data_1olh_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 1olh _Structure_validation_residue.Date_analyzed 2016-10-06 loop_ _Residue_analysis_software.Software_ID _Residue_analysis_software.Software_label _Residue_analysis_software.Method_ID _Residue_analysis_software.Method_label _Residue_analysis_software.Entry_ID _Residue_analysis_software.Structure_validation_oneline_list_ID 1 MolProbity . . ? 1 2 CYRANGE . . ? 1 stop_ loop_ _Residue_analysis.ID _Residue_analysis.PDB_model_num _Residue_analysis.Hydrogen_positions _Residue_analysis.MolProbity_flips _Residue_analysis.Cyrange_core_flag _Residue_analysis.Two_letter_chain_ID _Residue_analysis.PDB_strand_ID _Residue_analysis.PDB_residue_no _Residue_analysis.PDB_ins_code _Residue_analysis.PDB_residue_name _Residue_analysis.Assembly_ID _Residue_analysis.Entity_assembly_ID _Residue_analysis.Entity_ID _Residue_analysis.Comp_ID _Residue_analysis.Comp_index_ID _Residue_analysis.Clash_value _Residue_analysis.Clash_source_PDB_atom_name _Residue_analysis.Clash_destination_PDB_atom_name _Residue_analysis.Clash_destination_PDB_strand_ID _Residue_analysis.Clash_destination_PDB_residue_no _Residue_analysis.Clash_destination_PDB_ins_code _Residue_analysis.Clash_destination_PDB_residue_name _Residue_analysis.Cbeta_deviation_value _Residue_analysis.Rotamer_score _Residue_analysis.Rotamer_name _Residue_analysis.Ramachandran_phi _Residue_analysis.Ramachandran_psi _Residue_analysis.Ramachandran_score _Residue_analysis.Ramachandran_evaluation _Residue_analysis.Ramachandran_type _Residue_analysis.Bond_outlier_count _Residue_analysis.Worst_bond _Residue_analysis.Worst_bond_value _Residue_analysis.Worst_bond_sigma _Residue_analysis.Angle_outlier_count _Residue_analysis.Worst_angle _Residue_analysis.Worst_angle_value _Residue_analysis.Worst_angle_sigma _Residue_analysis.RNA_phosphate_perpendicular_outlier _Residue_analysis.RNA_suitness_score _Residue_analysis.RNA_suite_conformer _Residue_analysis.RNA_suite_triage _Residue_analysis.Max_b_factor _Residue_analysis.Tau_angle _Residue_analysis.Omega_dihedral _Residue_analysis.Disulfide_chi1 _Residue_analysis.Disulfide_chi2 _Residue_analysis.Disulfide_chi3 _Residue_analysis.Disulfide_ss_angle _Residue_analysis.Disulfide_ss _Residue_analysis.Disulfide_ss_angle_prime _Residue_analysis.Disulfide_chi2prime _Residue_analysis.Disulfide_chi1prime _Residue_analysis.Outlier_count_separate_geometry _Residue_analysis.Outlier_count _Residue_analysis.Entry_ID _Residue_analysis.Structure_validation_residue_list_ID . 001 nuclear orig core ' A' A ' 326' ' ' GLU . . . . . . . . . . . . . 4.2 mm-40 . . . . . 0 N--CA 1.487 1.424 0 N-CA-C 109.235 -0.654 . . . . 2.13 109.235 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 327' ' ' TYR . . . . . . . . . . . . . 42.2 m-85 -147.31 96.28 2.68 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.248 -0.908 . . . . 1.0 109.437 -179.974 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 328' ' ' PHE . . . . . 0.572 ' CE2' ' HG3' ' C' ' 335' ' ' ARG . 56.8 m-85 -103.46 -160.34 0.77 Allowed 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.319 -0.863 . . . . 0.34 109.588 -179.759 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 329' ' ' THR . . . . . 0.447 ' HA ' ' O ' ' C' ' 330' ' ' LEU . 34.8 p -154.11 169.22 24.07 Favored 'General case' 0 N--CA 1.489 1.49 0 O-C-N 121.455 -0.778 . . . . 1.05 108.922 179.894 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 330' ' ' LEU . . . . . 0.469 ' O ' ' HA ' ' C' ' 329' ' ' THR . 24.4 tp -151.42 132.97 14.76 Favored 'General case' 0 N--CA 1.488 1.474 0 O-C-N 121.071 -1.018 . . . . 1.07 109.768 -179.717 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 331' ' ' GLN . . . . . . . . . . . . . 7.1 tp-100 -85.66 115.94 23.64 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.343 -0.848 . . . . 0.91 108.946 179.695 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 332' ' ' ILE . . . . . . . . . . . . . 75.0 mt -103.17 104.25 16.34 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.555 0 O-C-N 121.261 -0.899 . . . . 1.09 109.819 -179.714 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 333' ' ' ARG . . . . . 0.554 ' CG ' ' CE1' ' C' ' 327' ' ' TYR . 1.9 mpt_? -72.74 138.86 46.78 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.376 -0.828 . . . . 3.41 109.35 179.744 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 334' ' ' GLY . . . . . . . . . . . . . . . 91.25 130.21 4.69 Favored Glycine 0 N--CA 1.491 2.367 0 N-CA-C 109.573 -1.411 . . . . 0.4 109.573 179.868 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 335' ' ' ARG . . . . . 0.411 ' O ' ' HB3' ' A' ' 338' ' ' PHE . 57.5 ttt180 -79.36 -37.8 36.55 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.34 -1.094 . . . . 3.55 109.653 179.919 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 336' ' ' GLU . . . . . . . . . . . . . 5.0 mt-10 -58.0 -60.87 3.07 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.187 -0.946 . . . . 2.29 109.671 -179.863 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 337' ' ' ARG . . . . . . . . . . . . . 4.0 mtt180 -59.98 -28.58 67.8 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.232 -0.918 . . . . 3.64 109.603 -179.831 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 338' ' ' PHE . . . . . 0.411 ' HB3' ' O ' ' A' ' 335' ' ' ARG . 59.1 t80 -54.51 -60.24 3.62 Favored 'General case' 0 N--CA 1.489 1.494 0 O-C-N 121.175 -0.953 . . . . 0.41 109.477 -179.996 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 339' ' ' GLU . . . . . . . . . . . . . 5.8 mt-10 -51.36 -31.29 21.65 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.291 -0.881 . . . . 1.97 109.771 -179.917 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 340' ' ' MET . . . . . . . . . . . . . 27.7 ttp -64.19 -52.61 58.11 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.128 -0.982 . . . . 1.14 109.881 -179.703 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 341' ' ' PHE . . . . . . . . . . . . . 39.2 m-85 -61.79 -47.84 83.31 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.205 -0.935 . . . . 0.21 109.766 -179.623 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 342' ' ' ARG . . . . . . . . . . . . . 9.7 ttt180 -49.67 -40.21 39.16 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.21 -0.931 . . . . 3.15 109.779 -179.811 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 343' ' ' GLU . . . . . . . . . . . . . 4.3 tt0 -59.29 -49.7 76.84 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.196 -0.94 . . . . 2.35 109.8 -179.762 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 344' ' ' LEU . . . . . 0.427 HD21 ' CD2' ' B' ' 344' ' ' LEU . 45.4 mt -61.84 -31.47 71.73 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.148 -0.97 . . . . 1.06 109.569 -179.805 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 345' ' ' ASN . . . . . . . . . . . . . 15.9 t-20 -57.87 -57.87 10.87 Favored 'General case' 0 N--CA 1.489 1.477 0 O-C-N 121.229 -0.919 . . . . 1.36 109.53 -179.965 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 346' ' ' GLU . . . . . . . . . . . . . 37.3 tt0 -60.98 -29.06 69.46 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.296 -0.878 . . . . 1.65 109.628 -179.848 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 347' ' ' ALA . . . . . . . . . . . . . . . -59.45 -58.43 8.65 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.195 -0.941 . . . . 1.03 109.843 -179.83 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 348' ' ' LEU . . . . . 0.504 ' N ' HD23 ' A' ' 348' ' ' LEU . 4.2 mm? -61.52 -38.73 88.45 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.282 -0.887 . . . . 1.04 109.71 -179.671 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 349' ' ' GLU . . . . . . . . . . . . . 9.2 mt-10 -57.83 -38.31 75.41 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.337 -0.852 . . . . 1.94 110.063 -179.57 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 350' ' ' LEU . . . . . 0.527 ' CD1' HD21 ' B' ' 350' ' ' LEU . 6.1 tt -62.75 -48.74 77.88 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.165 -0.96 . . . . 1.17 109.73 -179.755 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 351' ' ' LYS . . . . . . . . . . . . . 5.8 tttt -59.33 -36.92 76.55 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.221 -0.924 . . . . 1.97 109.471 -179.808 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 352' ' ' ASP . . . . . 0.403 ' OD1' ' CZ ' ' C' ' 337' ' ' ARG . 55.3 m-20 -56.36 -42.3 77.57 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.254 -0.904 . . . . 1.16 109.709 -179.974 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 353' ' ' ALA . . . . . . . . . . . . . . . -67.62 -23.02 65.32 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.271 -0.893 . . . . 1.22 109.93 -179.573 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 354' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.491 1.602 0 O-C-N 121.185 -0.947 . . . . 1.71 109.746 -179.736 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 326' ' ' GLU . . . . . . . . . . . . . 4.1 mm-40 . . . . . 0 N--CA 1.489 1.514 0 N-CA-C 109.208 -0.664 . . . . 2.13 109.208 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' B' B ' 327' ' ' TYR . . . . . 0.588 ' CE2' ' CG ' ' D' ' 333' ' ' ARG . 42.3 m-85 -147.55 96.1 2.63 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.322 -0.861 . . . . 0.99 109.426 179.986 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 328' ' ' PHE . . . . . . . . . . . . . 58.1 m-85 -103.27 -160.2 0.76 Allowed 'General case' 0 N--CA 1.489 1.482 0 O-C-N 121.323 -0.861 . . . . 0.36 109.57 -179.841 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 329' ' ' THR . . . . . . . . . . . . . 35.4 p -154.18 169.2 24.17 Favored 'General case' 0 N--CA 1.489 1.482 0 O-C-N 121.354 -0.841 . . . . 1.05 108.987 179.825 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 330' ' ' LEU . . . . . . . . . . . . . 25.0 tp -151.34 133.04 14.89 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.084 -1.01 . . . . 1.07 109.735 -179.765 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 331' ' ' GLN . . . . . . . . . . . . . 7.1 tp-100 -85.65 116.1 23.73 Favored 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.283 -0.885 . . . . 0.91 108.999 179.546 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 332' ' ' ILE . . . . . . . . . . . . . 75.3 mt -103.44 104.3 16.46 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.523 0 O-C-N 121.258 -0.901 . . . . 1.08 109.761 -179.669 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 333' ' ' ARG . . . . . 0.527 ' CG ' ' CE2' ' D' ' 327' ' ' TYR . 1.9 mpt_? -72.87 139.05 46.66 Favored 'General case' 0 N--CA 1.489 1.493 0 O-C-N 121.271 -0.893 . . . . 3.42 109.352 179.737 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 334' ' ' GLY . . . . . . . . . . . . . . . 91.24 129.89 4.58 Favored Glycine 0 N--CA 1.489 2.206 0 N-CA-C 109.679 -1.369 . . . . 0.4 109.679 179.906 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 335' ' ' ARG . . . . . 0.406 ' O ' ' HB3' ' B' ' 338' ' ' PHE . 57.5 ttt180 -79.15 -37.88 37.37 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.34 -1.094 . . . . 3.55 109.581 -179.955 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 336' ' ' GLU . . . . . . . . . . . . . 5.0 mt-10 -57.95 -60.81 3.14 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.348 -0.845 . . . . 2.28 109.719 -179.823 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 337' ' ' ARG . . . . . 0.511 ' CZ ' ' OD1' ' D' ' 352' ' ' ASP . 4.0 mtt180 -60.02 -28.53 67.81 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.188 -0.945 . . . . 3.64 109.641 -179.806 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 338' ' ' PHE . . . . . 0.406 ' HB3' ' O ' ' B' ' 335' ' ' ARG . 59.4 t80 -54.42 -60.41 3.38 Favored 'General case' 0 N--CA 1.488 1.458 0 O-C-N 121.184 -0.948 . . . . 0.39 109.397 179.969 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 339' ' ' GLU . . . . . . . . . . . . . 5.7 mt-10 -51.31 -31.23 20.88 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.248 -0.907 . . . . 1.98 109.781 -179.88 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 340' ' ' MET . . . . . . . . . . . . . 27.5 ttp -64.19 -52.64 57.92 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.221 -0.924 . . . . 1.14 109.982 -179.711 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 341' ' ' PHE . . . . . . . . . . . . . 39.1 m-85 -61.72 -47.87 83.3 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.103 -0.998 . . . . 0.22 109.78 -179.694 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 342' ' ' ARG . . . . . . . . . . . . . 9.8 ttt180 -49.62 -40.16 38.28 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.294 -0.879 . . . . 3.15 109.828 -179.846 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 343' ' ' GLU . . . . . . . . . . . . . 4.2 tt0 -59.36 -49.64 77.04 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.227 -0.92 . . . . 2.35 109.742 -179.745 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 344' ' ' LEU . . . . . 0.427 ' CD2' HD21 ' A' ' 344' ' ' LEU . 45.4 mt -61.88 -31.56 71.85 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.234 -0.916 . . . . 1.05 109.597 -179.788 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 345' ' ' ASN . . . . . . . . . . . . . 16.7 t-20 -57.64 -58.0 10.26 Favored 'General case' 0 N--CA 1.489 1.483 0 O-C-N 121.235 -0.916 . . . . 1.35 109.571 179.956 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 346' ' ' GLU . . . . . . . . . . . . . 36.8 tt0 -60.84 -29.35 69.45 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.354 -0.841 . . . . 1.66 109.658 -179.901 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 347' ' ' ALA . . . . . . . . . . . . . . . -59.29 -58.41 8.76 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.24 -0.912 . . . . 1.02 109.891 -179.774 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 348' ' ' LEU . . . . . 0.511 ' N ' HD23 ' B' ' 348' ' ' LEU . 4.1 mm? -61.5 -38.68 88.22 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.19 -0.944 . . . . 1.05 109.737 -179.737 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 349' ' ' GLU . . . . . . . . . . . . . 9.3 mt-10 -57.86 -38.42 75.67 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.247 -0.908 . . . . 1.95 110.074 -179.539 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 350' ' ' LEU . . . . . 0.527 HD21 ' CD1' ' A' ' 350' ' ' LEU . 6.1 tt -62.69 -48.82 77.64 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.197 -0.94 . . . . 1.18 109.659 -179.705 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 351' ' ' LYS . . . . . . . . . . . . . 5.8 tttt -59.26 -36.92 76.38 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.115 -0.99 . . . . 1.96 109.525 -179.847 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 352' ' ' ASP . . . . . . . . . . . . . 55.4 m-20 -56.33 -42.34 77.53 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.26 -0.9 . . . . 1.16 109.668 -179.96 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 353' ' ' ALA . . . . . . . . . . . . . . . -67.6 -23.22 65.36 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.217 -0.927 . . . . 1.21 109.868 -179.504 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 354' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.491 1.598 0 O-C-N 121.194 -0.941 . . . . 1.69 109.812 -179.86 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 326' ' ' GLU . . . . . . . . . . . . . 3.2 mm-40 . . . . . 0 N--CA 1.489 1.517 0 N-CA-C 109.47 -0.567 . . . . 2.17 109.47 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' C' C ' 327' ' ' TYR . . . . . 0.554 ' CE1' ' CG ' ' A' ' 333' ' ' ARG . 49.3 m-85 -149.05 101.71 3.18 Favored 'General case' 0 N--CA 1.488 1.46 0 O-C-N 121.333 -0.854 . . . . 1.03 109.505 179.891 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' C' C ' 328' ' ' PHE . . . . . . . . . . . . . 63.9 m-85 -103.15 -165.85 1.21 Allowed 'General case' 0 N--CA 1.488 1.472 0 O-C-N 121.381 -0.824 . . . . 0.37 109.129 179.985 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 329' ' ' THR . . . . . 0.469 ' HA ' ' O ' ' A' ' 330' ' ' LEU . 43.1 p -150.71 167.04 28.57 Favored 'General case' 0 N--CA 1.488 1.468 0 O-C-N 121.204 -0.935 . . . . 1.04 109.353 -179.952 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' C' C ' 330' ' ' LEU . . . . . 0.447 ' O ' ' HA ' ' A' ' 329' ' ' THR . 17.7 tp -150.67 125.94 10.03 Favored 'General case' 0 C--N 1.303 -1.451 0 O-C-N 121.184 -0.948 . . . . 1.09 109.939 -179.585 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' C' C ' 331' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -87.0 110.29 19.96 Favored 'General case' 0 N--CA 1.488 1.433 0 N-CA-C 108.554 -0.906 . . . . 1.48 108.554 179.236 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' C' C ' 332' ' ' ILE . . . . . 0.436 HD12 ' CD2' ' C' ' 341' ' ' PHE . 51.5 mt -100.87 111.44 30.56 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.521 0 O-C-N 121.232 -0.917 . . . . 1.08 109.622 -179.382 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' C' C ' 333' ' ' ARG . . . . . 0.493 ' NH1' ' HG2' ' C' ' 333' ' ' ARG . 0.0 OUTLIER -72.71 153.07 41.34 Favored 'General case' 0 C--N 1.304 -1.374 0 O-C-N 121.395 -0.815 . . . . 3.36 109.421 179.848 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' C' C ' 334' ' ' GLY . . . . . . . . . . . . . . . 73.97 118.67 0.08 OUTLIER Glycine 0 N--CA 1.491 2.323 0 N-CA-C 109.464 -1.455 . . . . 0.35 109.464 -179.933 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 335' ' ' ARG . . . . . 0.572 ' HG3' ' CE2' ' A' ' 328' ' ' PHE . 4.6 ttt-85 -69.76 -30.39 67.96 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.251 -1.147 . . . . 3.23 109.611 -179.826 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' C' C ' 336' ' ' GLU . . . . . . . . . . . . . 4.2 tt0 -57.89 -62.92 1.46 Allowed 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.134 -0.979 . . . . 2.62 109.552 -179.828 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 337' ' ' ARG . . . . . 0.403 ' CZ ' ' OD1' ' A' ' 352' ' ' ASP . 2.3 mpt_? -60.5 -27.1 67.32 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.217 -0.927 . . . . 3.61 109.588 -179.918 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' C' C ' 338' ' ' PHE . . . . . 0.452 ' HB3' ' O ' ' C' ' 335' ' ' ARG . 61.2 t80 -54.58 -59.33 4.84 Favored 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.259 -0.901 . . . . 0.43 109.536 -179.903 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' C' C ' 339' ' ' GLU . . . . . . . . . . . . . 1.5 mt-10 -52.56 -34.13 48.91 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.326 -0.859 . . . . 2.05 109.884 -179.917 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 340' ' ' MET . . . . . . . . . . . . . 38.5 ttp -62.85 -49.98 72.76 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.194 -0.942 . . . . 1.1 109.901 -179.558 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 341' ' ' PHE . . . . . 0.436 ' CD2' HD12 ' C' ' 332' ' ' ILE . 41.6 m-85 -62.59 -41.81 99.19 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.191 -0.943 . . . . 0.21 109.724 -179.826 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' C' C ' 342' ' ' ARG . . . . . 0.444 ' CG ' ' NH1' ' C' ' 342' ' ' ARG . 0.0 OUTLIER -50.94 -43.68 60.23 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.323 -0.861 . . . . 3.42 109.922 -179.83 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' C' C ' 343' ' ' GLU . . . . . . . . . . . . . 3.3 tp10 -58.53 -45.72 88.27 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.166 -0.959 . . . . 2.14 109.725 -179.599 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 344' ' ' LEU . . . . . 0.434 ' O ' HD21 ' C' ' 348' ' ' LEU . 81.0 mt -61.76 -37.63 85.01 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.18 -0.95 . . . . 1.09 109.499 -179.809 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' C' C ' 345' ' ' ASN . . . . . 0.425 ' O ' ' HG3' ' C' ' 349' ' ' GLU . 16.9 t-20 -58.74 -54.18 50.01 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.232 -0.917 . . . . 1.38 109.567 179.929 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' C' C ' 346' ' ' GLU . . . . . . . . . . . . . 1.3 tm-20 -60.3 -32.12 70.91 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.283 -0.886 . . . . 2.21 109.792 -179.661 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 347' ' ' ALA . . . . . . . . . . . . . . . -59.44 -60.55 3.68 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.142 -0.974 . . . . 1.03 109.828 -179.856 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 348' ' ' LEU . . . . . 0.483 ' N ' ' CD2' ' C' ' 348' ' ' LEU . 4.0 mm? -61.05 -31.57 71.22 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.2 -0.938 . . . . 1.06 109.453 -179.836 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' C' C ' 349' ' ' GLU . . . . . 0.425 ' HG3' ' O ' ' C' ' 345' ' ' ASN . 7.6 mt-10 -59.46 -48.4 81.8 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.247 -0.908 . . . . 2.19 110.013 -179.644 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' C' C ' 350' ' ' LEU . . . . . 0.534 HD21 ' CD1' ' D' ' 350' ' ' LEU . 6.6 tt -62.83 -38.56 91.25 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.069 -1.019 . . . . 1.2 109.73 -179.623 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' C' C ' 351' ' ' LYS . . . . . . . . . . . . . 20.8 ttmt -58.08 -46.7 85.04 Favored 'General case' 0 N--CA 1.487 1.42 0 O-C-N 121.138 -0.976 . . . . 1.92 109.204 179.921 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 352' ' ' ASP . . . . . . . . . . . . . 3.4 m-20 -56.71 -41.21 77.01 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.261 -0.899 . . . . 1.19 109.576 179.863 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 353' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 1.646 0 O-C-N 121.29 -0.881 . . . . 1.15 109.805 -179.647 . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' D' D ' 326' ' ' GLU . . . . . . . . . . . . . 4.2 mm-40 . . . . . 0 N--CA 1.489 1.509 0 N-CA-C 109.214 -0.662 . . . . 2.13 109.214 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' D' D ' 327' ' ' TYR . . . . . 0.527 ' CE2' ' CG ' ' B' ' 333' ' ' ARG . 42.1 m-85 -147.38 96.04 2.64 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.299 -0.875 . . . . 1.0 109.396 -179.967 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' D' D ' 328' ' ' PHE . . . . . . . . . . . . . 58.1 m-85 -103.27 -160.35 0.77 Allowed 'General case' 0 N--CA 1.489 1.48 0 O-C-N 121.395 -0.816 . . . . 0.34 109.639 -179.842 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' D' D ' 329' ' ' THR . . . . . . . . . . . . . 35.7 p -154.1 169.24 24.02 Favored 'General case' 0 N--CA 1.489 1.477 0 O-C-N 121.355 -0.841 . . . . 1.05 108.95 179.869 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' D' D ' 330' ' ' LEU . . . . . . . . . . . . . 24.9 tp -151.4 133.09 14.87 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.206 -0.934 . . . . 1.07 109.796 -179.692 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' D' D ' 331' ' ' GLN . . . . . . . . . . . . . 7.1 tp-100 -85.82 115.96 23.78 Favored 'General case' 0 N--CA 1.489 1.494 0 O-C-N 121.325 -0.859 . . . . 0.93 109.037 179.646 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' D' D ' 332' ' ' ILE . . . . . . . . . . . . . 75.3 mt -103.35 104.42 16.62 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.558 0 O-C-N 121.166 -0.959 . . . . 1.07 109.8 -179.603 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' D' D ' 333' ' ' ARG . . . . . 0.588 ' CG ' ' CE2' ' B' ' 327' ' ' TYR . 2.0 mpt_? -72.73 138.82 46.78 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.294 -0.879 . . . . 3.42 109.36 179.738 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' D' D ' 334' ' ' GLY . . . . . . . . . . . . . . . 91.31 129.9 4.61 Favored Glycine 0 N--CA 1.491 2.313 0 N-CA-C 109.645 -1.382 . . . . 0.41 109.645 179.838 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' D' D ' 335' ' ' ARG . . . . . 0.4 ' O ' ' HB3' ' D' ' 338' ' ' PHE . 57.6 ttt180 -79.12 -37.9 37.48 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.36 -1.082 . . . . 3.58 109.57 -179.957 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' D' D ' 336' ' ' GLU . . . . . . . . . . . . . 5.1 mt-10 -57.9 -60.94 2.95 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.292 -0.88 . . . . 2.26 109.774 -179.86 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' D' D ' 337' ' ' ARG . . . . . . . . . . . . . 4.0 mtt180 -59.96 -28.43 67.64 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.15 -0.968 . . . . 3.64 109.693 -179.908 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' D' D ' 338' ' ' PHE . . . . . 0.4 ' HB3' ' O ' ' D' ' 335' ' ' ARG . 59.5 t80 -54.56 -60.19 3.69 Favored 'General case' 0 N--CA 1.488 1.464 0 O-C-N 121.244 -0.91 . . . . 0.4 109.486 179.991 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' D' D ' 339' ' ' GLU . . . . . . . . . . . . . 5.7 mt-10 -51.35 -31.27 21.46 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.191 -0.943 . . . . 1.99 109.76 -179.951 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' D' D ' 340' ' ' MET . . . . . . . . . . . . . 27.4 ttp -64.18 -52.69 57.72 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.286 -0.884 . . . . 1.13 109.964 -179.715 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' D' D ' 341' ' ' PHE . . . . . . . . . . . . . 38.9 m-85 -61.83 -47.72 83.8 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.138 -0.976 . . . . 0.21 109.794 -179.638 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' D' D ' 342' ' ' ARG . . . . . . . . . . . . . 9.8 ttt180 -49.7 -40.12 39.23 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.21 -0.931 . . . . 3.15 109.85 -179.864 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' D' D ' 343' ' ' GLU . . . . . . . . . . . . . 4.2 tt0 -59.32 -49.81 76.41 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.147 -0.971 . . . . 2.35 109.742 -179.76 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' D' D ' 344' ' ' LEU . . . . . 0.421 ' O ' HD21 ' D' ' 348' ' ' LEU . 45.2 mt -61.85 -31.34 71.59 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.276 -0.89 . . . . 1.06 109.616 -179.787 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' D' D ' 345' ' ' ASN . . . . . . . . . . . . . 16.3 t-20 -57.88 -57.81 11.14 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.279 -0.888 . . . . 1.35 109.526 -179.978 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' D' D ' 346' ' ' GLU . . . . . . . . . . . . . 36.6 tt0 -61.03 -29.2 69.58 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.43 -0.794 . . . . 1.69 109.682 -179.878 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' D' D ' 347' ' ' ALA . . . . . . . . . . . . . . . -59.36 -58.35 9.0 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.239 -0.913 . . . . 1.03 109.827 -179.827 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' D' D ' 348' ' ' LEU . . . . . 0.506 ' N ' HD23 ' D' ' 348' ' ' LEU . 4.1 mm? -61.65 -38.55 88.13 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.271 -0.893 . . . . 1.04 109.772 -179.656 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' D' D ' 349' ' ' GLU . . . . . . . . . . . . . 9.3 mt-10 -58.02 -38.33 76.0 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.228 -0.92 . . . . 1.95 110.013 -179.588 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' D' D ' 350' ' ' LEU . . . . . 0.534 ' CD1' HD21 ' C' ' 350' ' ' LEU . 6.1 tt -62.7 -48.83 77.57 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.11 -0.994 . . . . 1.16 109.697 -179.757 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' D' D ' 351' ' ' LYS . . . . . . . . . . . . . 5.9 tttt -59.21 -36.86 76.14 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.14 -0.975 . . . . 1.97 109.6 -179.895 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' D' D ' 352' ' ' ASP . . . . . 0.511 ' OD1' ' CZ ' ' B' ' 337' ' ' ARG . 55.5 m-20 -56.47 -42.33 78.05 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.332 -0.855 . . . . 1.17 109.664 -179.972 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' D' D ' 353' ' ' ALA . . . . . . . . . . . . . . . -67.59 -23.07 65.35 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.219 -0.925 . . . . 1.21 109.913 -179.598 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' D' D ' 354' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.491 1.59 0 O-C-N 121.048 -1.033 . . . . 1.68 109.762 -179.844 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 326' ' ' GLU . . . . . 0.427 ' O ' ' CD1' ' A' ' 327' ' ' TYR . 70.0 mm-40 . . . . . 0 N--CA 1.49 1.566 0 CA-C-O 121.388 0.614 . . . . 2.13 109.579 . . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 327' ' ' TYR . . . . . 0.582 ' CE2' ' HG2' ' C' ' 333' ' ' ARG . 46.6 m-85 -149.54 110.15 4.26 Favored 'General case' 0 N--CA 1.487 1.42 0 O-C-N 121.484 -0.76 . . . . 1.0 109.0 179.573 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 328' ' ' PHE . . . . . 0.403 ' CZ ' ' HD3' ' C' ' 335' ' ' ARG . 54.8 m-85 -112.22 -167.99 1.26 Allowed 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.185 -0.947 . . . . 0.34 109.602 -179.696 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 329' ' ' THR . . . . . . . . . . . . . 53.3 p -152.06 164.81 36.46 Favored 'General case' 0 N--CA 1.488 1.457 0 O-C-N 121.416 -0.802 . . . . 1.05 108.973 -179.878 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 330' ' ' LEU . . . . . 0.428 ' O ' ' HA ' ' C' ' 329' ' ' THR . 19.1 tp -151.2 131.22 13.41 Favored 'General case' 0 C--N 1.301 -1.507 0 O-C-N 121.127 -0.983 . . . . 1.07 109.769 -179.606 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 331' ' ' GLN . . . . . . . . . . . . . 1.4 tt0 -85.37 116.49 23.73 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.223 -0.923 . . . . 0.91 108.989 179.524 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 332' ' ' ILE . . . . . . . . . . . . . 86.3 mt -101.52 103.44 14.91 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.53 0 O-C-N 121.281 -0.887 . . . . 1.09 109.742 -179.619 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 333' ' ' ARG . . . . . 0.577 ' HG3' ' CD1' ' C' ' 327' ' ' TYR . 3.7 mpt_? -70.27 149.42 47.44 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.238 -0.914 . . . . 3.41 109.199 179.632 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 334' ' ' GLY . . . . . . . . . . . . . . . 78.29 125.37 0.37 Allowed Glycine 0 N--CA 1.49 2.294 0 N-CA-C 109.6 -1.4 . . . . 0.4 109.6 -179.799 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 335' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -74.62 -36.02 62.93 Favored 'General case' 0 N--CA 1.489 1.494 0 O-C-N 121.36 -1.082 . . . . 3.55 109.546 179.956 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 336' ' ' GLU . . . . . . . . . . . . . 27.8 mt-10 -57.77 -58.95 6.1 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.149 -0.969 . . . . 2.29 109.739 -179.562 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 337' ' ' ARG . . . . . . . . . . . . . 15.8 mmt180 -60.77 -28.92 69.1 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.222 -0.924 . . . . 3.64 110.178 -179.573 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 338' ' ' PHE . . . . . . . . . . . . . 41.8 t80 -57.31 -58.88 6.33 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.087 -1.008 . . . . 0.41 110.126 -179.655 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 339' ' ' GLU . . . . . . . . . . . . . 3.5 mt-10 -52.07 -33.91 41.35 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.132 -0.98 . . . . 1.97 110.165 -179.399 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 340' ' ' MET . . . . . 0.4 ' HE2' ' HG ' ' C' ' 348' ' ' LEU . 32.8 ttp -63.72 -49.94 71.1 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.21 -0.931 . . . . 1.14 109.965 -179.577 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 341' ' ' PHE . . . . . 0.509 ' CZ ' ' HA ' ' C' ' 345' ' ' ASN . 35.6 m-85 -62.14 -44.1 97.37 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.117 -0.99 . . . . 0.21 110.038 -179.646 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 342' ' ' ARG . . . . . 0.495 ' HG2' ' NH1' ' A' ' 342' ' ' ARG . 0.1 OUTLIER -48.98 -45.48 42.29 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.236 -0.915 . . . . 3.15 110.118 -179.537 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 343' ' ' GLU . . . . . . . . . . . . . 5.4 tt0 -57.83 -47.9 81.3 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.28 -0.888 . . . . 2.35 109.977 -179.606 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 344' ' ' LEU . . . . . 0.453 ' O ' ' HB1' ' A' ' 347' ' ' ALA . 50.0 mt -61.36 -32.05 71.95 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.055 -1.028 . . . . 1.06 109.734 -179.715 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 345' ' ' ASN . . . . . 0.453 ' HA ' ' CZ ' ' C' ' 341' ' ' PHE . 17.0 t-20 -56.81 -60.73 3.13 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.326 -0.858 . . . . 1.36 109.752 -179.783 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 346' ' ' GLU . . . . . . . . . . . . . 4.3 tt0 -61.19 -24.41 66.3 Favored 'General case' 0 N--CA 1.488 1.438 0 O-C-N 121.269 -0.895 . . . . 1.65 109.785 -179.801 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 347' ' ' ALA . . . . . 0.457 ' HB2' ' HB2' ' B' ' 347' ' ' ALA . . . -60.34 -61.76 2.37 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.213 -0.929 . . . . 1.03 110.097 -179.728 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 348' ' ' LEU . . . . . 0.437 HD13 ' NH1' ' C' ' 337' ' ' ARG . 3.5 mm? -61.52 -47.43 85.63 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.165 -0.96 . . . . 1.04 109.857 -179.455 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 349' ' ' GLU . . . . . . . . . . . . . 3.3 mm-40 -56.21 -30.6 62.53 Favored 'General case' 0 C--N 1.301 -1.539 0 O-C-N 121.17 -0.956 . . . . 1.94 109.87 -179.307 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 350' ' ' LEU . . . . . 0.475 HD23 HD23 ' B' ' 350' ' ' LEU . 4.0 tt -65.1 -45.1 86.58 Favored 'General case' 0 N--CA 1.488 1.463 0 O-C-N 121.217 -0.927 . . . . 1.17 109.621 -179.743 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 351' ' ' LYS . . . . . . . . . . . . . 28.5 tttt -59.94 -50.72 72.64 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.263 -0.898 . . . . 1.97 109.587 -179.836 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 352' ' ' ASP . . . . . . . . . . . . . 66.0 m-20 -55.8 -37.56 68.77 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.153 -0.967 . . . . 1.16 109.689 -179.848 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 353' ' ' ALA . . . . . . . . . . . . . . . -65.36 -35.65 81.6 Favored 'General case' 0 N--CA 1.488 1.467 0 O-C-N 121.269 -0.894 . . . . 1.22 109.492 -179.834 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 354' ' ' GLN . . . . . . . . . . . . . 3.7 tt0 . . . . . 0 N--CA 1.489 1.516 0 O-C-N 121.287 -0.883 . . . . 1.71 109.353 179.839 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' B' B ' 326' ' ' GLU . . . . . 0.422 ' O ' ' CD1' ' B' ' 327' ' ' TYR . 70.8 mm-40 . . . . . 0 N--CA 1.491 1.582 0 CA-C-O 121.308 0.575 . . . . 2.13 109.535 . . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 327' ' ' TYR . . . . . 0.566 ' CE2' ' HG3' ' D' ' 333' ' ' ARG . 45.8 m-85 -150.15 109.46 3.96 Favored 'General case' 0 N--CA 1.487 1.421 0 O-C-N 121.274 -0.891 . . . . 0.99 108.851 179.769 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 328' ' ' PHE . . . . . 0.423 ' HB2' ' CD1' ' D' ' 338' ' ' PHE . 53.0 m-85 -111.84 -167.44 1.18 Allowed 'General case' 0 N--CA 1.488 1.473 0 O-C-N 121.326 -0.859 . . . . 0.36 109.666 -179.635 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 329' ' ' THR . . . . . . . . . . . . . 59.1 p -152.28 163.64 39.04 Favored 'General case' 0 C--N 1.302 -1.477 0 O-C-N 121.389 -0.82 . . . . 1.05 109.144 -179.889 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 330' ' ' LEU . . . . . . . . . . . . . 17.3 tp -150.12 131.68 14.84 Favored 'General case' 0 N--CA 1.488 1.46 0 O-C-N 121.166 -0.958 . . . . 1.07 109.743 -179.84 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 331' ' ' GLN . . . . . . . . . . . . . 1.4 tt0 -85.77 116.78 24.24 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.373 -0.829 . . . . 0.91 108.906 179.587 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 332' ' ' ILE . . . . . . . . . . . . . 85.1 mt -101.97 104.04 15.83 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.489 0 O-C-N 121.207 -0.933 . . . . 1.08 109.513 -179.573 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 333' ' ' ARG . . . . . 0.508 ' CG ' ' CE2' ' D' ' 327' ' ' TYR . 4.1 mpt_? -71.21 150.48 45.27 Favored 'General case' 0 C--N 1.305 -1.365 0 O-C-N 121.255 -0.903 . . . . 3.42 109.011 179.746 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 334' ' ' GLY . . . . . . . . . . . . . . . 77.58 126.17 0.33 Allowed Glycine 0 N--CA 1.489 2.175 0 N-CA-C 109.388 -1.485 . . . . 0.4 109.388 -179.986 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 335' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -75.22 -36.91 61.32 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.413 -1.051 . . . . 3.55 109.608 -179.727 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 336' ' ' GLU . . . . . . . . . . . . . 38.7 mt-10 -56.96 -57.49 12.29 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.39 -0.819 . . . . 2.28 110.069 -179.593 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 337' ' ' ARG . . . . . . . . . . . . . 17.0 mmt180 -62.38 -29.24 70.34 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.229 -0.919 . . . . 3.64 109.877 -179.635 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 338' ' ' PHE . . . . . . . . . . . . . 44.5 t80 -56.57 -59.94 4.27 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.26 -0.9 . . . . 0.39 110.121 -179.692 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 339' ' ' GLU . . . . . . . . . . . . . 4.2 mt-10 -51.98 -33.44 38.0 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.238 -0.914 . . . . 1.98 110.102 -179.347 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 340' ' ' MET . . . . . . . . . . . . . 31.8 ttp -63.89 -49.68 71.74 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.066 -1.021 . . . . 1.14 109.822 -179.578 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 341' ' ' PHE . . . . . . . . . . . . . 35.4 m-85 -62.31 -44.28 96.87 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.163 -0.961 . . . . 0.22 110.04 -179.54 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 342' ' ' ARG . . . . . 0.491 ' NH1' ' HG2' ' B' ' 342' ' ' ARG . 0.1 OUTLIER -49.33 -44.62 44.58 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.283 -0.886 . . . . 3.15 110.096 -179.576 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' B' B ' 343' ' ' GLU . . . . . . . . . . . . . 4.6 tt0 -58.18 -47.27 83.92 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.196 -0.94 . . . . 2.35 109.914 -179.393 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 344' ' ' LEU . . . . . 0.435 ' O ' ' HB1' ' B' ' 347' ' ' ALA . 50.3 mt -62.11 -31.68 72.16 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.309 -0.87 . . . . 1.05 109.954 -179.825 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 345' ' ' ASN . . . . . 0.48 ' HA ' ' CZ ' ' D' ' 341' ' ' PHE . 17.0 t-20 -57.43 -60.48 3.58 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.232 -0.918 . . . . 1.35 109.849 -179.683 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 346' ' ' GLU . . . . . . . . . . . . . 4.0 tt0 -61.1 -24.61 66.37 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.304 -0.872 . . . . 1.66 109.791 -179.655 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 347' ' ' ALA . . . . . 0.457 ' HB2' ' HB2' ' A' ' 347' ' ' ALA . . . -60.18 -61.86 2.29 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.147 -0.971 . . . . 1.02 110.016 -179.7 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 348' ' ' LEU . . . . . 0.427 ' N ' HD23 ' B' ' 348' ' ' LEU . 3.5 mm? -61.3 -47.73 84.61 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.234 -0.916 . . . . 1.05 109.917 -179.418 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 349' ' ' GLU . . . . . . . . . . . . . 3.6 mm-40 -56.25 -30.3 62.21 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.174 -0.954 . . . . 1.95 109.825 -179.383 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 350' ' ' LEU . . . . . 0.475 HD23 HD23 ' A' ' 350' ' ' LEU . 4.2 tt -65.17 -45.95 82.79 Favored 'General case' 0 N--CA 1.489 1.492 0 O-C-N 121.116 -0.99 . . . . 1.18 109.328 179.912 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 351' ' ' LYS . . . . . . . . . . . . . 29.3 tttt -59.33 -51.5 69.69 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.233 -0.917 . . . . 1.96 109.646 -179.898 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 352' ' ' ASP . . . . . . . . . . . . . 67.3 m-20 -55.35 -37.62 67.72 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.236 -0.915 . . . . 1.16 109.748 -179.757 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 353' ' ' ALA . . . . . . . . . . . . . . . -65.68 -34.94 79.37 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.377 -0.827 . . . . 1.21 109.403 -179.581 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 354' ' ' GLN . . . . . . . . . . . . . 4.1 tt0 . . . . . 0 N--CA 1.487 1.421 0 O-C-N 121.201 -0.937 . . . . 1.69 109.225 179.775 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' C' C ' 326' ' ' GLU . . . . . . . . . . . . . 3.0 mm-40 . . . . . 0 N--CA 1.487 1.389 0 N-CA-C 108.972 -0.751 . . . . 2.17 108.972 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' C' C ' 327' ' ' TYR . . . . . 0.577 ' CD1' ' HG3' ' A' ' 333' ' ' ARG . 42.2 m-85 -146.82 100.54 3.33 Favored 'General case' 0 C--N 1.302 -1.5 0 O-C-N 121.238 -0.914 . . . . 1.03 108.973 -179.885 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' C' C ' 328' ' ' PHE . . . . . . . . . . . . . 87.6 m-85 -103.2 -166.41 1.27 Allowed 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.278 -0.889 . . . . 0.37 109.711 -179.449 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 329' ' ' THR . . . . . 0.428 ' HA ' ' O ' ' A' ' 330' ' ' LEU . 24.7 p -152.97 161.44 42.53 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.413 -0.804 . . . . 1.04 109.014 -179.865 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' C' C ' 330' ' ' LEU . . . . . . . . . . . . . 17.2 tp -149.95 133.42 16.57 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.158 -0.963 . . . . 1.09 109.508 -179.525 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 331' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -87.72 116.22 25.7 Favored 'General case' 0 N--CA 1.488 1.47 0 O-C-N 121.352 -0.843 . . . . 1.48 109.36 179.802 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' C' C ' 332' ' ' ILE . . . . . 0.477 HG23 ' HA ' ' C' ' 338' ' ' PHE . 15.1 mt -104.24 104.76 17.3 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.68 0 O-C-N 121.247 -0.908 . . . . 1.08 109.607 179.961 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' C' C ' 333' ' ' ARG . . . . . 0.582 ' HG2' ' CE2' ' A' ' 327' ' ' TYR . 0.7 OUTLIER -73.04 143.38 47.52 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.392 -0.817 . . . . 3.36 109.423 179.582 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' C' C ' 334' ' ' GLY . . . . . . . . . . . . . . . 80.63 131.61 1.06 Allowed Glycine 0 N--CA 1.495 2.623 0 N-CA-C 109.722 -1.351 . . . . 0.35 109.722 179.848 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 335' ' ' ARG . . . . . 0.535 ' HG2' ' NH1' ' C' ' 335' ' ' ARG . 0.0 OUTLIER -79.48 -32.75 42.58 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.241 -1.152 . . . . 3.23 109.725 179.975 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' C' C ' 336' ' ' GLU . . . . . . . . . . . . . 49.2 mt-10 -55.55 -61.97 2.0 Allowed 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.238 -0.914 . . . . 2.62 109.208 -179.737 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 337' ' ' ARG . . . . . 0.437 ' NH1' HD13 ' A' ' 348' ' ' LEU . 30.5 mmt180 -61.98 -28.56 69.65 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.192 -0.942 . . . . 3.61 109.493 179.737 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' C' C ' 338' ' ' PHE . . . . . 0.477 ' HA ' HG23 ' C' ' 332' ' ' ILE . 86.4 t80 -54.94 -61.22 2.46 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.361 -0.837 . . . . 0.43 110.135 -179.552 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' C' C ' 339' ' ' GLU . . . . . . . . . . . . . 50.1 mt-10 -51.2 -34.2 30.86 Favored 'General case' 0 N--CA 1.495 1.787 0 O-C-N 121.257 -0.902 . . . . 2.05 109.777 -179.836 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 340' ' ' MET . . . . . . . . . . . . . 33.0 ttp -62.66 -50.77 69.89 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.316 -0.865 . . . . 1.1 109.791 -179.492 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 341' ' ' PHE . . . . . 0.453 ' CZ ' ' HA ' ' A' ' 345' ' ' ASN . 50.7 m-85 -61.11 -42.52 98.67 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.025 -1.047 . . . . 0.21 109.89 -179.772 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' C' C ' 342' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -52.35 -46.11 65.99 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.025 -1.047 . . . . 3.42 109.782 179.984 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' C' C ' 343' ' ' GLU . . . . . . . . . . . . . 9.4 tt0 -57.12 -49.14 76.81 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.225 -0.922 . . . . 2.14 109.835 -179.528 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 344' ' ' LEU . . . . . 0.422 ' O ' HD21 ' C' ' 348' ' ' LEU . 85.4 mt -62.25 -28.06 69.44 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.292 -0.88 . . . . 1.09 109.552 179.945 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' C' C ' 345' ' ' ASN . . . . . 0.509 ' HA ' ' CZ ' ' A' ' 341' ' ' PHE . 24.8 t-20 -58.74 -63.21 1.37 Allowed 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.425 -0.797 . . . . 1.38 110.303 -179.422 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' C' C ' 346' ' ' GLU . . . . . 0.438 ' O ' ' HG2' ' C' ' 346' ' ' GLU . 17.9 tt0 -61.66 -21.77 64.71 Favored 'General case' 0 C--N 1.301 -1.509 0 O-C-N 121.3 -0.875 . . . . 2.21 109.948 -179.444 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' C' C ' 347' ' ' ALA . . . . . . . . . . . . . . . -61.67 -58.43 8.08 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.004 -1.06 . . . . 1.03 110.214 -179.617 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 348' ' ' LEU . . . . . 0.422 HD21 ' O ' ' C' ' 344' ' ' LEU . 3.4 mm? -63.47 -53.94 44.26 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.071 -1.018 . . . . 1.06 110.344 -179.214 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' C' C ' 349' ' ' GLU . . . . . . . . . . . . . 1.9 mp0 -57.22 -26.84 61.37 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.002 -1.061 . . . . 2.19 109.735 -179.472 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 350' ' ' LEU . . . . . 0.589 ' CD2' ' CD1' ' D' ' 350' ' ' LEU . 7.7 tt -65.12 -46.7 79.92 Favored 'General case' 0 N--CA 1.488 1.453 0 O-C-N 121.015 -1.053 . . . . 1.2 109.165 179.666 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' C' C ' 351' ' ' LYS . . . . . . . . . . . . . 42.1 tttt -61.19 -43.63 98.58 Favored 'General case' 0 N--CA 1.488 1.438 0 O-C-N 121.385 -0.822 . . . . 1.92 109.473 179.924 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 352' ' ' ASP . . . . . . . . . . . . . 2.9 m-20 -56.28 -47.79 77.9 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.264 -0.898 . . . . 1.19 109.655 -179.95 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 353' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 1.499 0 O-C-N 121.189 -0.944 . . . . 1.15 109.424 -179.934 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' D' D ' 326' ' ' GLU . . . . . 0.433 ' O ' ' CD1' ' D' ' 327' ' ' TYR . 71.8 mm-40 . . . . . 0 N--CA 1.488 1.437 0 CA-C-O 121.514 0.673 . . . . 2.13 109.617 . . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' D' D ' 327' ' ' TYR . . . . . 0.508 ' CE2' ' CG ' ' B' ' 333' ' ' ARG . 47.4 m-85 -150.12 109.49 3.98 Favored 'General case' 0 C--N 1.302 -1.5 0 O-C-N 121.276 -0.89 . . . . 1.0 109.082 179.817 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' D' D ' 328' ' ' PHE . . . . . . . . . . . . . 52.0 m-85 -111.35 -166.71 1.1 Allowed 'General case' 0 N--CA 1.488 1.472 0 O-C-N 121.398 -0.814 . . . . 0.34 109.623 -179.674 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' D' D ' 329' ' ' THR . . . . . . . . . . . . . 66.4 p -152.56 163.33 39.8 Favored 'General case' 0 N--CA 1.488 1.425 0 O-C-N 121.34 -0.85 . . . . 1.05 108.843 179.991 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' D' D ' 330' ' ' LEU . . . . . . . . . . . . . 17.7 tp -149.85 131.35 14.8 Favored 'General case' 0 C--N 1.301 -1.507 0 O-C-N 121.158 -0.964 . . . . 1.07 109.655 -179.702 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' D' D ' 331' ' ' GLN . . . . . . . . . . . . . 1.5 tt0 -86.0 116.66 24.36 Favored 'General case' 0 C--N 1.303 -1.433 0 O-C-N 121.347 -0.846 . . . . 0.93 108.804 179.593 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' D' D ' 332' ' ' ILE . . . . . . . . . . . . . 80.4 mt -102.4 103.68 15.36 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.452 0 O-C-N 121.344 -0.848 . . . . 1.07 109.572 -179.545 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' D' D ' 333' ' ' ARG . . . . . 0.566 ' HG3' ' CE2' ' B' ' 327' ' ' TYR . 4.5 mpt_? -70.64 151.22 45.2 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.282 -0.886 . . . . 3.42 109.294 179.731 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' D' D ' 334' ' ' GLY . . . . . . . . . . . . . . . 77.07 126.77 0.29 Allowed Glycine 0 N--CA 1.489 2.199 0 N-CA-C 109.389 -1.485 . . . . 0.41 109.389 -179.953 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' D' D ' 335' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -75.68 -36.83 59.96 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.426 -1.043 . . . . 3.58 109.56 -179.815 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' D' D ' 336' ' ' GLU . . . . . . . . . . . . . 43.8 mt-10 -56.8 -58.77 6.67 Favored 'General case' 0 C--N 1.301 -1.505 0 O-C-N 121.281 -0.887 . . . . 2.26 109.778 -179.633 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' D' D ' 337' ' ' ARG . . . . . . . . . . . . . 16.9 mmt180 -60.94 -28.94 69.33 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.195 -0.941 . . . . 3.64 110.196 -179.578 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' D' D ' 338' ' ' PHE . . . . . 0.423 ' CD1' ' HB2' ' B' ' 328' ' ' PHE . 40.5 t80 -57.22 -60.29 3.83 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.261 -0.899 . . . . 0.4 110.081 -179.45 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' D' D ' 339' ' ' GLU . . . . . . . . . . . . . 5.3 mt-10 -51.89 -33.0 34.8 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.328 -0.858 . . . . 1.99 110.218 -179.203 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' D' D ' 340' ' ' MET . . . . . . . . . . . . . 30.2 ttp -63.96 -49.94 70.6 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.065 -1.022 . . . . 1.13 109.755 -179.659 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' D' D ' 341' ' ' PHE . . . . . 0.48 ' CZ ' ' HA ' ' B' ' 345' ' ' ASN . 36.2 m-85 -61.97 -43.96 97.74 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.314 -0.866 . . . . 0.21 110.106 -179.721 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' D' D ' 342' ' ' ARG . . . . . 0.508 ' NH1' ' HG2' ' D' ' 342' ' ' ARG . 0.1 OUTLIER -49.32 -44.54 44.49 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.401 -0.812 . . . . 3.15 110.042 -179.54 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' D' D ' 343' ' ' GLU . . . . . . . . . . . . . 4.4 tt0 -58.49 -47.85 82.73 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.247 -0.908 . . . . 2.35 109.949 -179.448 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' D' D ' 344' ' ' LEU . . . . . 0.452 ' O ' ' HB1' ' D' ' 347' ' ' ALA . 47.3 mt -61.58 -32.03 72.11 Favored 'General case' 0 N--CA 1.489 1.493 0 O-C-N 121.065 -1.022 . . . . 1.06 109.979 -179.66 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' D' D ' 345' ' ' ASN . . . . . . . . . . . . . 16.3 t-20 -57.09 -60.39 3.66 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.23 -0.919 . . . . 1.35 109.85 -179.538 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' D' D ' 346' ' ' GLU . . . . . . . . . . . . . 3.9 tt0 -61.09 -24.71 66.44 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.391 -0.818 . . . . 1.69 109.699 -179.549 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' D' D ' 347' ' ' ALA . . . . . 0.452 ' HB1' ' O ' ' D' ' 344' ' ' LEU . . . -60.15 -61.7 2.41 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.162 -0.961 . . . . 1.03 110.058 -179.719 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' D' D ' 348' ' ' LEU . . . . . 0.448 ' N ' HD23 ' D' ' 348' ' ' LEU . 3.5 mm? -61.4 -47.72 84.52 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.144 -0.972 . . . . 1.04 110.219 -179.616 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' D' D ' 349' ' ' GLU . . . . . . . . . . . . . 3.5 mm-40 -56.71 -29.81 62.84 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.131 -0.981 . . . . 1.95 109.723 -179.327 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' D' D ' 350' ' ' LEU . . . . . 0.589 ' CD1' ' CD2' ' C' ' 350' ' ' LEU . 4.3 tt -64.95 -45.92 83.75 Favored 'General case' 0 N--CA 1.488 1.469 0 O-C-N 121.252 -0.905 . . . . 1.16 109.368 179.947 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' D' D ' 351' ' ' LYS . . . . . . . . . . . . . 29.3 tttt -60.04 -51.62 68.85 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.504 -0.748 . . . . 1.97 109.584 179.959 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' D' D ' 352' ' ' ASP . . . . . . . . . . . . . 69.3 m-20 -55.3 -38.04 68.13 Favored 'General case' 0 N--CA 1.489 1.48 0 O-C-N 121.343 -0.848 . . . . 1.17 109.382 -179.916 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' D' D ' 353' ' ' ALA . . . . . . . . . . . . . . . -65.17 -35.17 80.24 Favored 'General case' 0 N--CA 1.489 1.489 0 O-C-N 121.146 -0.971 . . . . 1.21 109.552 -179.998 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' D' D ' 354' ' ' GLN . . . . . . . . . . . . . 4.1 tt0 . . . . . 0 N--CA 1.488 1.457 0 O-C-N 121.151 -0.968 . . . . 1.68 109.557 -179.944 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 326' ' ' GLU . . . . . 0.431 ' HB3' ' CE2' ' A' ' 328' ' ' PHE . 43.5 mm-40 . . . . . 0 N--CA 1.49 1.568 0 N-CA-C 109.093 -0.706 . . . . 2.13 109.093 . . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 327' ' ' TYR . . . . . 0.588 ' CE1' ' HG2' ' C' ' 333' ' ' ARG . 41.2 m-85 -149.69 104.83 3.37 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.169 -0.957 . . . . 1.0 109.428 -179.894 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 328' ' ' PHE . . . . . 0.431 ' CE2' ' HB3' ' A' ' 326' ' ' GLU . 88.9 m-85 -111.46 -166.19 1.06 Allowed 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.419 -0.801 . . . . 0.34 109.576 -179.72 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 329' ' ' THR . . . . . . . . . . . . . 33.5 p -153.61 160.92 42.56 Favored 'General case' 0 N--CA 1.488 1.435 0 O-C-N 121.451 -0.781 . . . . 1.05 108.923 -179.826 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 330' ' ' LEU . . . . . . . . . . . . . 25.9 tp -150.78 129.84 12.62 Favored 'General case' 0 N--CA 1.488 1.465 0 O-C-N 121.167 -0.958 . . . . 1.07 109.738 -179.611 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 331' ' ' GLN . . . . . . . . . . . . . 1.3 tt0 -88.82 113.81 24.77 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.22 -0.925 . . . . 0.91 109.189 179.732 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 332' ' ' ILE . . . . . 0.408 HG23 ' HA ' ' A' ' 338' ' ' PHE . 38.5 mt -103.41 111.76 34.35 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.505 0 O-C-N 121.08 -1.013 . . . . 1.09 109.911 -179.864 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 333' ' ' ARG . . . . . 0.594 ' CG ' ' CE1' ' C' ' 327' ' ' TYR . 0.0 OUTLIER -73.12 149.28 43.17 Favored 'General case' 0 C--N 1.302 -1.47 0 O-C-N 121.27 -0.894 . . . . 3.41 109.488 179.725 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 334' ' ' GLY . . . . . . . . . . . . . . . 84.77 132.57 2.53 Favored Glycine 0 N--CA 1.49 2.259 0 N-CA-C 109.514 -1.434 . . . . 0.4 109.514 -179.917 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 335' ' ' ARG . . . . . . . . . . . . . 36.0 ttt180 -78.92 -42.48 26.98 Favored 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.199 -1.177 . . . . 3.55 109.59 -179.83 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 336' ' ' GLU . . . . . . . . . . . . . 3.5 pt-20 -57.22 -53.08 62.14 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.232 -0.917 . . . . 2.29 110.115 -179.589 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 337' ' ' ARG . . . . . . . . . . . . . 12.6 mmt180 -61.97 -34.81 76.82 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 120.97 -1.081 . . . . 3.64 109.809 -179.754 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 338' ' ' PHE . . . . . 0.408 ' HA ' HG23 ' A' ' 332' ' ' ILE . 80.8 t80 -55.32 -57.55 11.36 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.173 -0.955 . . . . 0.41 109.802 -179.711 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 339' ' ' GLU . . . . . . . . . . . . . 44.1 mt-10 -51.43 -36.09 42.29 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.224 -0.923 . . . . 1.97 110.425 -179.681 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 340' ' ' MET . . . . . . . . . . . . . 47.1 ttp -62.44 -48.57 79.08 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.119 -0.988 . . . . 1.14 109.808 -179.448 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 341' ' ' PHE . . . . . 0.424 ' CZ ' ' HA ' ' C' ' 345' ' ' ASN . 43.3 m-85 -62.55 -47.81 82.24 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.128 -0.982 . . . . 0.21 109.982 -179.614 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 342' ' ' ARG . . . . . . . . . . . . . 19.7 ttt180 -49.23 -42.32 40.18 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.316 -0.865 . . . . 3.15 110.21 -179.496 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 343' ' ' GLU . . . . . . . . . . . . . 4.2 tp10 -58.89 -49.05 79.24 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.143 -0.973 . . . . 2.35 109.921 -179.611 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 344' ' ' LEU . . . . . 0.499 HD21 ' CD2' ' B' ' 344' ' ' LEU . 37.1 mt -61.34 -31.56 71.43 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.217 -0.927 . . . . 1.06 109.76 -179.568 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 345' ' ' ASN . . . . . . . . . . . . . 62.4 t-20 -57.36 -54.3 48.4 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.295 -0.878 . . . . 1.36 109.698 -179.717 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 346' ' ' GLU . . . . . . . . . . . . . 6.0 tp10 -62.62 -27.74 69.41 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.331 -0.855 . . . . 1.65 110.097 -179.661 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 347' ' ' ALA . . . . . . . . . . . . . . . -61.85 -58.82 6.5 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.217 -0.927 . . . . 1.03 110.025 -179.609 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 348' ' ' LEU . . . . . 0.46 ' N ' HD23 ' A' ' 348' ' ' LEU . 3.8 mm? -60.72 -48.53 81.37 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.119 -0.988 . . . . 1.04 110.053 -179.304 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 349' ' ' GLU . . . . . 0.452 ' OE1' ' NH1' ' C' ' 333' ' ' ARG . 43.4 mt-10 -56.98 -33.13 66.79 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.155 -0.966 . . . . 1.94 109.533 -179.47 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 350' ' ' LEU . . . . . 0.477 HD23 HD23 ' B' ' 350' ' ' LEU . 3.9 tt -63.96 -45.34 89.59 Favored 'General case' 0 C--N 1.302 -1.469 0 O-C-N 121.269 -0.895 . . . . 1.17 109.182 179.887 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 351' ' ' LYS . . . . . . . . . . . . . 9.5 tttp -60.5 -45.33 94.19 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.279 -0.888 . . . . 1.97 109.624 179.858 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 352' ' ' ASP . . . . . . . . . . . . . 7.0 m-20 -55.19 -37.56 67.23 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.233 -0.917 . . . . 1.16 109.633 -179.844 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 353' ' ' ALA . . . . . . . . . . . . . . . -66.08 -30.29 70.78 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.228 -0.92 . . . . 1.22 109.702 -179.795 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 354' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 N--CA 1.492 1.658 0 O-C-N 121.239 -0.913 . . . . 1.71 109.727 -179.954 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 326' ' ' GLU . . . . . 0.43 ' HB3' ' CE2' ' B' ' 328' ' ' PHE . 45.1 mm-40 . . . . . 0 N--CA 1.491 1.582 0 N-CA-C 109.205 -0.665 . . . . 2.13 109.205 . . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 327' ' ' TYR . . . . . 0.622 ' CE1' ' CG ' ' D' ' 333' ' ' ARG . 42.9 m-85 -149.16 106.36 3.61 Favored 'General case' 0 C--N 1.301 -1.516 0 O-C-N 121.177 -0.952 . . . . 0.99 109.199 179.974 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 328' ' ' PHE . . . . . 0.522 ' CE2' ' HA ' ' D' ' 335' ' ' ARG . 89.3 m-85 -113.57 -167.07 1.15 Allowed 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.331 -0.856 . . . . 0.36 109.458 -179.563 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 329' ' ' THR . . . . . . . . . . . . . 33.9 p -152.74 161.32 42.72 Favored 'General case' 0 N--CA 1.488 1.459 0 O-C-N 121.314 -0.866 . . . . 1.05 109.08 -179.912 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 330' ' ' LEU . . . . . . . . . . . . . 25.4 tp -151.19 129.09 11.69 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 120.966 -1.084 . . . . 1.07 109.779 -179.637 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 331' ' ' GLN . . . . . . . . . . . . . 1.3 tt0 -87.96 114.91 25.03 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.201 -0.937 . . . . 0.91 109.185 179.623 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 332' ' ' ILE . . . . . 0.41 HG23 ' HA ' ' B' ' 338' ' ' PHE . 39.1 mt -103.89 111.81 34.97 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.594 0 O-C-N 121.09 -1.006 . . . . 1.08 109.718 -179.871 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 333' ' ' ARG . . . . . 0.597 ' CG ' ' CE1' ' D' ' 327' ' ' TYR . 0.0 OUTLIER -73.34 149.21 42.77 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.231 -0.918 . . . . 3.42 109.587 179.755 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' B' B ' 334' ' ' GLY . . . . . . . . . . . . . . . 84.23 132.36 2.29 Favored Glycine 0 N--CA 1.492 2.391 0 N-CA-C 109.437 -1.465 . . . . 0.4 109.437 -179.834 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 335' ' ' ARG . . . . . 0.491 ' HA ' ' CE2' ' D' ' 328' ' ' PHE . 38.4 ttt180 -78.62 -41.96 30.15 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.332 -1.099 . . . . 3.55 109.737 -179.768 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 336' ' ' GLU . . . . . . . . . . . . . 3.7 pt-20 -57.16 -53.2 60.84 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.224 -0.922 . . . . 2.28 110.09 -179.677 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 337' ' ' ARG . . . . . . . . . . . . . 13.0 mmt180 -62.05 -34.9 77.12 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.044 -1.035 . . . . 3.64 109.929 -179.75 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 338' ' ' PHE . . . . . 0.41 ' HA ' HG23 ' B' ' 332' ' ' ILE . 80.3 t80 -55.61 -56.71 17.2 Favored 'General case' 0 C--N 1.303 -1.455 0 O-C-N 121.211 -0.931 . . . . 0.39 109.88 -179.618 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 339' ' ' GLU . . . . . . . . . . . . . 44.0 mt-10 -52.4 -35.2 51.13 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.222 -0.923 . . . . 1.98 110.337 -179.489 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 340' ' ' MET . . . . . . . . . . . . . 47.4 ttp -63.27 -48.27 78.85 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.135 -0.978 . . . . 1.14 109.755 -179.405 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 341' ' ' PHE . . . . . . . . . . . . . 43.9 m-85 -62.49 -47.94 81.74 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.204 -0.935 . . . . 0.22 109.848 -179.886 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 342' ' ' ARG . . . . . . . . . . . . . 17.2 ttt180 -49.24 -41.98 39.25 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.246 -0.909 . . . . 3.15 110.162 -179.55 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 343' ' ' GLU . . . . . . . . . . . . . 4.3 tp10 -59.16 -48.72 80.57 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.026 -1.046 . . . . 2.35 109.839 -179.53 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 344' ' ' LEU . . . . . 0.499 ' CD2' HD21 ' A' ' 344' ' ' LEU . 38.0 mt -61.76 -31.3 71.48 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.207 -0.933 . . . . 1.05 109.865 -179.609 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 345' ' ' ASN . . . . . . . . . . . . . 63.0 t-20 -57.64 -54.65 44.42 Favored 'General case' 0 C--N 1.302 -1.465 0 O-C-N 121.175 -0.953 . . . . 1.35 109.641 -179.714 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 346' ' ' GLU . . . . . . . . . . . . . 6.3 tp10 -62.0 -28.06 69.3 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.29 -0.881 . . . . 1.66 110.047 -179.659 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 347' ' ' ALA . . . . . . . . . . . . . . . -61.62 -58.32 8.55 Favored 'General case' 0 N--CA 1.495 1.795 0 O-C-N 121.138 -0.976 . . . . 1.02 110.238 -179.732 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 348' ' ' LEU . . . . . 0.453 ' N ' HD23 ' B' ' 348' ' ' LEU . 3.8 mm? -61.09 -49.54 76.88 Favored 'General case' 0 N--CA 1.493 1.692 0 O-C-N 121.287 -0.883 . . . . 1.05 109.869 -179.283 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 349' ' ' GLU . . . . . . . . . . . . . 44.0 mt-10 -56.1 -32.9 64.6 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.047 -1.033 . . . . 1.95 109.617 -179.624 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 350' ' ' LEU . . . . . 0.477 HD23 HD23 ' A' ' 350' ' ' LEU . 4.0 tt -64.46 -44.38 91.26 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.245 -0.909 . . . . 1.18 109.399 179.929 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 351' ' ' LYS . . . . . . . . . . . . . 9.9 tttp -61.56 -45.32 94.65 Favored 'General case' 0 N--CA 1.488 1.45 0 O-C-N 121.337 -0.852 . . . . 1.96 109.619 179.872 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 352' ' ' ASP . . . . . . . . . . . . . 6.3 m-20 -55.23 -37.21 66.86 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.201 -0.937 . . . . 1.16 109.602 -179.995 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 353' ' ' ALA . . . . . . . . . . . . . . . -66.44 -30.97 71.44 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.164 -0.96 . . . . 1.21 109.548 -179.75 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 354' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 N--CA 1.489 1.505 0 O-C-N 121.109 -0.994 . . . . 1.69 109.552 -179.962 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 326' ' ' GLU . . . . . . . . . . . . . 3.1 mt-10 . . . . . 0 N--CA 1.492 1.652 0 CA-C-O 121.392 0.615 . . . . 2.17 109.635 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' C' C ' 327' ' ' TYR . . . . . 0.594 ' CE1' ' CG ' ' A' ' 333' ' ' ARG . 38.2 m-85 -149.14 111.45 4.69 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.412 -0.805 . . . . 1.03 109.512 179.823 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' C' C ' 328' ' ' PHE . . . . . . . . . . . . . 93.8 m-85 -113.47 -170.17 1.64 Allowed 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.2 -0.938 . . . . 0.37 109.578 -179.941 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 329' ' ' THR . . . . . . . . . . . . . 6.3 p -153.28 161.78 42.01 Favored 'General case' 0 N--CA 1.491 1.609 0 N-CA-C 108.807 -0.812 . . . . 1.04 108.807 179.84 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 330' ' ' LEU . . . . . . . . . . . . . 15.7 tp -150.46 130.01 13.05 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.0 -1.063 . . . . 1.09 110.609 -179.027 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 331' ' ' GLN . . . . . . . . . . . . . 1.8 tp60 -89.32 116.0 27.21 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.394 -0.816 . . . . 1.48 108.938 178.885 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 332' ' ' ILE . . . . . 0.419 HG22 ' CD2' ' C' ' 341' ' ' PHE . 58.5 mt -103.7 115.04 44.91 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.695 0 O-C-N 121.011 -1.056 . . . . 1.08 109.984 -179.569 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' C' C ' 333' ' ' ARG . . . . . 0.588 ' HG2' ' CE1' ' A' ' 327' ' ' TYR . 0.7 OUTLIER -72.61 146.64 46.5 Favored 'General case' 0 N--CA 1.489 1.494 0 O-C-N 121.319 -0.863 . . . . 3.36 109.223 179.58 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' C' C ' 334' ' ' GLY . . . . . . . . . . . . . . . 84.43 127.79 1.6 Allowed Glycine 0 N--CA 1.49 2.272 0 N-CA-C 109.896 -1.282 . . . . 0.35 109.896 179.759 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 335' ' ' ARG . . . . . 0.405 ' O ' ' HB3' ' C' ' 338' ' ' PHE . 62.4 ttt180 -78.5 -32.97 48.4 Favored 'General case' 0 C--N 1.301 -1.501 0 O-C-N 121.331 -1.099 . . . . 3.23 109.271 179.634 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' C' C ' 336' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -57.74 -62.03 2.09 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.355 -0.841 . . . . 2.62 110.027 -179.702 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' C' C ' 337' ' ' ARG . . . . . . . . . . . . . 1.1 mpt_? -60.43 -26.54 66.8 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.287 -0.883 . . . . 3.61 109.905 -179.427 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 338' ' ' PHE . . . . . 0.405 ' HB3' ' O ' ' C' ' 335' ' ' ARG . 76.1 t80 -55.89 -58.95 5.71 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.236 -0.915 . . . . 0.43 109.855 -179.899 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' C' C ' 339' ' ' GLU . . . . . . . . . . . . . 10.2 mm-40 -51.64 -34.51 38.21 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.309 -0.87 . . . . 2.05 109.884 -179.537 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 340' ' ' MET . . . . . . . . . . . . . 33.4 ttp -64.43 -49.53 71.11 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.22 -0.925 . . . . 1.1 109.898 -179.665 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 341' ' ' PHE . . . . . 0.419 ' CD2' HG22 ' C' ' 332' ' ' ILE . 41.2 m-85 -60.78 -39.54 89.19 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.177 -0.952 . . . . 0.21 109.848 -179.505 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' C' C ' 342' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -51.77 -45.83 63.9 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.119 -0.988 . . . . 3.42 109.835 179.879 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' C' C ' 343' ' ' GLU . . . . . . . . . . . . . 2.3 tp10 -59.17 -47.77 84.09 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.309 -0.869 . . . . 2.14 110.486 -179.267 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 344' ' ' LEU . . . . . . . . . . . . . 30.2 mt -61.62 -35.0 76.65 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.034 -1.041 . . . . 1.09 110.159 -179.376 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 345' ' ' ASN . . . . . 0.424 ' HA ' ' CZ ' ' A' ' 341' ' ' PHE . 50.4 t-20 -58.17 -59.76 4.8 Favored 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.245 -0.91 . . . . 1.38 110.217 -179.506 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' C' C ' 346' ' ' GLU . . . . . . . . . . . . . 2.6 tt0 -60.55 -22.95 64.22 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.183 -0.948 . . . . 2.21 110.168 -179.375 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 347' ' ' ALA . . . . . . . . . . . . . . . -61.52 -57.47 12.0 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.124 -0.985 . . . . 1.03 110.159 -179.657 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 348' ' ' LEU . . . . . 0.432 HD23 ' N ' ' C' ' 348' ' ' LEU . 4.2 mm? -61.83 -52.92 62.19 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.267 -0.896 . . . . 1.06 110.272 -179.165 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' C' C ' 349' ' ' GLU . . . . . . . . . . . . . 21.4 mm-40 -55.75 -31.29 62.42 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.157 -0.964 . . . . 2.19 109.995 -179.195 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 350' ' ' LEU . . . . . 0.586 ' CD1' ' CD1' ' D' ' 350' ' ' LEU . 0.3 OUTLIER -65.22 -49.24 70.46 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.126 -0.984 . . . . 1.2 109.342 -179.91 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' C' C ' 351' ' ' LYS . . . . . 0.437 ' N ' ' CD1' ' C' ' 350' ' ' LEU . 9.6 tttt -61.4 -44.19 97.57 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.322 -0.861 . . . . 1.92 109.744 179.696 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' C' C ' 352' ' ' ASP . . . . . . . . . . . . . 77.8 m-20 -55.98 -31.48 63.06 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.47 -0.769 . . . . 1.19 110.182 -179.53 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 353' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 1.493 0 O-C-N 121.066 -1.021 . . . . 1.15 109.441 -179.676 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' D' D ' 326' ' ' GLU . . . . . 0.437 ' HB3' ' CE2' ' D' ' 328' ' ' PHE . 48.1 mm-40 . . . . . 0 N--CA 1.487 1.399 0 N-CA-C 109.123 -0.695 . . . . 2.13 109.123 . . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' D' D ' 327' ' ' TYR . . . . . 0.597 ' CE1' ' CG ' ' B' ' 333' ' ' ARG . 41.8 m-85 -149.16 106.21 3.59 Favored 'General case' 0 C--N 1.302 -1.467 0 O-C-N 121.203 -0.935 . . . . 1.0 109.385 179.814 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' D' D ' 328' ' ' PHE . . . . . 0.491 ' CE2' ' HA ' ' B' ' 335' ' ' ARG . 87.8 m-85 -113.09 -166.39 1.08 Allowed 'General case' 0 N--CA 1.488 1.456 0 O-C-N 121.298 -0.876 . . . . 0.34 109.623 -179.557 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' D' D ' 329' ' ' THR . . . . . . . . . . . . . 35.2 p -153.51 160.32 42.48 Favored 'General case' 0 N--CA 1.488 1.464 0 O-C-N 121.345 -0.847 . . . . 1.05 109.012 -179.544 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' D' D ' 330' ' ' LEU . . . . . . . . . . . . . 23.4 tp -151.05 129.6 12.2 Favored 'General case' 0 N--CA 1.488 1.475 0 O-C-N 121.152 -0.968 . . . . 1.07 109.639 -179.677 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' D' D ' 331' ' ' GLN . . . . . . . . . . . . . 1.3 tt0 -88.44 114.54 25.16 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.367 -0.833 . . . . 0.93 109.271 179.865 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' D' D ' 332' ' ' ILE . . . . . . . . . . . . . 38.5 mt -103.52 111.7 34.24 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.447 0 O-C-N 121.094 -1.004 . . . . 1.07 109.849 -179.604 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' D' D ' 333' ' ' ARG . . . . . 0.622 ' CG ' ' CE1' ' B' ' 327' ' ' TYR . 0.0 OUTLIER -73.11 148.9 43.52 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.291 -0.88 . . . . 3.42 109.527 179.803 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' D' D ' 334' ' ' GLY . . . . . . . . . . . . . . . 84.97 131.94 2.48 Favored Glycine 0 N--CA 1.492 2.37 0 N-CA-C 109.567 -1.413 . . . . 0.41 109.567 179.988 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' D' D ' 335' ' ' ARG . . . . . 0.522 ' HA ' ' CE2' ' B' ' 328' ' ' PHE . 39.7 ttt180 -78.75 -40.66 32.78 Favored 'General case' 0 N--CA 1.49 1.525 0 O-C-N 121.158 -1.201 . . . . 3.58 109.558 -179.821 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' D' D ' 336' ' ' GLU . . . . . . . . . . . . . 3.7 pt-20 -58.18 -53.28 60.02 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.173 -0.955 . . . . 2.26 110.001 -179.566 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' D' D ' 337' ' ' ARG . . . . . . . . . . . . . 12.9 mmt180 -61.79 -35.98 79.76 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.182 -0.949 . . . . 3.64 109.795 -179.719 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' D' D ' 338' ' ' PHE . . . . . . . . . . . . . 80.5 t80 -54.73 -56.66 16.9 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.145 -0.972 . . . . 0.4 110.054 -179.65 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' D' D ' 339' ' ' GLU . . . . . . . . . . . . . 43.4 mt-10 -52.26 -35.9 51.19 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.214 -0.929 . . . . 1.99 110.337 -179.565 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' D' D ' 340' ' ' MET . . . . . . . . . . . . . 46.9 ttp -62.97 -48.03 80.62 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 120.989 -1.069 . . . . 1.13 109.83 -179.454 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' D' D ' 341' ' ' PHE . . . . . . . . . . . . . 44.5 m-85 -62.83 -47.9 81.39 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.207 -0.933 . . . . 0.21 109.859 -179.752 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' D' D ' 342' ' ' ARG . . . . . . . . . . . . . 16.7 ttt180 -48.98 -42.26 37.05 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.374 -0.829 . . . . 3.15 110.104 -179.544 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' D' D ' 343' ' ' GLU . . . . . . . . . . . . . 4.2 tp10 -59.12 -48.95 79.73 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.037 -1.039 . . . . 2.35 109.845 -179.692 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' D' D ' 344' ' ' LEU . . . . . . . . . . . . . 39.0 mt -60.95 -33.03 72.56 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.097 -1.002 . . . . 1.06 109.741 -179.68 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' D' D ' 345' ' ' ASN . . . . . . . . . . . . . 63.2 t-20 -56.2 -54.6 43.31 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.223 -0.923 . . . . 1.35 109.739 -179.928 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' D' D ' 346' ' ' GLU . . . . . . . . . . . . . 6.6 tp10 -62.46 -27.48 69.15 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.124 -0.985 . . . . 1.69 110.101 -179.589 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' D' D ' 347' ' ' ALA . . . . . . . . . . . . . . . -62.16 -58.48 7.63 Favored 'General case' 0 N--CA 1.493 1.725 0 O-C-N 121.051 -1.03 . . . . 1.03 110.221 -179.573 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' D' D ' 348' ' ' LEU . . . . . 0.469 ' N ' HD23 ' D' ' 348' ' ' LEU . 3.8 mm? -60.8 -48.81 80.09 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.26 -0.9 . . . . 1.04 110.017 -179.321 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' D' D ' 349' ' ' GLU . . . . . . . . . . . . . 43.4 mt-10 -56.83 -33.31 66.62 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.073 -1.017 . . . . 1.95 109.594 -179.591 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' D' D ' 350' ' ' LEU . . . . . 0.586 ' CD1' ' CD1' ' C' ' 350' ' ' LEU . 4.2 tt -64.16 -44.4 92.21 Favored 'General case' 0 N--CA 1.489 1.479 0 O-C-N 121.374 -0.829 . . . . 1.16 109.243 179.968 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' D' D ' 351' ' ' LYS . . . . . . . . . . . . . 10.1 tttp -61.51 -44.78 96.45 Favored 'General case' 0 N--CA 1.489 1.486 0 O-C-N 121.393 -0.817 . . . . 1.97 109.677 -179.943 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' D' D ' 352' ' ' ASP . . . . . . . . . . . . . 6.0 m-20 -55.96 -37.1 68.57 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.352 -0.842 . . . . 1.17 109.701 -179.795 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' D' D ' 353' ' ' ALA . . . . . . . . . . . . . . . -66.44 -30.51 70.88 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.278 -0.889 . . . . 1.21 109.722 -179.767 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' D' D ' 354' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 N--CA 1.49 1.526 0 O-C-N 121.269 -0.894 . . . . 1.68 109.603 -179.947 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 326' ' ' GLU . . . . . . . . . . . . . 3.5 mt-10 . . . . . 0 N--CA 1.489 1.518 0 CA-C-O 121.427 0.632 . . . . 2.13 109.716 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 327' ' ' TYR . . . . . 0.584 ' CE1' ' HG2' ' C' ' 333' ' ' ARG . 39.1 m-85 -149.44 109.66 4.16 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.471 -0.768 . . . . 1.0 109.613 -179.877 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 328' ' ' PHE . . . . . 0.45 ' O ' ' OE1' ' C' ' 331' ' ' GLN . 81.2 m-85 -113.01 -166.6 1.09 Allowed 'General case' 0 N--CA 1.489 1.487 0 O-C-N 121.439 -0.788 . . . . 0.34 109.293 179.658 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 329' ' ' THR . . . . . 0.435 ' HA ' ' O ' ' C' ' 330' ' ' LEU . 15.2 p -153.77 167.14 30.63 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.305 -0.872 . . . . 1.05 109.216 179.985 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 330' ' ' LEU . . . . . . . . . . . . . 15.1 tp -152.79 131.55 12.39 Favored 'General case' 0 C--N 1.303 -1.415 0 O-C-N 121.278 -0.889 . . . . 1.07 109.876 -179.698 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 331' ' ' GLN . . . . . 0.406 ' O ' ' NH2' ' A' ' 333' ' ' ARG . 1.5 tt0 -86.4 117.42 25.19 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.29 -0.881 . . . . 0.91 108.87 179.635 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 332' ' ' ILE . . . . . . . . . . . . . 61.1 mt -102.91 103.55 15.24 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.526 0 O-C-N 121.042 -1.036 . . . . 1.09 109.725 -179.796 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 333' ' ' ARG . . . . . 0.462 ' NH1' ' CG ' ' A' ' 333' ' ' ARG . 0.0 OUTLIER -69.96 145.86 51.56 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.372 -0.83 . . . . 3.41 109.123 179.659 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 334' ' ' GLY . . . . . . . . . . . . . . . 82.5 126.86 1.02 Allowed Glycine 0 N--CA 1.492 2.421 0 N-CA-C 109.654 -1.378 . . . . 0.4 109.654 -179.801 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 335' ' ' ARG . . . . . 0.451 ' O ' ' HB3' ' A' ' 338' ' ' PHE . 10.2 ttm180 -74.6 -38.5 62.59 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.387 -1.066 . . . . 3.55 109.334 179.881 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 336' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -55.54 -54.94 37.73 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.416 -0.802 . . . . 2.29 109.792 -179.555 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 337' ' ' ARG . . . . . . . . . . . . . 17.8 mtp180 -62.81 -28.65 70.15 Favored 'General case' 0 N--CA 1.496 1.835 0 O-C-N 121.381 -0.824 . . . . 3.64 109.87 179.803 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 338' ' ' PHE . . . . . 0.451 ' HB3' ' O ' ' A' ' 335' ' ' ARG . 77.9 t80 -55.05 -61.5 2.27 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.035 -1.04 . . . . 0.41 109.833 -179.453 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 339' ' ' GLU . . . . . . . . . . . . . 43.1 mt-10 -50.58 -31.75 16.69 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 120.935 -1.103 . . . . 1.97 109.769 -179.748 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 340' ' ' MET . . . . . . . . . . . . . 27.2 ttp -63.8 -55.06 25.82 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 120.991 -1.068 . . . . 1.14 110.153 -179.519 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 341' ' ' PHE . . . . . . . . . . . . . 43.5 m-85 -61.37 -53.72 53.03 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.346 -0.846 . . . . 0.21 109.647 -179.502 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 342' ' ' ARG . . . . . . . . . . . . . 5.4 ttp180 -44.52 -40.57 5.75 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.466 -0.771 . . . . 3.15 109.596 -179.866 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 343' ' ' GLU . . . . . . . . . . . . . 21.6 tt0 -58.68 -46.69 86.66 Favored 'General case' 0 N--CA 1.489 1.5 0 O-C-N 121.18 -0.95 . . . . 2.35 109.866 -179.689 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 344' ' ' LEU . . . . . 0.44 ' O ' HD21 ' A' ' 348' ' ' LEU . 49.3 mt -63.36 -45.16 92.46 Favored 'General case' 0 C--N 1.3 -1.552 0 O-C-N 121.269 -0.895 . . . . 1.06 109.988 -179.628 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 345' ' ' ASN . . . . . . . . . . . . . 34.5 t-20 -53.02 -48.93 67.18 Favored 'General case' 0 C--N 1.302 -1.478 0 O-C-N 121.247 -0.908 . . . . 1.36 109.595 -179.613 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 346' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -59.61 -36.34 76.12 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.178 -0.951 . . . . 1.65 109.514 -179.922 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 347' ' ' ALA . . . . . . . . . . . . . . . -61.05 -49.44 77.35 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.239 -0.913 . . . . 1.03 109.854 -179.924 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 348' ' ' LEU . . . . . 0.492 ' N ' ' CD2' ' A' ' 348' ' ' LEU . 4.0 mm? -61.84 -41.6 98.0 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 120.949 -1.094 . . . . 1.04 109.739 -179.729 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 349' ' ' GLU . . . . . . . . . . . . . 61.5 mt-10 -58.06 -41.02 82.47 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.231 -0.918 . . . . 1.94 110.117 -179.441 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 350' ' ' LEU . . . . . 0.526 HD21 ' CD1' ' B' ' 350' ' ' LEU . 7.7 tt -62.9 -41.43 99.44 Favored 'General case' 0 N--CA 1.488 1.461 0 O-C-N 121.109 -0.995 . . . . 1.17 109.86 -179.52 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 351' ' ' LYS . . . . . . . . . . . . . 10.5 tttt -58.04 -46.7 84.91 Favored 'General case' 0 N--CA 1.494 1.751 0 O-C-N 121.0 -1.063 . . . . 1.97 109.387 -179.741 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 352' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -55.8 -51.88 65.91 Favored 'General case' 0 N--CA 1.487 1.389 0 O-C-N 121.481 -0.762 . . . . 1.16 109.778 -179.951 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 353' ' ' ALA . . . . . . . . . . . . . . . -68.65 -14.76 63.23 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 120.964 -1.085 . . . . 1.22 109.574 -179.829 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 354' ' ' GLN . . . . . 0.529 ' NE2' ' CD1' ' B' ' 350' ' ' LEU . 0.7 OUTLIER . . . . . 0 N--CA 1.492 1.63 0 O-C-N 121.279 -0.888 . . . . 1.71 109.611 -179.893 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 326' ' ' GLU . . . . . . . . . . . . . 3.4 mt-10 . . . . . 0 N--CA 1.492 1.639 0 CA-C-O 121.367 0.603 . . . . 2.13 109.391 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' B' B ' 327' ' ' TYR . . . . . 0.434 ' CE1' ' HG2' ' D' ' 333' ' ' ARG . 41.1 m-85 -150.35 109.72 3.98 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.444 -0.785 . . . . 0.99 109.556 179.902 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 328' ' ' PHE . . . . . . . . . . . . . 91.1 m-85 -113.41 -167.05 1.14 Allowed 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.363 -0.835 . . . . 0.36 109.399 179.999 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 329' ' ' THR . . . . . 0.439 ' HA ' ' O ' ' D' ' 330' ' ' LEU . 18.0 p -153.53 165.64 35.24 Favored 'General case' 0 N--CA 1.487 1.41 0 O-C-N 121.122 -0.987 . . . . 1.05 109.351 179.836 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 330' ' ' LEU . . . . . . . . . . . . . 14.9 tp -151.19 132.8 14.83 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.206 -0.934 . . . . 1.07 110.102 -179.685 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 331' ' ' GLN . . . . . . . . . . . . . 1.4 tt0 -87.06 117.95 26.13 Favored 'General case' 0 C--N 1.301 -1.528 0 O-C-N 121.296 -0.877 . . . . 0.91 109.067 179.496 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 332' ' ' ILE . . . . . . . . . . . . . 56.4 mt -103.02 104.89 17.29 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.5 0 O-C-N 121.14 -0.975 . . . . 1.08 109.664 179.813 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 333' ' ' ARG . . . . . 0.468 ' CG ' ' NH1' ' B' ' 333' ' ' ARG . 0.0 OUTLIER -70.76 145.44 50.43 Favored 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.385 -0.822 . . . . 3.42 108.927 179.602 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' B' B ' 334' ' ' GLY . . . . . . . . . . . . . . . 81.62 131.18 1.27 Allowed Glycine 0 N--CA 1.491 2.303 0 N-CA-C 109.264 -1.534 . . . . 0.4 109.264 -179.685 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 335' ' ' ARG . . . . . 0.462 ' O ' ' HB3' ' B' ' 338' ' ' PHE . 9.9 ttm180 -77.5 -38.14 49.62 Favored 'General case' 0 N--CA 1.489 1.48 0 O-C-N 121.283 -1.128 . . . . 3.55 109.472 -179.931 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 336' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -56.38 -54.48 45.11 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.362 -0.837 . . . . 2.28 109.382 -179.924 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 337' ' ' ARG . . . . . . . . . . . . . 18.6 mtp180 -62.19 -28.49 69.71 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.189 -0.944 . . . . 3.64 109.944 -179.987 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 338' ' ' PHE . . . . . 0.462 ' HB3' ' O ' ' B' ' 335' ' ' ARG . 80.2 t80 -55.85 -61.18 2.54 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 120.985 -1.072 . . . . 0.39 109.848 -179.617 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 339' ' ' GLU . . . . . . . . . . . . . 35.8 mt-10 -50.44 -32.84 18.96 Favored 'General case' 0 N--CA 1.494 1.77 0 O-C-N 121.241 -0.912 . . . . 1.98 109.846 -179.6 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 340' ' ' MET . . . . . . . . . . . . . 27.0 ttp -63.08 -54.42 38.33 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.265 -0.897 . . . . 1.14 109.921 -179.725 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 341' ' ' PHE . . . . . 0.416 ' O ' ' C ' ' B' ' 342' ' ' ARG . 45.0 m-85 -62.28 -54.06 46.1 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.464 -0.772 . . . . 0.22 109.826 -179.721 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 342' ' ' ARG . . . . . 0.416 ' C ' ' O ' ' B' ' 341' ' ' PHE . 4.4 ttp180 -45.0 -39.14 5.31 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 120.926 -1.108 . . . . 3.15 109.768 -179.954 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 343' ' ' GLU . . . . . . . . . . . . . 20.1 tt0 -58.68 -47.6 83.94 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.111 -0.993 . . . . 2.35 109.568 -179.911 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 344' ' ' LEU . . . . . 0.439 ' O ' HD21 ' B' ' 348' ' ' LEU . 48.0 mt -63.27 -45.25 92.33 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.047 -1.033 . . . . 1.05 110.244 -179.628 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 345' ' ' ASN . . . . . . . . . . . . . 36.8 t-20 -52.79 -48.12 67.09 Favored 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.28 -0.887 . . . . 1.35 109.666 -179.316 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 346' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -60.48 -35.64 76.39 Favored 'General case' 0 N--CA 1.488 1.447 0 O-C-N 121.021 -1.049 . . . . 1.66 109.465 179.882 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 347' ' ' ALA . . . . . . . . . . . . . . . -61.72 -48.88 78.75 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.145 -0.972 . . . . 1.02 110.406 -179.732 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 348' ' ' LEU . . . . . 0.511 ' CD2' ' N ' ' B' ' 348' ' ' LEU . 3.8 mm? -63.0 -40.85 99.0 Favored 'General case' 0 N--CA 1.495 1.818 0 O-C-N 121.263 -0.898 . . . . 1.05 109.661 -179.647 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 349' ' ' GLU . . . . . . . . . . . . . 64.5 mt-10 -58.32 -41.54 84.79 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.264 -0.898 . . . . 1.95 110.254 -179.863 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 350' ' ' LEU . . . . . 0.529 ' CD1' ' NE2' ' A' ' 354' ' ' GLN . 8.6 tt -61.93 -41.65 98.2 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.067 -1.021 . . . . 1.18 109.969 -179.428 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 351' ' ' LYS . . . . . . . . . . . . . 10.9 tttt -57.9 -47.02 84.03 Favored 'General case' 0 C--N 1.3 -1.577 0 O-C-N 121.084 -1.01 . . . . 1.96 109.425 179.952 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 352' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -55.28 -50.62 69.06 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 120.917 -1.114 . . . . 1.16 109.835 -179.9 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 353' ' ' ALA . . . . . . . . . . . . . . . -69.26 -16.0 63.49 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 121.284 -0.885 . . . . 1.21 109.667 -179.853 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 354' ' ' GLN . . . . . 0.42 ' NE2' ' CD1' ' A' ' 350' ' ' LEU . 1.0 OUTLIER . . . . . 0 N--CA 1.492 1.674 0 O-C-N 121.263 -0.898 . . . . 1.69 109.892 -179.808 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' C' C ' 326' ' ' GLU . . . . . . . . . . . . . 8.0 mm-40 . . . . . 0 N--CA 1.486 1.327 0 N-CA-C 108.938 -0.764 . . . . 2.17 108.938 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' C' C ' 327' ' ' TYR . . . . . . . . . . . . . 47.9 m-85 -149.78 109.46 4.04 Favored 'General case' 0 C--N 1.3 -1.561 0 O-C-N 121.014 -1.054 . . . . 1.03 110.139 -179.804 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 328' ' ' PHE . . . . . . . . . . . . . 77.4 m-85 -110.72 -167.79 1.23 Allowed 'General case' 0 N--CA 1.491 1.59 0 N-CA-C 108.886 -0.783 . . . . 0.37 108.886 179.742 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 329' ' ' THR . . . . . . . . . . . . . 6.4 p -151.77 160.12 43.69 Favored 'General case' 0 C--N 1.302 -1.486 0 O-C-N 121.052 -1.03 . . . . 1.04 109.312 -179.779 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 330' ' ' LEU . . . . . 0.435 ' O ' ' HA ' ' A' ' 329' ' ' THR . 21.8 tp -149.32 126.87 11.61 Favored 'General case' 0 N--CA 1.494 1.771 0 O-C-N 121.083 -1.01 . . . . 1.09 109.833 -179.674 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' C' C ' 331' ' ' GLN . . . . . 0.45 ' OE1' ' O ' ' A' ' 328' ' ' PHE . 0.7 OUTLIER -87.14 120.99 28.99 Favored 'General case' 0 N--CA 1.496 1.851 0 O-C-N 121.437 -0.79 . . . . 1.48 109.578 179.904 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' C' C ' 332' ' ' ILE . . . . . 0.468 HG23 ' HA ' ' C' ' 338' ' ' PHE . 15.2 mt -103.88 111.1 32.25 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.854 0 O-C-N 121.023 -1.048 . . . . 1.08 109.843 179.762 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' C' C ' 333' ' ' ARG . . . . . 0.584 ' HG2' ' CE1' ' A' ' 327' ' ' TYR . 4.4 mtp180 -72.06 137.66 47.29 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.351 -0.843 . . . . 3.36 109.332 179.709 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' C' C ' 334' ' ' GLY . . . . . . . . . . . . . . . 90.94 137.0 7.01 Favored Glycine 0 N--CA 1.491 2.303 0 N-CA-C 109.82 -1.312 . . . . 0.35 109.82 179.709 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 335' ' ' ARG . . . . . 0.407 ' HA ' ' CE1' ' A' ' 328' ' ' PHE . 3.1 ttt180 -80.09 -38.9 30.76 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.272 -1.134 . . . . 3.23 109.31 179.929 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' C' C ' 336' ' ' GLU . . . . . 0.411 ' HA ' ' OE1' ' C' ' 339' ' ' GLU . 1.7 tm-20 -58.91 -52.8 64.18 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.569 -0.707 . . . . 2.62 109.391 179.992 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' C' C ' 337' ' ' ARG . . . . . . . . . . . . . 34.9 mtp180 -60.91 -34.66 75.02 Favored 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.33 -0.856 . . . . 3.61 109.324 179.975 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 338' ' ' PHE . . . . . 0.468 ' HA ' HG23 ' C' ' 332' ' ' ILE . 57.5 t80 -53.57 -65.21 0.6 Allowed 'General case' 0 N--CA 1.487 1.403 0 O-C-N 121.264 -0.898 . . . . 0.43 109.745 -179.735 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' C' C ' 339' ' ' GLU . . . . . 0.411 ' OE1' ' HA ' ' C' ' 336' ' ' GLU . 3.2 mp0 -47.13 -34.84 6.46 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.249 -0.907 . . . . 2.05 110.375 -179.217 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' C' C ' 340' ' ' MET . . . . . . . . . . . . . 15.2 ttp -63.92 -53.4 50.98 Favored 'General case' 0 C--N 1.301 -1.51 0 O-C-N 120.841 -1.162 . . . . 1.1 110.034 -179.208 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 341' ' ' PHE . . . . . 0.427 ' CB ' HD12 ' C' ' 332' ' ' ILE . 40.6 m-85 -61.29 -44.92 96.42 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.032 -1.043 . . . . 0.21 109.614 -179.581 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' C' C ' 342' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -50.5 -45.52 56.51 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.213 -0.929 . . . . 3.42 110.41 -179.699 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' C' C ' 343' ' ' GLU . . . . . . . . . . . . . 5.1 tt0 -57.34 -43.58 83.52 Favored 'General case' 0 N--CA 1.489 1.497 0 O-C-N 121.331 -0.856 . . . . 2.14 109.786 -179.431 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 344' ' ' LEU . . . . . 0.454 ' O ' HD21 ' C' ' 348' ' ' LEU . 41.3 mt -62.64 -46.93 85.95 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.192 -0.942 . . . . 1.09 109.779 179.945 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' C' C ' 345' ' ' ASN . . . . . . . . . . . . . 31.2 t-20 -55.22 -49.48 71.87 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.287 -0.883 . . . . 1.38 109.896 -179.499 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 346' ' ' GLU . . . . . . . . . . . . . 13.6 tp10 -58.18 -35.95 72.35 Favored 'General case' 0 N--CA 1.489 1.5 0 O-C-N 121.098 -1.001 . . . . 2.21 109.713 -179.556 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 347' ' ' ALA . . . . . . . . . . . . . . . -61.49 -47.0 87.61 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.03 -1.044 . . . . 1.03 109.802 -179.931 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 348' ' ' LEU . . . . . 0.471 ' N ' ' CD2' ' C' ' 348' ' ' LEU . 4.2 mm? -62.83 -48.44 79.08 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.104 -0.998 . . . . 1.06 110.401 -179.552 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' C' C ' 349' ' ' GLU . . . . . . . . . . . . . 33.4 mt-10 -57.7 -36.53 72.1 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.151 -0.968 . . . . 2.19 109.878 -179.176 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 350' ' ' LEU . . . . . 0.497 HD22 ' CD1' ' D' ' 350' ' ' LEU . 3.9 tt -62.05 -40.07 94.53 Favored 'General case' 0 N--CA 1.489 1.482 0 O-C-N 121.312 -0.867 . . . . 1.2 109.424 -179.87 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' C' C ' 351' ' ' LYS . . . . . 0.418 ' N ' HD21 ' C' ' 350' ' ' LEU . 12.3 tttt -58.72 -37.83 77.0 Favored 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.147 -0.97 . . . . 1.92 109.084 -179.929 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' C' C ' 352' ' ' ASP . . . . . . . . . . . . . 49.0 m-20 -55.1 -54.97 36.41 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.29 -0.881 . . . . 1.19 109.556 179.519 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 353' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 1.566 0 O-C-N 121.351 -0.843 . . . . 1.15 109.544 -179.85 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' D' D ' 326' ' ' GLU . . . . . . . . . . . . . 3.4 mt-10 . . . . . 0 N--CA 1.489 1.491 0 CA-C-O 121.331 0.586 . . . . 2.13 109.723 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' D' D ' 327' ' ' TYR . . . . . . . . . . . . . 40.5 m-85 -149.39 109.88 4.22 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.277 -0.89 . . . . 1.0 109.541 -179.695 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' D' D ' 328' ' ' PHE . . . . . . . . . . . . . 94.9 m-85 -113.29 -166.83 1.12 Allowed 'General case' 0 N--CA 1.488 1.469 0 O-C-N 121.213 -0.929 . . . . 0.34 109.38 179.986 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' D' D ' 329' ' ' THR . . . . . . . . . . . . . 19.1 p -154.1 165.05 37.44 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.248 -0.907 . . . . 1.05 109.517 179.875 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' D' D ' 330' ' ' LEU . . . . . 0.439 ' O ' ' HA ' ' B' ' 329' ' ' THR . 14.7 tp -150.69 132.56 15.08 Favored 'General case' 0 N--CA 1.487 1.413 0 O-C-N 121.029 -1.044 . . . . 1.07 109.997 -179.463 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' D' D ' 331' ' ' GLN . . . . . . . . . . . . . 1.3 tt0 -86.21 117.14 24.84 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.234 -0.916 . . . . 0.93 108.576 179.402 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' D' D ' 332' ' ' ILE . . . . . . . . . . . . . 63.7 mt -102.65 104.2 16.17 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.618 0 O-C-N 121.162 -0.961 . . . . 1.07 109.584 -179.923 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' D' D ' 333' ' ' ARG . . . . . 0.445 ' CG ' ' NH1' ' D' ' 333' ' ' ARG . 0.0 OUTLIER -70.19 146.49 50.71 Favored 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.422 -0.799 . . . . 3.42 109.477 179.869 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' D' D ' 334' ' ' GLY . . . . . . . . . . . . . . . 80.33 130.93 0.94 Allowed Glycine 0 N--CA 1.491 2.363 0 N-CA-C 109.533 -1.427 . . . . 0.41 109.533 -179.77 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' D' D ' 335' ' ' ARG . . . . . 0.466 ' O ' ' HB3' ' D' ' 338' ' ' PHE . 9.8 ttm180 -77.66 -36.33 51.47 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.104 -1.233 . . . . 3.58 109.572 -179.753 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' D' D ' 336' ' ' GLU . . . . . . . . . . . . . 1.1 tt0 -57.12 -55.31 36.36 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.369 -0.832 . . . . 2.26 109.358 -179.759 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' D' D ' 337' ' ' ARG . . . . . . . . . . . . . 18.1 mtp180 -61.48 -28.38 69.25 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.356 -0.84 . . . . 3.64 109.695 -179.932 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' D' D ' 338' ' ' PHE . . . . . 0.466 ' HB3' ' O ' ' D' ' 335' ' ' ARG . 79.5 t80 -55.74 -61.76 2.14 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.21 -0.931 . . . . 0.4 109.83 -179.482 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' D' D ' 339' ' ' GLU . . . . . . . . . . . . . 45.1 mt-10 -50.66 -31.63 16.81 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.38 -0.825 . . . . 1.99 109.945 -179.655 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' D' D ' 340' ' ' MET . . . . . . . . . . . . . 29.3 ttp -64.64 -53.86 40.96 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.093 -1.004 . . . . 1.13 110.0 -179.482 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' D' D ' 341' ' ' PHE . . . . . . . . . . . . . 46.3 m-85 -62.57 -53.41 55.1 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.216 -0.928 . . . . 0.21 109.549 -179.74 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' D' D ' 342' ' ' ARG . . . . . . . . . . . . . 4.0 ttp180 -45.08 -38.67 5.19 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.101 -0.999 . . . . 3.15 109.904 -179.924 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' D' D ' 343' ' ' GLU . . . . . . . . . . . . . 20.9 tt0 -59.39 -47.65 84.62 Favored 'General case' 0 N--CA 1.49 1.525 0 O-C-N 121.12 -0.988 . . . . 2.35 109.534 -179.978 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' D' D ' 344' ' ' LEU . . . . . 0.469 ' O ' HD21 ' D' ' 348' ' ' LEU . 44.9 mt -63.18 -45.37 92.08 Favored 'General case' 0 C--N 1.301 -1.51 0 O-C-N 121.193 -0.942 . . . . 1.06 110.037 -179.703 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' D' D ' 345' ' ' ASN . . . . . . . . . . . . . 33.9 t-20 -52.43 -49.03 65.36 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.22 -0.925 . . . . 1.35 109.858 -179.349 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' D' D ' 346' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -60.07 -35.63 75.59 Favored 'General case' 0 N--CA 1.488 1.436 0 O-C-N 121.077 -1.014 . . . . 1.69 109.453 -179.961 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' D' D ' 347' ' ' ALA . . . . . . . . . . . . . . . -61.42 -48.97 78.78 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.259 -0.901 . . . . 1.03 110.215 -179.677 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' D' D ' 348' ' ' LEU . . . . . 0.511 ' CD2' ' N ' ' D' ' 348' ' ' LEU . 4.0 mm? -62.91 -40.66 98.25 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.147 -0.971 . . . . 1.04 109.663 -179.7 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' D' D ' 349' ' ' GLU . . . . . . . . . . . . . 59.6 mt-10 -59.05 -41.64 88.39 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.3 -0.875 . . . . 1.95 110.059 -179.309 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' D' D ' 350' ' ' LEU . . . . . 0.497 ' CD1' HD22 ' C' ' 350' ' ' LEU . 8.3 tt -61.76 -41.45 97.7 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.04 -1.037 . . . . 1.16 109.791 -179.282 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' D' D ' 351' ' ' LYS . . . . . . . . . . . . . 13.3 tttt -57.56 -47.34 82.33 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.01 -1.056 . . . . 1.97 109.301 -179.96 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' D' D ' 352' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -55.8 -51.45 67.4 Favored 'General case' 0 C--N 1.301 -1.505 0 O-C-N 121.393 -0.817 . . . . 1.17 109.503 179.984 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' D' D ' 353' ' ' ALA . . . . . . . . . . . . . . . -68.77 -14.88 63.31 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.153 -0.967 . . . . 1.21 109.616 -179.806 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' D' D ' 354' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 N--CA 1.494 1.746 0 O-C-N 121.334 -0.854 . . . . 1.68 109.955 -179.51 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 326' ' ' GLU . . . . . . . . . . . . . 6.2 mm-40 . . . . . 0 N--CA 1.49 1.554 0 CA-C-O 121.257 0.551 . . . . 2.13 109.548 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 327' ' ' TYR . . . . . 0.58 ' CE1' ' HG2' ' C' ' 333' ' ' ARG . 49.1 m-85 -149.36 108.47 3.91 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.31 -0.869 . . . . 1.0 109.315 179.98 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 328' ' ' PHE . . . . . 0.4 ' CZ ' ' HG3' ' C' ' 335' ' ' ARG . 98.0 m-85 -113.97 -167.54 1.22 Allowed 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.261 -0.9 . . . . 0.34 109.693 -179.902 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 329' ' ' THR . . . . . . . . . . . . . 41.5 p -152.83 165.13 36.39 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.398 -0.814 . . . . 1.05 108.967 179.91 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 330' ' ' LEU . . . . . . . . . . . . . 21.4 tp -151.55 129.59 11.83 Favored 'General case' 0 N--CA 1.489 1.497 0 O-C-N 121.067 -1.021 . . . . 1.07 110.063 -179.519 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 331' ' ' GLN . . . . . . . . . . . . . 1.7 tp60 -88.28 116.32 26.4 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.28 -0.887 . . . . 0.91 109.02 179.422 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 332' ' ' ILE . . . . . 0.444 HG23 ' HA ' ' A' ' 338' ' ' PHE . 36.1 mt -103.71 108.64 25.0 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.641 0 O-C-N 121.107 -0.996 . . . . 1.09 110.082 -179.588 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 333' ' ' ARG . . . . . 0.427 ' HG2' ' CE1' ' C' ' 327' ' ' TYR . 0.1 OUTLIER -73.41 144.84 46.22 Favored 'General case' 0 N--CA 1.489 1.483 0 O-C-N 121.284 -0.885 . . . . 3.41 109.152 179.417 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 334' ' ' GLY . . . . . 0.476 ' CA ' ' HB2' ' C' ' 326' ' ' GLU . . . 82.37 128.01 1.1 Allowed Glycine 0 N--CA 1.492 2.385 0 N-CA-C 109.534 -1.426 . . . . 0.4 109.534 -179.853 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 335' ' ' ARG . . . . . . . . . . . . . 40.3 ttp180 -79.92 -30.48 40.04 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.269 -1.136 . . . . 3.55 110.019 -179.717 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 336' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -55.41 -68.29 0.21 Allowed 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.199 -0.938 . . . . 2.29 109.967 -179.537 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 337' ' ' ARG . . . . . . . . . . . . . 16.3 mmt180 -60.36 -28.05 67.88 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.182 -0.949 . . . . 3.64 109.693 -179.72 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 338' ' ' PHE . . . . . 0.444 ' HA ' HG23 ' A' ' 332' ' ' ILE . 66.2 t80 -55.56 -56.35 21.31 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.141 -0.974 . . . . 0.41 109.749 -179.934 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 339' ' ' GLU . . . . . . . . . . . . . 20.2 mm-40 -51.37 -37.48 48.3 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.276 -0.89 . . . . 1.97 109.948 -179.774 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 340' ' ' MET . . . . . . . . . . . . . 33.6 ttp -64.36 -45.39 87.95 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.138 -0.977 . . . . 1.14 110.252 -179.545 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 341' ' ' PHE . . . . . . . . . . . . . 32.8 m-85 -63.04 -51.07 68.18 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.234 -0.917 . . . . 0.21 110.313 -179.341 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 342' ' ' ARG . . . . . 0.543 ' HG2' ' NH1' ' A' ' 342' ' ' ARG . 4.5 ttt-85 -49.0 -46.2 43.53 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.187 -0.946 . . . . 3.15 110.158 -179.295 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 343' ' ' GLU . . . . . . . . . . . . . 2.1 tt0 -58.44 -43.05 88.6 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.27 -0.894 . . . . 2.35 110.046 -179.408 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 344' ' ' LEU . . . . . 0.425 ' O ' HD21 ' A' ' 348' ' ' LEU . 40.3 mt -62.54 -38.41 89.9 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.111 -0.993 . . . . 1.06 109.828 -179.745 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 345' ' ' ASN . . . . . . . . . . . . . 46.7 t-20 -56.88 -48.43 78.18 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.152 -0.967 . . . . 1.36 109.648 -179.778 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 346' ' ' GLU . . . . . . . . . . . . . 2.9 tt0 -61.7 -33.65 74.39 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.274 -0.891 . . . . 1.65 109.835 -179.776 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 347' ' ' ALA . . . . . . . . . . . . . . . -60.53 -53.76 53.59 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.204 -0.935 . . . . 1.03 110.27 -179.601 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 348' ' ' LEU . . . . . 0.443 ' N ' ' CD2' ' A' ' 348' ' ' LEU . 4.1 mm? -61.51 -48.46 80.93 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.201 -0.937 . . . . 1.04 110.166 -179.319 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 349' ' ' GLU . . . . . . . . . . . . . 64.9 mm-40 -57.86 -32.89 68.1 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.182 -0.949 . . . . 1.94 110.126 -179.426 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 350' ' ' LEU . . . . . 0.461 HD23 HD23 ' B' ' 350' ' ' LEU . 7.7 tt -64.39 -49.11 72.88 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.136 -0.978 . . . . 1.17 109.821 -179.647 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 351' ' ' LYS . . . . . . . . . . . . . 68.0 tttt -59.01 -43.25 91.52 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.193 -0.942 . . . . 1.97 109.781 -179.547 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 352' ' ' ASP . . . . . . . . . . . . . 66.7 m-20 -56.52 -50.91 70.45 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.11 -0.994 . . . . 1.16 109.66 -179.79 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 353' ' ' ALA . . . . . . . . . . . . . . . -68.23 -14.11 62.74 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.308 -0.87 . . . . 1.22 109.803 -179.676 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 354' ' ' GLN . . . . . . . . . . . . . 10.6 tt0 . . . . . 0 N--CA 1.49 1.548 0 O-C-N 121.181 -0.949 . . . . 1.71 109.798 -179.857 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' B' B ' 326' ' ' GLU . . . . . . . . . . . . . 6.5 mm-40 . . . . . 0 N--CA 1.49 1.528 0 CA-C-O 121.285 0.564 . . . . 2.13 109.536 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' B' B ' 327' ' ' TYR . . . . . 0.456 ' CE1' ' HG2' ' D' ' 333' ' ' ARG . 49.0 m-85 -149.33 108.69 3.96 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.264 -0.898 . . . . 0.99 109.373 179.881 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 328' ' ' PHE . . . . . . . . . . . . . 98.0 m-85 -114.09 -167.32 1.2 Allowed 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.242 -0.911 . . . . 0.36 109.73 -179.847 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 329' ' ' THR . . . . . . . . . . . . . 40.9 p -152.81 165.2 36.13 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.423 -0.798 . . . . 1.05 109.041 179.876 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 330' ' ' LEU . . . . . . . . . . . . . 21.4 tp -151.81 129.66 11.68 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.038 -1.039 . . . . 1.07 110.038 -179.647 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 331' ' ' GLN . . . . . . . . . . . . . 1.7 tp60 -88.42 116.32 26.56 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.397 -0.814 . . . . 0.91 109.001 179.528 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 332' ' ' ILE . . . . . 0.435 HG23 ' HA ' ' B' ' 338' ' ' PHE . 35.4 mt -103.74 108.94 25.7 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.614 0 O-C-N 121.18 -0.95 . . . . 1.08 109.988 -179.555 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 333' ' ' ARG . . . . . 0.526 ' HG2' ' CE1' ' D' ' 327' ' ' TYR . 0.1 OUTLIER -73.83 144.57 45.45 Favored 'General case' 0 N--CA 1.489 1.481 0 O-C-N 121.267 -0.896 . . . . 3.42 109.043 179.359 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' B' B ' 334' ' ' GLY . . . . . . . . . . . . . . . 82.65 127.54 1.11 Allowed Glycine 0 N--CA 1.492 2.418 0 N-CA-C 109.491 -1.444 . . . . 0.4 109.491 -179.821 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 335' ' ' ARG . . . . . . . . . . . . . 40.3 ttp180 -79.71 -30.32 40.94 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.333 -1.098 . . . . 3.55 109.944 -179.654 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 336' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -55.6 -68.43 0.2 Allowed 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.128 -0.982 . . . . 2.28 109.824 -179.533 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 337' ' ' ARG . . . . . . . . . . . . . 16.5 mmt180 -60.21 -27.88 67.54 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.192 -0.942 . . . . 3.64 109.67 -179.614 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 338' ' ' PHE . . . . . 0.435 ' HA ' HG23 ' B' ' 332' ' ' ILE . 65.4 t80 -55.73 -56.39 21.06 Favored 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.298 -0.876 . . . . 0.39 109.672 -179.867 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 339' ' ' GLU . . . . . . . . . . . . . 21.2 mm-40 -51.42 -37.56 49.14 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.229 -0.919 . . . . 1.98 109.886 -179.77 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 340' ' ' MET . . . . . . . . . . . . . 33.6 ttp -64.25 -45.54 87.68 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.202 -0.936 . . . . 1.14 110.171 -179.48 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 341' ' ' PHE . . . . . . . . . . . . . 32.6 m-85 -62.88 -50.85 69.26 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.202 -0.936 . . . . 0.22 110.433 -179.331 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 342' ' ' ARG . . . . . 0.535 ' NH1' ' HG2' ' B' ' 342' ' ' ARG . 4.5 ttt-85 -49.25 -46.21 45.78 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.165 -0.959 . . . . 3.15 110.164 -179.337 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 343' ' ' GLU . . . . . . . . . . . . . 2.0 tt0 -58.28 -43.03 87.83 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.061 -1.024 . . . . 2.35 110.016 -179.475 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 344' ' ' LEU . . . . . 0.438 ' O ' HD21 ' B' ' 348' ' ' LEU . 40.2 mt -62.71 -38.19 89.47 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.107 -0.995 . . . . 1.05 109.922 -179.718 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 345' ' ' ASN . . . . . . . . . . . . . 47.0 t-20 -57.13 -48.3 79.0 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.211 -0.931 . . . . 1.35 109.658 -179.825 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 346' ' ' GLU . . . . . . . . . . . . . 2.9 tt0 -61.66 -33.7 74.42 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.206 -0.934 . . . . 1.66 109.812 -179.825 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 347' ' ' ALA . . . . . . . . . . . . . . . -60.56 -53.74 53.81 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.197 -0.939 . . . . 1.02 110.188 -179.526 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 348' ' ' LEU . . . . . 0.452 ' CD2' ' N ' ' B' ' 348' ' ' LEU . 4.1 mm? -61.42 -48.59 80.49 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.221 -0.924 . . . . 1.05 110.178 -179.287 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 349' ' ' GLU . . . . . . . . . . . . . 64.3 mm-40 -57.76 -32.91 67.94 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.188 -0.945 . . . . 1.95 110.105 -179.348 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 350' ' ' LEU . . . . . 0.461 HD23 HD23 ' A' ' 350' ' ' LEU . 7.6 tt -64.44 -49.06 72.94 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.133 -0.979 . . . . 1.18 109.853 -179.631 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 351' ' ' LYS . . . . . . . . . . . . . 67.3 tttt -59.06 -43.41 91.73 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.299 -0.876 . . . . 1.96 109.77 -179.569 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 352' ' ' ASP . . . . . . . . . . . . . 66.7 m-20 -56.25 -50.99 69.75 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.147 -0.971 . . . . 1.16 109.729 -179.902 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 353' ' ' ALA . . . . . . . . . . . . . . . -68.29 -13.98 62.66 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.217 -0.927 . . . . 1.21 109.777 -179.621 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 354' ' ' GLN . . . . . . . . . . . . . 10.5 tt0 . . . . . 0 N--CA 1.49 1.557 0 O-C-N 121.17 -0.956 . . . . 1.69 109.775 -179.871 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' C' C ' 326' ' ' GLU . . . . . 0.476 ' HB2' ' CA ' ' A' ' 334' ' ' GLY . 6.5 mm-40 . . . . . 0 N--CA 1.489 1.516 0 N-CA-C 108.836 -0.802 . . . . 2.17 108.836 . . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 327' ' ' TYR . . . . . 0.427 ' CE1' ' HG2' ' A' ' 333' ' ' ARG . 37.5 m-85 -149.09 102.94 3.29 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.042 -1.036 . . . . 1.03 110.215 -179.583 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' C' C ' 328' ' ' PHE . . . . . 0.445 ' O ' HG21 ' C' ' 329' ' ' THR . 90.6 m-85 -112.98 -165.23 0.97 Allowed 'General case' 0 N--CA 1.489 1.478 0 O-C-N 121.48 -0.762 . . . . 0.37 108.966 179.337 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' C' C ' 329' ' ' THR . . . . . 0.445 HG21 ' O ' ' C' ' 328' ' ' PHE . 54.6 p -155.48 156.45 35.27 Favored 'General case' 0 N--CA 1.489 1.492 0 O-C-N 121.085 -1.01 . . . . 1.04 109.437 179.961 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' C' C ' 330' ' ' LEU . . . . . . . . . . . . . 18.1 tp -148.71 120.06 7.87 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.331 -0.856 . . . . 1.09 109.596 -179.671 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 331' ' ' GLN . . . . . 0.451 ' OE1' ' HB3' ' A' ' 327' ' ' TYR . 0.1 OUTLIER -86.98 117.69 25.87 Favored 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.32 -0.863 . . . . 1.48 109.089 179.743 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' C' C ' 332' ' ' ILE . . . . . . . . . . . . . 18.8 mt -103.8 118.68 51.31 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.557 0 O-C-N 121.116 -0.99 . . . . 1.08 109.972 -179.639 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 333' ' ' ARG . . . . . 0.58 ' HG2' ' CE1' ' A' ' 327' ' ' TYR . 4.1 mtp180 -73.25 143.38 47.1 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.384 -0.823 . . . . 3.36 109.309 179.526 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' C' C ' 334' ' ' GLY . . . . . . . . . . . . . . . 86.22 130.78 2.73 Favored Glycine 0 N--CA 1.491 2.365 0 N-CA-C 109.694 -1.363 . . . . 0.35 109.694 179.867 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 335' ' ' ARG . . . . . 0.441 ' NH1' ' CG ' ' C' ' 335' ' ' ARG . 0.0 OUTLIER -80.25 -37.91 31.99 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.367 -1.078 . . . . 3.23 109.81 -179.994 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' C' C ' 336' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -56.33 -59.0 5.59 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.222 -0.923 . . . . 2.62 109.521 -179.83 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' C' C ' 337' ' ' ARG . . . . . 0.525 ' HD2' ' N ' ' C' ' 337' ' ' ARG . 18.6 mmm180 -60.95 -30.82 70.46 Favored 'General case' 0 N--CA 1.489 1.482 0 O-C-N 121.247 -0.908 . . . . 3.61 109.241 179.836 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' C' C ' 338' ' ' PHE . . . . . 0.434 ' HB3' ' O ' ' C' ' 335' ' ' ARG . 91.7 t80 -55.03 -54.99 36.0 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.326 -0.859 . . . . 0.43 109.554 179.991 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' C' C ' 339' ' ' GLU . . . . . . . . . . . . . 27.4 mt-10 -51.82 -32.81 33.14 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.313 -0.867 . . . . 2.05 110.055 -179.787 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 340' ' ' MET . . . . . . . . . . . . . 3.3 ttt -63.66 -51.7 63.96 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.073 -1.017 . . . . 1.1 110.067 -179.539 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 341' ' ' PHE . . . . . . . . . . . . . 65.1 m-85 -62.68 -46.48 87.96 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.161 -0.962 . . . . 0.21 110.057 -179.506 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 342' ' ' ARG . . . . . 0.463 ' O ' ' HB3' ' C' ' 345' ' ' ASN . 14.6 ttm180 -49.81 -43.53 48.61 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.2 -0.937 . . . . 3.42 109.965 -179.558 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' C' C ' 343' ' ' GLU . . . . . . . . . . . . . 1.3 tt0 -58.19 -48.53 80.02 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.04 -1.037 . . . . 2.14 109.568 -179.685 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 344' ' ' LEU . . . . . . . . . . . . . 36.7 mt -61.82 -26.58 68.2 Favored 'General case' 0 N--CA 1.488 1.469 0 O-C-N 121.229 -0.919 . . . . 1.09 109.549 -179.977 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 345' ' ' ASN . . . . . 0.463 ' HB3' ' O ' ' C' ' 342' ' ' ARG . 24.0 t-20 -57.15 -62.52 1.7 Allowed 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.219 -0.926 . . . . 1.38 109.659 -179.866 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' C' C ' 346' ' ' GLU . . . . . 0.438 ' O ' ' HB2' ' C' ' 350' ' ' LEU . 2.5 tt0 -62.04 -23.66 66.6 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.209 -0.932 . . . . 2.21 109.768 -179.692 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' C' C ' 347' ' ' ALA . . . . . . . . . . . . . . . -62.33 -57.04 12.81 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.194 -0.941 . . . . 1.03 109.865 -179.84 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 348' ' ' LEU . . . . . 0.508 ' N ' ' CD2' ' C' ' 348' ' ' LEU . 3.6 mm? -61.58 -53.46 55.93 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.244 -0.91 . . . . 1.06 110.032 -179.658 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' C' C ' 349' ' ' GLU . . . . . . . . . . . . . 1.5 mt-10 -56.38 -28.83 60.39 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.172 -0.955 . . . . 2.19 109.692 -179.578 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 350' ' ' LEU . . . . . 0.52 ' CD2' ' CD1' ' D' ' 350' ' ' LEU . 10.3 tt -65.24 -48.78 72.11 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.341 -0.849 . . . . 1.2 109.212 179.821 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' C' C ' 351' ' ' LYS . . . . . . . . . . . . . 31.1 tttm -58.26 -42.83 87.29 Favored 'General case' 0 N--CA 1.488 1.454 0 O-C-N 121.466 -0.771 . . . . 1.92 109.579 -179.782 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 352' ' ' ASP . . . . . . . . . . . . . 5.2 m-20 -61.0 -43.05 99.46 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.288 -0.882 . . . . 1.19 109.712 179.752 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 353' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.493 1.701 0 O-C-N 121.275 -0.891 . . . . 1.15 109.855 -179.483 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' D' D ' 326' ' ' GLU . . . . . . . . . . . . . 6.6 mm-40 . . . . . 0 N--CA 1.49 1.531 0 N-CA-C 109.45 -0.574 . . . . 2.13 109.45 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' D' D ' 327' ' ' TYR . . . . . 0.526 ' CE1' ' HG2' ' B' ' 333' ' ' ARG . 49.4 m-85 -149.25 108.81 3.99 Favored 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.295 -0.878 . . . . 1.0 109.371 179.979 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' D' D ' 328' ' ' PHE . . . . . . . . . . . . . 97.9 m-85 -114.09 -167.15 1.17 Allowed 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.352 -0.842 . . . . 0.34 109.687 -179.808 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' D' D ' 329' ' ' THR . . . . . . . . . . . . . 40.7 p -152.97 164.96 36.99 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.369 -0.832 . . . . 1.05 109.024 179.934 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' D' D ' 330' ' ' LEU . . . . . . . . . . . . . 21.3 tp -151.66 129.53 11.69 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.113 -0.992 . . . . 1.07 110.016 -179.571 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' D' D ' 331' ' ' GLN . . . . . . . . . . . . . 1.7 tp60 -88.27 116.38 26.44 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.266 -0.896 . . . . 0.93 108.97 179.506 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' D' D ' 332' ' ' ILE . . . . . 0.445 HG23 ' HA ' ' D' ' 338' ' ' PHE . 36.2 mt -103.81 109.02 25.91 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.57 0 O-C-N 121.023 -1.048 . . . . 1.07 110.071 -179.634 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' D' D ' 333' ' ' ARG . . . . . 0.456 ' HG2' ' CE1' ' B' ' 327' ' ' TYR . 0.1 OUTLIER -73.87 144.54 45.37 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.306 -0.871 . . . . 3.42 109.142 179.442 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' D' D ' 334' ' ' GLY . . . . . . . . . . . . . . . 82.58 127.91 1.14 Allowed Glycine 0 N--CA 1.492 2.399 0 N-CA-C 109.417 -1.473 . . . . 0.41 109.417 -179.841 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' D' D ' 335' ' ' ARG . . . . . . . . . . . . . 40.4 ttp180 -79.96 -30.29 39.8 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.239 -1.153 . . . . 3.58 110.017 -179.722 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' D' D ' 336' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -55.48 -68.47 0.19 Allowed 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.126 -0.984 . . . . 2.26 109.889 -179.568 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' D' D ' 337' ' ' ARG . . . . . . . . . . . . . 16.3 mmt180 -60.23 -27.9 67.57 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.24 -0.913 . . . . 3.64 109.746 -179.787 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' D' D ' 338' ' ' PHE . . . . . 0.445 ' HA ' HG23 ' D' ' 332' ' ' ILE . 65.6 t80 -55.69 -56.41 20.81 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.174 -0.954 . . . . 0.4 109.638 -179.917 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' D' D ' 339' ' ' GLU . . . . . . . . . . . . . 21.7 mm-40 -51.45 -37.51 49.07 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.245 -0.909 . . . . 1.99 109.865 -179.764 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' D' D ' 340' ' ' MET . . . . . . . . . . . . . 33.6 ttp -64.21 -45.78 86.77 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.164 -0.96 . . . . 1.13 110.162 -179.468 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' D' D ' 341' ' ' PHE . . . . . . . . . . . . . 32.5 m-85 -62.61 -51.18 68.31 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.127 -0.983 . . . . 0.21 110.377 -179.357 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' D' D ' 342' ' ' ARG . . . . . 0.531 ' NH1' ' HG2' ' D' ' 342' ' ' ARG . 4.7 ttt-85 -49.06 -46.12 44.0 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.13 -0.981 . . . . 3.15 110.212 -179.314 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' D' D ' 343' ' ' GLU . . . . . . . . . . . . . 2.0 tt0 -58.4 -43.04 88.41 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.115 -0.991 . . . . 2.35 109.921 -179.481 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' D' D ' 344' ' ' LEU . . . . . 0.43 ' O ' HD21 ' D' ' 348' ' ' LEU . 39.1 mt -62.59 -38.37 89.87 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.163 -0.961 . . . . 1.06 109.898 -179.675 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' D' D ' 345' ' ' ASN . . . . . . . . . . . . . 46.4 t-20 -57.01 -48.4 78.56 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.231 -0.918 . . . . 1.35 109.667 -179.838 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' D' D ' 346' ' ' GLU . . . . . . . . . . . . . 2.8 tt0 -61.53 -33.99 74.78 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.22 -0.925 . . . . 1.69 109.753 -179.784 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' D' D ' 347' ' ' ALA . . . . . . . . . . . . . . . -60.27 -53.64 55.22 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.238 -0.914 . . . . 1.03 110.331 -179.594 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' D' D ' 348' ' ' LEU . . . . . 0.452 ' CD2' ' N ' ' D' ' 348' ' ' LEU . 4.2 mm? -61.63 -48.63 79.99 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.187 -0.946 . . . . 1.04 110.112 -179.165 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' D' D ' 349' ' ' GLU . . . . . . . . . . . . . 64.5 mm-40 -57.8 -32.78 67.89 Favored 'General case' 0 N--CA 1.492 1.675 0 O-C-N 121.257 -0.902 . . . . 1.95 110.076 -179.296 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' D' D ' 350' ' ' LEU . . . . . 0.52 ' CD1' ' CD2' ' C' ' 350' ' ' LEU . 7.6 tt -64.48 -49.12 72.64 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.13 -0.981 . . . . 1.16 109.855 -179.697 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' D' D ' 351' ' ' LYS . . . . . . . . . . . . . 66.5 tttt -58.97 -43.1 91.3 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.246 -0.909 . . . . 1.97 109.785 -179.581 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' D' D ' 352' ' ' ASP . . . . . . . . . . . . . 66.7 m-20 -56.58 -51.05 70.1 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.286 -0.884 . . . . 1.17 109.706 -179.848 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' D' D ' 353' ' ' ALA . . . . . . . . . . . . . . . -68.11 -14.01 62.65 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.287 -0.883 . . . . 1.21 109.866 -179.824 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' D' D ' 354' ' ' GLN . . . . . . . . . . . . . 10.5 tt0 . . . . . 0 N--CA 1.492 1.652 0 O-C-N 121.092 -1.005 . . . . 1.68 109.69 -179.867 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 326' ' ' GLU . . . . . . . . . . . . . 11.0 mm-40 . . . . . 0 N--CA 1.488 1.462 0 N-CA-C 109.362 -0.606 . . . . 2.13 109.362 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 327' ' ' TYR . . . . . 0.439 ' CE2' ' HG2' ' C' ' 333' ' ' ARG . 39.5 m-85 -148.7 109.51 4.26 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.244 -0.91 . . . . 1.0 109.732 -179.9 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 328' ' ' PHE . . . . . 0.486 ' CD1' ' N ' ' A' ' 328' ' ' PHE . 5.2 m-85 -113.7 -169.18 1.46 Allowed 'General case' 0 N--CA 1.488 1.473 0 O-C-N 121.401 -0.812 . . . . 0.34 108.969 179.75 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 329' ' ' THR . . . . . . . . . . . . . 23.9 p -154.4 171.67 18.95 Favored 'General case' 0 N--CA 1.489 1.476 0 O-C-N 121.041 -1.037 . . . . 1.05 109.605 -179.763 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 330' ' ' LEU . . . . . . . . . . . . . 29.7 tp -150.49 129.88 12.93 Favored 'General case' 0 N--CA 1.488 1.456 0 O-C-N 121.307 -0.87 . . . . 1.07 109.378 -179.913 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 331' ' ' GLN . . . . . . . . . . . . . 1.6 tp60 -87.27 113.89 23.4 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.19 -0.944 . . . . 0.91 109.511 -179.982 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 332' ' ' ILE . . . . . 0.52 ' CG2' ' HA ' ' A' ' 338' ' ' PHE . 96.1 mt -103.44 99.97 9.48 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.552 0 O-C-N 121.162 -0.961 . . . . 1.09 109.417 179.902 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 333' ' ' ARG . . . . . . . . . . . . . 25.7 mtt180 -71.85 145.29 48.69 Favored 'General case' 0 N--CA 1.489 1.49 0 O-C-N 121.2 -0.937 . . . . 3.41 109.27 179.756 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 334' ' ' GLY . . . . . . . . . . . . . . . 82.71 121.3 0.68 Allowed Glycine 0 N--CA 1.489 2.181 0 N-CA-C 109.452 -1.459 . . . . 0.4 109.452 -179.854 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 335' ' ' ARG . . . . . 0.545 ' NH1' ' HG3' ' A' ' 335' ' ' ARG . 1.3 ttm-85 -69.18 -29.36 67.33 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.327 -1.102 . . . . 3.55 109.684 -179.844 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 336' ' ' GLU . . . . . . . . . . . . . 21.6 tt0 -59.31 -65.63 0.64 Allowed 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.267 -0.896 . . . . 2.29 109.906 -179.763 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 337' ' ' ARG . . . . . 0.61 ' CB ' ' CZ ' ' A' ' 337' ' ' ARG . 0.4 OUTLIER -59.0 -31.05 68.45 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.223 -0.923 . . . . 3.64 109.289 -179.906 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 338' ' ' PHE . . . . . 0.52 ' HA ' ' CG2' ' A' ' 332' ' ' ILE . 54.3 t80 -54.47 -58.09 8.8 Favored 'General case' 0 N--CA 1.488 1.469 0 O-C-N 121.409 -0.807 . . . . 0.41 109.695 -179.856 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 339' ' ' GLU . . . . . . . . . . . . . 12.5 mt-10 -51.19 -34.18 30.58 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.204 -0.935 . . . . 1.97 110.146 -179.709 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 340' ' ' MET . . . . . . . . . . . . . 32.3 ttp -63.9 -51.58 63.87 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.14 -0.975 . . . . 1.14 110.27 -179.388 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 341' ' ' PHE . . . . . 0.426 ' CZ ' ' HA ' ' C' ' 345' ' ' ASN . 39.7 m-85 -62.12 -47.67 83.56 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.11 -0.994 . . . . 0.21 110.029 -179.513 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 342' ' ' ARG . . . . . . . . . . . . . 31.4 ttt180 -48.05 -41.83 26.9 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.246 -0.909 . . . . 3.15 109.95 -179.563 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 343' ' ' GLU . . . . . . . . . . . . . 3.2 tt0 -58.72 -48.27 81.74 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.08 -1.013 . . . . 2.35 109.738 -179.643 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 344' ' ' LEU . . . . . . . . . . . . . 80.9 mt -62.29 -31.2 71.75 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.142 -0.974 . . . . 1.06 109.618 -179.853 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 345' ' ' ASN . . . . . . . . . . . . . 17.5 t-20 -57.16 -60.56 3.43 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.296 -0.878 . . . . 1.36 109.802 -179.67 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 346' ' ' GLU . . . . . 0.413 ' O ' ' HB2' ' A' ' 350' ' ' LEU . 24.9 tt0 -62.35 -25.25 67.8 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.316 -0.865 . . . . 1.65 110.15 -179.684 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 347' ' ' ALA . . . . . 0.472 ' HB2' ' HB2' ' B' ' 347' ' ' ALA . . . -60.33 -59.91 4.65 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.195 -0.941 . . . . 1.03 110.17 -179.568 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 348' ' ' LEU . . . . . 0.487 ' N ' HD23 ' A' ' 348' ' ' LEU . 3.8 mm? -61.34 -49.03 78.6 Favored 'General case' 0 N--CA 1.493 1.711 0 O-C-N 121.274 -0.891 . . . . 1.04 109.901 -179.523 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 349' ' ' GLU . . . . . . . . . . . . . 4.5 mm-40 -57.43 -27.62 62.57 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.223 -0.923 . . . . 1.94 109.798 -179.565 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 350' ' ' LEU . . . . . 0.486 HD23 HD23 ' B' ' 350' ' ' LEU . 2.9 tt -64.49 -43.59 93.66 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.244 -0.91 . . . . 1.17 109.293 -179.984 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 351' ' ' LYS . . . . . . . . . . . . . 33.3 tttt -59.4 -52.94 63.44 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.41 -0.806 . . . . 1.97 109.868 -179.788 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 352' ' ' ASP . . . . . . . . . . . . . 66.9 m-20 -57.17 -38.54 73.74 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.246 -0.909 . . . . 1.16 109.966 -179.594 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 353' ' ' ALA . . . . . . . . . . . . . . . -67.08 -24.67 65.98 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.104 -0.997 . . . . 1.22 109.886 -179.539 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 354' ' ' GLN . . . . . . . . . . . . . 3.8 tt0 . . . . . 0 N--CA 1.491 1.588 0 O-C-N 121.091 -1.005 . . . . 1.71 109.586 -179.854 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' B' B ' 326' ' ' GLU . . . . . . . . . . . . . 10.4 mm-40 . . . . . 0 N--CA 1.489 1.502 0 N-CA-C 109.349 -0.611 . . . . 2.13 109.349 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' B' B ' 327' ' ' TYR . . . . . 0.443 ' CE2' ' HG2' ' D' ' 333' ' ' ARG . 39.8 m-85 -148.62 109.82 4.36 Favored 'General case' 0 N--CA 1.488 1.474 0 O-C-N 121.302 -0.874 . . . . 0.99 109.767 179.987 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 328' ' ' PHE . . . . . 0.485 ' CD1' ' N ' ' B' ' 328' ' ' PHE . 5.5 m-85 -113.73 -168.89 1.41 Allowed 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.293 -0.879 . . . . 0.36 109.057 179.725 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 329' ' ' THR . . . . . 0.474 ' HA ' ' O ' ' D' ' 330' ' ' LEU . 23.5 p -154.46 171.49 19.28 Favored 'General case' 0 N--CA 1.488 1.466 0 O-C-N 121.08 -1.013 . . . . 1.05 109.682 -179.947 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 330' ' ' LEU . . . . . 0.437 ' O ' ' HA ' ' D' ' 329' ' ' THR . 30.1 tp -150.41 129.67 12.82 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.34 -0.85 . . . . 1.07 109.388 -179.95 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 331' ' ' GLN . . . . . . . . . . . . . 1.7 tp60 -87.06 113.86 23.18 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.192 -0.942 . . . . 0.91 109.575 179.917 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 332' ' ' ILE . . . . . 0.52 ' CG2' ' HA ' ' B' ' 338' ' ' PHE . 96.2 mt -103.31 99.94 9.41 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.581 0 O-C-N 121.142 -0.974 . . . . 1.08 109.385 179.889 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 333' ' ' ARG . . . . . . . . . . . . . 25.9 mtt180 -71.94 145.59 48.34 Favored 'General case' 0 N--CA 1.489 1.482 0 O-C-N 121.263 -0.898 . . . . 3.42 109.203 179.79 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 334' ' ' GLY . . . . . . . . . . . . . . . 82.58 121.15 0.66 Allowed Glycine 0 N--CA 1.49 2.238 0 N-CA-C 109.424 -1.47 . . . . 0.4 109.424 -179.903 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 335' ' ' ARG . . . . . 0.557 ' NH1' ' HG3' ' B' ' 335' ' ' ARG . 1.3 ttm-85 -69.02 -29.57 67.76 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.341 -1.094 . . . . 3.55 109.678 -179.879 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 336' ' ' GLU . . . . . . . . . . . . . 21.3 tt0 -59.2 -65.68 0.63 Allowed 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.275 -0.891 . . . . 2.28 109.871 -179.786 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 337' ' ' ARG . . . . . 0.609 ' CB ' ' CZ ' ' B' ' 337' ' ' ARG . 0.4 OUTLIER -59.11 -30.84 68.41 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.155 -0.966 . . . . 3.64 109.326 -179.884 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' B' B ' 338' ' ' PHE . . . . . 0.52 ' HA ' ' CG2' ' B' ' 332' ' ' ILE . 53.5 t80 -54.65 -58.06 9.0 Favored 'General case' 0 N--CA 1.488 1.444 0 O-C-N 121.303 -0.873 . . . . 0.39 109.583 -179.797 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 339' ' ' GLU . . . . . . . . . . . . . 12.6 mt-10 -51.27 -34.08 31.22 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.154 -0.966 . . . . 1.98 110.124 -179.691 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 340' ' ' MET . . . . . . . . . . . . . 32.4 ttp -63.88 -51.75 63.11 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.108 -0.995 . . . . 1.14 110.234 -179.397 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 341' ' ' PHE . . . . . . . . . . . . . 39.5 m-85 -61.96 -47.55 84.34 Favored 'General case' 0 N--CA 1.493 1.675 0 O-C-N 121.108 -0.995 . . . . 0.22 110.089 -179.45 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 342' ' ' ARG . . . . . . . . . . . . . 31.5 ttt180 -48.16 -41.77 27.77 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.28 -0.888 . . . . 3.15 110.006 -179.543 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 343' ' ' GLU . . . . . . . . . . . . . 3.2 tt0 -58.73 -48.15 82.17 Favored 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.14 -0.975 . . . . 2.35 109.781 -179.649 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 344' ' ' LEU . . . . . . . . . . . . . 80.5 mt -62.46 -31.21 71.9 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.151 -0.968 . . . . 1.05 109.624 -179.859 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 345' ' ' ASN . . . . . . . . . . . . . 17.7 t-20 -56.98 -60.73 3.14 Favored 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.163 -0.96 . . . . 1.35 109.786 -179.812 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 346' ' ' GLU . . . . . 0.419 ' O ' ' HB2' ' B' ' 350' ' ' LEU . 24.8 tt0 -62.24 -25.27 67.73 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.304 -0.873 . . . . 1.66 110.152 -179.646 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 347' ' ' ALA . . . . . 0.472 ' HB2' ' HB2' ' A' ' 347' ' ' ALA . . . -60.29 -59.97 4.57 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.087 -1.008 . . . . 1.02 110.17 -179.534 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 348' ' ' LEU . . . . . 0.485 ' N ' HD23 ' B' ' 348' ' ' LEU . 3.7 mm? -61.34 -49.02 78.66 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.262 -0.899 . . . . 1.05 109.994 -179.498 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 349' ' ' GLU . . . . . . . . . . . . . 4.5 mm-40 -57.27 -27.94 62.54 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.165 -0.96 . . . . 1.95 109.784 -179.594 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 350' ' ' LEU . . . . . 0.486 HD23 HD23 ' A' ' 350' ' ' LEU . 2.8 tt -64.28 -43.5 94.61 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.259 -0.901 . . . . 1.18 109.311 -179.989 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 351' ' ' LYS . . . . . . . . . . . . . 33.4 tttt -59.52 -53.13 61.66 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.305 -0.872 . . . . 1.96 109.833 -179.692 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 352' ' ' ASP . . . . . . . . . . . . . 65.9 m-20 -56.97 -38.63 73.27 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.262 -0.899 . . . . 1.16 109.979 -179.733 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 353' ' ' ALA . . . . . . . . . . . . . . . -66.94 -24.86 66.12 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.209 -0.932 . . . . 1.21 109.876 -179.54 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 354' ' ' GLN . . . . . . . . . . . . . 3.7 tt0 . . . . . 0 N--CA 1.492 1.643 0 O-C-N 121.168 -0.958 . . . . 1.69 109.549 -179.889 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' C' C ' 326' ' ' GLU . . . . . . . . . . . . . 66.3 mm-40 . . . . . 0 N--CA 1.487 1.41 0 CA-C-O 121.445 0.64 . . . . 2.17 109.48 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' C' C ' 327' ' ' TYR . . . . . . . . . . . . . 36.2 m-85 -147.47 105.93 3.79 Favored 'General case' 0 C--N 1.302 -1.484 0 O-C-N 121.441 -0.787 . . . . 1.03 109.226 179.661 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 328' ' ' PHE . . . . . . . . . . . . . 43.3 m-85 -113.35 -171.81 1.95 Allowed 'General case' 0 C--N 1.302 -1.461 0 O-C-N 121.297 -0.877 . . . . 0.37 108.91 179.902 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 329' ' ' THR . . . . . . . . . . . . . 19.0 p -152.5 -175.66 5.38 Favored 'General case' 0 C--N 1.302 -1.461 0 O-C-N 121.091 -1.006 . . . . 1.04 109.645 -179.973 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 330' ' ' LEU . . . . . . . . . . . . . 28.1 tp -153.37 128.99 10.03 Favored 'General case' 0 N--CA 1.489 1.492 0 O-C-N 121.331 -0.855 . . . . 1.09 109.557 -179.65 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 331' ' ' GLN . . . . . . . . . . . . . 8.2 tp-100 -89.08 106.49 18.47 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.253 -0.904 . . . . 1.48 109.418 179.759 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 332' ' ' ILE . . . . . 0.468 HD12 ' CD2' ' C' ' 341' ' ' PHE . 68.3 mt -103.55 108.53 24.69 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.557 0 O-C-N 121.193 -0.942 . . . . 1.08 109.813 -179.96 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' C' C ' 333' ' ' ARG . . . . . 0.439 ' HG2' ' CE2' ' A' ' 327' ' ' TYR . 2.1 mpt_? -74.13 156.54 37.27 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.267 -0.895 . . . . 3.36 109.685 179.935 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' C' C ' 334' ' ' GLY . . . . . . . . . . . . . . . 76.93 132.73 0.52 Allowed Glycine 0 N--CA 1.492 2.4 0 N-CA-C 109.9 -1.28 . . . . 0.35 109.9 179.709 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 335' ' ' ARG . . . . . . . . . . . . . 26.4 ttp180 -77.9 -32.83 52.0 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.3 -1.118 . . . . 3.23 109.595 179.947 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 336' ' ' GLU . . . . . . . . . . . . . 1.6 mt-10 -57.05 -59.72 4.65 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.291 -0.88 . . . . 2.62 109.67 -179.707 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 337' ' ' ARG . . . . . 0.544 ' HG2' ' NH1' ' C' ' 337' ' ' ARG . 0.1 OUTLIER -61.23 -35.22 76.63 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.217 -0.927 . . . . 3.61 109.667 -179.742 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' C' C ' 338' ' ' PHE . . . . . . . . . . . . . 51.5 t80 -54.32 -54.86 34.6 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.185 -0.947 . . . . 0.43 109.598 -179.714 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 339' ' ' GLU . . . . . . . . . . . . . 6.9 mt-10 -53.12 -33.39 52.07 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.165 -0.959 . . . . 2.05 109.942 -179.922 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 340' ' ' MET . . . . . . . . . . . . . 25.7 ttp -65.01 -55.35 19.52 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.239 -0.913 . . . . 1.1 110.366 -179.402 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 341' ' ' PHE . . . . . 0.468 ' CD2' HD12 ' C' ' 332' ' ' ILE . 49.7 m-85 -61.39 -35.23 76.93 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.111 -0.993 . . . . 0.21 110.082 -179.231 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' C' C ' 342' ' ' ARG . . . . . . . . . . . . . 10.7 ttt180 -53.33 -49.44 67.06 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.227 -0.92 . . . . 3.42 110.13 -179.807 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 343' ' ' GLU . . . . . . . . . . . . . 2.3 tt0 -59.28 -47.11 86.59 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.214 -0.929 . . . . 2.14 110.289 -179.33 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 344' ' ' LEU . . . . . . . . . . . . . 85.2 mt -60.33 -30.97 69.86 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.065 -1.022 . . . . 1.09 109.641 -179.457 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 345' ' ' ASN . . . . . 0.426 ' HA ' ' CZ ' ' A' ' 341' ' ' PHE . 19.4 t-20 -59.15 -58.84 6.85 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.266 -0.896 . . . . 1.38 109.928 -179.873 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' C' C ' 346' ' ' GLU . . . . . 0.4 ' O ' ' HG3' ' C' ' 346' ' ' GLU . 8.8 tp10 -61.85 -25.5 67.57 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.356 -0.84 . . . . 2.21 110.321 -179.351 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' C' C ' 347' ' ' ALA . . . . . . . . . . . . . . . -58.52 -62.46 1.84 Allowed 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.045 -1.035 . . . . 1.03 110.26 -179.355 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 348' ' ' LEU . . . . . 0.406 ' N ' ' CD2' ' C' ' 348' ' ' LEU . 3.4 mm? -61.34 -42.44 98.69 Favored 'General case' 0 N--CA 1.494 1.761 0 O-C-N 121.181 -0.949 . . . . 1.06 110.014 -179.274 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' C' C ' 349' ' ' GLU . . . . . . . . . . . . . 34.7 mt-10 -57.25 -31.29 65.41 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.109 -0.994 . . . . 2.19 109.709 -179.697 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 350' ' ' LEU . . . . . 0.491 HD23 HD23 ' D' ' 350' ' ' LEU . 5.8 tt -62.87 -43.59 98.38 Favored 'General case' 0 N--CA 1.488 1.453 0 O-C-N 121.106 -0.996 . . . . 1.2 109.604 179.993 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' C' C ' 351' ' ' LYS . . . . . . . . . . . . . 6.0 tttp -58.79 -44.77 90.79 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.288 -0.883 . . . . 1.92 109.831 -179.808 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 352' ' ' ASP . . . . . . . . . . . . . 81.6 m-20 -54.99 -44.64 74.64 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.083 -1.011 . . . . 1.19 109.945 -179.753 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 353' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 1.536 0 O-C-N 121.1 -1.0 . . . . 1.15 109.84 -179.607 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' D' D ' 326' ' ' GLU . . . . . . . . . . . . . 11.1 mm-40 . . . . . 0 N--CA 1.488 1.445 0 N-CA-C 109.37 -0.604 . . . . 2.13 109.37 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' D' D ' 327' ' ' TYR . . . . . . . . . . . . . 40.1 m-85 -148.55 110.02 4.43 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.225 -0.922 . . . . 1.0 109.721 -179.985 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' D' D ' 328' ' ' PHE . . . . . 0.478 ' CD1' ' N ' ' D' ' 328' ' ' PHE . 5.4 m-85 -113.96 -168.9 1.42 Allowed 'General case' 0 N--CA 1.489 1.483 0 O-C-N 121.345 -0.847 . . . . 0.34 109.064 179.679 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' D' D ' 329' ' ' THR . . . . . 0.437 ' HA ' ' O ' ' B' ' 330' ' ' LEU . 23.8 p -154.45 171.75 18.86 Favored 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.216 -0.928 . . . . 1.05 109.613 -179.88 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' D' D ' 330' ' ' LEU . . . . . 0.474 ' O ' ' HA ' ' B' ' 329' ' ' THR . 29.8 tp -150.65 129.53 12.48 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.299 -0.876 . . . . 1.07 109.369 -179.943 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' D' D ' 331' ' ' GLN . . . . . . . . . . . . . 1.6 tp60 -87.0 113.92 23.17 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.259 -0.901 . . . . 0.93 109.578 179.958 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' D' D ' 332' ' ' ILE . . . . . 0.519 ' CG2' ' HA ' ' D' ' 338' ' ' PHE . 96.2 mt -103.29 100.03 9.6 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.522 0 O-C-N 121.223 -0.923 . . . . 1.07 109.421 179.882 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' D' D ' 333' ' ' ARG . . . . . 0.443 ' HG2' ' CE2' ' B' ' 327' ' ' TYR . 26.2 mtt180 -71.88 145.61 48.43 Favored 'General case' 0 N--CA 1.488 1.427 0 O-C-N 121.253 -0.905 . . . . 3.42 109.225 179.761 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' D' D ' 334' ' ' GLY . . . . . . . . . . . . . . . 82.75 121.21 0.68 Allowed Glycine 0 N--CA 1.49 2.253 0 N-CA-C 109.518 -1.433 . . . . 0.41 109.518 -179.93 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' D' D ' 335' ' ' ARG . . . . . 0.542 ' NH1' ' HG3' ' D' ' 335' ' ' ARG . 1.3 ttm-85 -69.02 -29.98 68.27 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.324 -1.103 . . . . 3.58 109.613 -179.94 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' D' D ' 336' ' ' GLU . . . . . . . . . . . . . 21.3 tt0 -58.93 -65.57 0.64 Allowed 'General case' 0 N--CA 1.491 1.625 0 O-C-N 121.239 -0.913 . . . . 2.26 109.95 -179.728 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' D' D ' 337' ' ' ARG . . . . . 0.588 ' CZ ' ' CB ' ' D' ' 337' ' ' ARG . 0.4 OUTLIER -59.22 -30.77 68.48 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.172 -0.955 . . . . 3.64 109.355 -179.877 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' D' D ' 338' ' ' PHE . . . . . 0.519 ' HA ' ' CG2' ' D' ' 332' ' ' ILE . 54.0 t80 -54.61 -58.01 9.19 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.389 -0.819 . . . . 0.4 109.635 -179.951 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' D' D ' 339' ' ' GLU . . . . . . . . . . . . . 12.6 mt-10 -51.37 -34.2 33.17 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.207 -0.933 . . . . 1.99 110.093 -179.636 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' D' D ' 340' ' ' MET . . . . . . . . . . . . . 32.3 ttp -63.79 -51.53 64.38 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.077 -1.015 . . . . 1.13 110.327 -179.5 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' D' D ' 341' ' ' PHE . . . . . . . . . . . . . 39.2 m-85 -62.17 -47.67 83.48 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.128 -0.982 . . . . 0.21 110.043 -179.438 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' D' D ' 342' ' ' ARG . . . . . . . . . . . . . 31.1 ttt180 -47.89 -41.98 25.73 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.286 -0.883 . . . . 3.15 110.042 -179.606 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' D' D ' 343' ' ' GLU . . . . . . . . . . . . . 3.2 tt0 -58.72 -48.07 82.42 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.156 -0.965 . . . . 2.35 109.729 -179.556 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' D' D ' 344' ' ' LEU . . . . . . . . . . . . . 80.2 mt -62.49 -31.29 72.01 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.244 -0.91 . . . . 1.06 109.624 -179.772 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' D' D ' 345' ' ' ASN . . . . . . . . . . . . . 17.4 t-20 -56.91 -60.42 3.6 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.279 -0.888 . . . . 1.35 109.798 -179.775 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' D' D ' 346' ' ' GLU . . . . . 0.42 ' O ' ' HB2' ' D' ' 350' ' ' LEU . 24.8 tt0 -62.69 -25.4 68.13 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.179 -0.95 . . . . 1.69 110.077 -179.55 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' D' D ' 347' ' ' ALA . . . . . . . . . . . . . . . -60.18 -59.87 4.72 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.173 -0.954 . . . . 1.03 110.06 -179.518 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' D' D ' 348' ' ' LEU . . . . . 0.499 ' N ' HD23 ' D' ' 348' ' ' LEU . 3.8 mm? -61.44 -49.11 78.16 Favored 'General case' 0 N--CA 1.493 1.722 0 O-C-N 121.248 -0.907 . . . . 1.04 110.02 -179.48 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' D' D ' 349' ' ' GLU . . . . . . . . . . . . . 4.5 mm-40 -57.21 -27.77 62.27 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.186 -0.946 . . . . 1.95 109.77 -179.602 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' D' D ' 350' ' ' LEU . . . . . 0.491 HD23 HD23 ' C' ' 350' ' ' LEU . 2.7 tt -64.59 -43.52 93.57 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.142 -0.974 . . . . 1.16 109.268 -179.979 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' D' D ' 351' ' ' LYS . . . . . . . . . . . . . 32.9 tttt -59.28 -53.14 61.59 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.3 -0.875 . . . . 1.97 109.913 -179.84 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' D' D ' 352' ' ' ASP . . . . . . . . . . . . . 66.6 m-20 -56.96 -38.65 73.27 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.146 -0.971 . . . . 1.17 110.006 -179.745 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' D' D ' 353' ' ' ALA . . . . . . . . . . . . . . . -66.89 -24.73 66.14 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.144 -0.972 . . . . 1.21 109.917 -179.555 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' D' D ' 354' ' ' GLN . . . . . . . . . . . . . 3.7 tt0 . . . . . 0 N--CA 1.49 1.556 0 O-C-N 121.205 -0.934 . . . . 1.68 109.621 -179.885 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 326' ' ' GLU . . . . . . . . . . . . . 35.5 mm-40 . . . . . 0 N--CA 1.492 1.63 0 N-CA-C 109.241 -0.651 . . . . 2.13 109.241 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 327' ' ' TYR . . . . . 0.442 ' CE1' ' HG2' ' C' ' 333' ' ' ARG . 49.7 m-85 -150.17 111.75 4.48 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.235 -0.916 . . . . 1.0 109.617 -179.892 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 328' ' ' PHE . . . . . . . . . . . . . 46.2 m-85 -112.56 -170.07 1.6 Allowed 'General case' 0 N--CA 1.488 1.465 0 O-C-N 121.358 -0.839 . . . . 0.34 109.425 179.934 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 329' ' ' THR . . . . . 0.474 ' HA ' ' O ' ' C' ' 330' ' ' LEU . 9.1 p -153.38 175.62 12.93 Favored 'General case' 0 N--CA 1.487 1.416 0 O-C-N 121.203 -0.936 . . . . 1.05 109.404 -179.899 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 330' ' ' LEU . . . . . 0.479 ' O ' ' HA ' ' C' ' 329' ' ' THR . 29.2 tp -151.49 133.46 15.06 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.192 -0.942 . . . . 1.07 109.665 -179.698 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 331' ' ' GLN . . . . . . . . . . . . . 1.9 tp60 -85.64 110.42 19.26 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.365 -0.834 . . . . 0.91 109.222 179.784 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 332' ' ' ILE . . . . . 0.448 ' CG2' ' HA ' ' A' ' 338' ' ' PHE . 83.0 mt -103.11 103.99 15.94 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.659 0 O-C-N 121.251 -0.906 . . . . 1.09 109.404 -179.772 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 333' ' ' ARG . . . . . 0.48 ' HG2' ' CE1' ' C' ' 327' ' ' TYR . 85.4 mtt180 -73.34 143.88 46.73 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.178 -0.951 . . . . 3.41 109.424 179.891 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 334' ' ' GLY . . . . . . . . . . . . . . . 88.99 131.94 4.24 Favored Glycine 0 N--CA 1.49 2.279 0 N-CA-C 109.636 -1.386 . . . . 0.4 109.636 179.932 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 335' ' ' ARG . . . . . . . . . . . . . 58.7 ttt180 -80.23 -41.19 25.58 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.304 -1.115 . . . . 3.55 109.76 -179.92 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 336' ' ' GLU . . . . . . . . . . . . . 2.4 tt0 -58.49 -59.25 5.66 Favored 'General case' 0 N--CA 1.489 1.492 0 O-C-N 121.179 -0.951 . . . . 2.29 109.685 -179.754 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 337' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -59.43 -33.29 71.06 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.235 -0.916 . . . . 3.64 109.422 179.993 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 338' ' ' PHE . . . . . 0.448 ' HA ' ' CG2' ' A' ' 332' ' ' ILE . 43.6 t80 -55.51 -56.74 16.8 Favored 'General case' 0 N--CA 1.488 1.425 0 O-C-N 121.219 -0.926 . . . . 0.41 109.456 179.95 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 339' ' ' GLU . . . . . . . . . . . . . 43.4 mt-10 -51.29 -30.9 19.51 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.23 -0.919 . . . . 1.97 109.925 179.979 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 340' ' ' MET . . . . . . . . . . . . . 6.1 ttp -63.34 -53.15 57.05 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.128 -0.983 . . . . 1.14 109.919 -179.505 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 341' ' ' PHE . . . . . . . . . . . . . 40.6 m-85 -62.03 -43.65 98.39 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.208 -0.933 . . . . 0.21 109.719 -179.918 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 342' ' ' ARG . . . . . 0.456 ' NH1' ' CG ' ' A' ' 342' ' ' ARG . 0.0 OUTLIER -49.58 -41.06 40.79 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.178 -0.951 . . . . 3.15 109.562 -179.924 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 343' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -59.68 -47.54 85.21 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.28 -0.887 . . . . 2.35 109.638 -179.816 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 344' ' ' LEU . . . . . . . . . . . . . 53.2 mt -62.24 -31.68 72.27 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.237 -0.914 . . . . 1.06 109.566 -179.81 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 345' ' ' ASN . . . . . . . . . . . . . 10.4 t-20 -57.11 -57.26 13.35 Favored 'General case' 0 N--CA 1.488 1.467 0 O-C-N 121.257 -0.902 . . . . 1.36 109.772 -179.95 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 346' ' ' GLU . . . . . . . . . . . . . 64.9 tt0 -61.74 -26.47 68.08 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.311 -0.868 . . . . 1.65 109.68 -179.851 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 347' ' ' ALA . . . . . . . . . . . . . . . -61.82 -61.18 2.69 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.229 -0.919 . . . . 1.03 110.064 -179.59 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 348' ' ' LEU . . . . . 0.416 ' N ' ' CD2' ' A' ' 348' ' ' LEU . 4.1 mm? -59.79 -44.84 93.75 Favored 'General case' 0 N--CA 1.493 1.725 0 O-C-N 121.137 -0.977 . . . . 1.04 109.825 -179.519 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 349' ' ' GLU . . . . . . . . . . . . . 92.8 mt-10 -57.95 -32.47 67.85 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.196 -0.94 . . . . 1.94 109.901 -179.571 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 350' ' ' LEU . . . . . 0.523 HD21 ' CD1' ' B' ' 350' ' ' LEU . 5.9 tt -64.03 -45.55 88.38 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.24 -0.913 . . . . 1.17 109.274 -179.894 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 351' ' ' LYS . . . . . . . . . . . . . 85.9 tttt -60.26 -41.57 93.52 Favored 'General case' 0 C--N 1.303 -1.454 0 O-C-N 121.436 -0.79 . . . . 1.97 109.319 179.991 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 352' ' ' ASP . . . . . . . . . . . . . 21.1 m-20 -57.83 -40.91 81.14 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.406 -0.809 . . . . 1.16 109.841 179.922 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 353' ' ' ALA . . . . . . . . . . . . . . . -66.99 -21.2 65.97 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.293 -0.879 . . . . 1.22 109.798 -179.602 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 354' ' ' GLN . . . . . . . . . . . . . 5.6 tt0 . . . . . 0 C--N 1.302 -1.459 0 O-C-N 121.04 -1.038 . . . . 1.71 109.0 179.729 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' B' B ' 326' ' ' GLU . . . . . . . . . . . . . 37.5 mm-40 . . . . . 0 N--CA 1.49 1.554 0 N-CA-C 109.224 -0.658 . . . . 2.13 109.224 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' B' B ' 327' ' ' TYR . . . . . . . . . . . . . 50.4 m-85 -149.85 112.12 4.67 Favored 'General case' 0 N--CA 1.488 1.469 0 O-C-N 121.205 -0.934 . . . . 0.99 109.489 179.91 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 328' ' ' PHE . . . . . . . . . . . . . 47.6 m-85 -112.73 -170.21 1.62 Allowed 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.401 -0.812 . . . . 0.36 109.216 179.879 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 329' ' ' THR . . . . . . . . . . . . . 9.3 p -153.41 175.51 13.06 Favored 'General case' 0 N--CA 1.489 1.485 0 O-C-N 121.282 -0.886 . . . . 1.05 109.315 -179.89 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 330' ' ' LEU . . . . . 0.448 ' O ' ' HA ' ' D' ' 329' ' ' THR . 27.1 tp -151.21 133.92 15.65 Favored 'General case' 0 N--CA 1.488 1.442 0 O-C-N 121.167 -0.958 . . . . 1.07 109.644 -179.761 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 331' ' ' GLN . . . . . . . . . . . . . 1.9 tp60 -85.79 110.18 19.18 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.416 -0.803 . . . . 0.91 109.158 179.839 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 332' ' ' ILE . . . . . 0.431 ' CG2' ' HA ' ' B' ' 338' ' ' PHE . 83.5 mt -103.07 103.29 14.87 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.668 0 O-C-N 121.249 -0.907 . . . . 1.08 109.72 -179.737 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 333' ' ' ARG . . . . . 0.424 ' HG2' ' CD1' ' D' ' 327' ' ' TYR . 85.0 mtt180 -72.72 143.95 47.84 Favored 'General case' 0 N--CA 1.489 1.481 0 O-C-N 121.252 -0.905 . . . . 3.42 109.492 179.834 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 334' ' ' GLY . . . . . . . . . . . . . . . 89.11 132.13 4.36 Favored Glycine 0 N--CA 1.492 2.377 0 N-CA-C 109.561 -1.415 . . . . 0.4 109.561 -179.95 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 335' ' ' ARG . . . . . . . . . . . . . 58.4 ttt180 -80.31 -41.7 24.39 Favored 'General case' 0 N--CA 1.489 1.481 0 O-C-N 121.221 -1.164 . . . . 3.55 109.53 -179.99 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 336' ' ' GLU . . . . . . . . . . . . . 2.5 tt0 -58.0 -59.68 4.9 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.27 -0.894 . . . . 2.28 109.685 -179.823 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 337' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -58.86 -33.59 70.63 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.148 -0.97 . . . . 3.64 109.395 -179.872 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 338' ' ' PHE . . . . . 0.431 ' HA ' ' CG2' ' B' ' 332' ' ' ILE . 45.8 t80 -55.14 -56.72 16.75 Favored 'General case' 0 N--CA 1.487 1.397 0 O-C-N 121.324 -0.86 . . . . 0.39 109.623 179.963 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 339' ' ' GLU . . . . . . . . . . . . . 44.7 mt-10 -51.58 -30.46 20.98 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.205 -0.934 . . . . 1.98 109.984 -179.98 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 340' ' ' MET . . . . . . . . . . . . . 5.8 ttp -63.55 -53.71 47.51 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.177 -0.952 . . . . 1.14 109.784 -179.461 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 341' ' ' PHE . . . . . . . . . . . . . 39.8 m-85 -61.76 -43.84 98.06 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.282 -0.886 . . . . 0.22 109.637 -179.812 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 342' ' ' ARG . . . . . 0.432 ' CG ' HH11 ' B' ' 342' ' ' ARG . 0.1 OUTLIER -49.02 -41.7 35.62 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.258 -0.901 . . . . 3.15 109.711 -179.948 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' B' B ' 343' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -58.98 -48.69 80.66 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.266 -0.896 . . . . 2.35 109.599 -179.987 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 344' ' ' LEU . . . . . . . . . . . . . 59.6 mt -61.12 -31.18 70.89 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.253 -0.904 . . . . 1.05 109.807 -179.753 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 345' ' ' ASN . . . . . . . . . . . . . 10.5 t-20 -57.95 -56.91 15.92 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.192 -0.943 . . . . 1.35 109.681 -179.833 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 346' ' ' GLU . . . . . . . . . . . . . 62.4 tt0 -62.02 -26.38 68.2 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.226 -0.921 . . . . 1.66 109.572 -179.768 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 347' ' ' ALA . . . . . . . . . . . . . . . -61.86 -60.62 3.38 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.192 -0.943 . . . . 1.02 110.202 -179.687 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 348' ' ' LEU . . . . . 0.474 ' CD1' ' NH2' ' D' ' 337' ' ' ARG . 4.2 mm? -60.27 -45.16 94.27 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.045 -1.034 . . . . 1.05 109.683 -179.441 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 349' ' ' GLU . . . . . . . . . . . . . 93.2 mt-10 -57.34 -33.36 67.67 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.386 -0.821 . . . . 1.95 109.863 -179.649 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 350' ' ' LEU . . . . . 0.523 ' CD1' HD21 ' A' ' 350' ' ' LEU . 5.9 tt -63.13 -46.63 86.36 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.122 -0.986 . . . . 1.18 109.167 179.988 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 351' ' ' LYS . . . . . . . . . . . . . 87.5 tttt -59.23 -41.41 88.64 Favored 'General case' 0 N--CA 1.488 1.462 0 O-C-N 121.244 -0.91 . . . . 1.96 109.455 179.856 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 352' ' ' ASP . . . . . . . . . . . . . 21.1 m-20 -58.11 -40.99 82.59 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.095 -1.003 . . . . 1.16 110.06 -179.874 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 353' ' ' ALA . . . . . . . . . . . . . . . -66.48 -21.98 66.19 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.251 -0.905 . . . . 1.21 109.66 -179.64 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 354' ' ' GLN . . . . . . . . . . . . . 5.5 tt0 . . . . . 0 N--CA 1.492 1.627 0 O-C-N 121.205 -0.934 . . . . 1.69 109.241 179.853 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' C' C ' 326' ' ' GLU . . . . . . . . . . . . . 45.0 mt-10 . . . . . 0 N--CA 1.491 1.595 0 CA-C-O 121.308 0.575 . . . . 2.17 109.763 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' C' C ' 327' ' ' TYR . . . . . 0.48 ' CE1' ' HG2' ' A' ' 333' ' ' ARG . 59.1 m-85 -150.77 108.04 3.61 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.39 -0.819 . . . . 1.03 109.507 -179.905 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' C' C ' 328' ' ' PHE . . . . . 0.402 ' O ' ' CG2' ' C' ' 329' ' ' THR . 67.3 m-85 -104.12 -164.02 1.02 Allowed 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.201 -0.937 . . . . 0.37 109.825 -179.885 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' C' C ' 329' ' ' THR . . . . . 0.479 ' HA ' ' O ' ' A' ' 330' ' ' LEU . 56.1 p -156.28 177.8 11.03 Favored 'General case' 0 N--CA 1.491 1.589 0 N-CA-C 108.997 -0.742 . . . . 1.04 108.997 179.748 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' C' C ' 330' ' ' LEU . . . . . 0.474 ' O ' ' HA ' ' A' ' 329' ' ' THR . 39.3 tp -153.48 132.09 12.23 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 120.949 -1.095 . . . . 1.09 109.492 179.823 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' C' C ' 331' ' ' GLN . . . . . . . . . . . . . 1.1 tp60 -87.56 114.04 23.81 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.133 -0.979 . . . . 1.48 109.547 179.791 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 332' ' ' ILE . . . . . 0.452 HD12 ' CB ' ' C' ' 341' ' ' PHE . 48.5 mt -103.91 108.28 24.23 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.526 0 O-C-N 121.197 -0.939 . . . . 1.08 109.728 -179.933 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' C' C ' 333' ' ' ARG . . . . . 0.442 ' HG2' ' CE1' ' A' ' 327' ' ' TYR . 5.1 mtp180 -72.89 144.98 47.18 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.006 -1.058 . . . . 3.36 109.488 179.848 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' C' C ' 334' ' ' GLY . . . . . . . . . . . . . . . 73.05 130.92 0.15 Allowed Glycine 0 N--CA 1.491 2.322 0 N-CA-C 109.93 -1.268 . . . . 0.35 109.93 179.794 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 335' ' ' ARG . . . . . 0.479 ' O ' ' HB3' ' C' ' 338' ' ' PHE . 2.4 ttp180 -73.45 -27.77 61.6 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.238 -1.154 . . . . 3.23 109.667 179.922 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' C' C ' 336' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -57.08 -58.82 6.52 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 120.961 -1.087 . . . . 2.62 109.158 -179.987 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' C' C ' 337' ' ' ARG . . . . . 0.55 ' HG3' ' NH1' ' C' ' 337' ' ' ARG . 0.5 OUTLIER -60.95 -30.83 70.47 Favored 'General case' 0 N--CA 1.488 1.474 0 O-C-N 121.296 -0.877 . . . . 3.61 108.776 179.618 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' C' C ' 338' ' ' PHE . . . . . 0.479 ' HB3' ' O ' ' C' ' 335' ' ' ARG . 82.6 t80 -54.89 -58.66 6.68 Favored 'General case' 0 C--N 1.304 -1.378 0 O-C-N 121.345 -0.847 . . . . 0.43 109.646 -179.835 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' C' C ' 339' ' ' GLU . . . . . . . . . . . . . 41.2 mt-10 -50.97 -32.63 21.62 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.07 -1.018 . . . . 2.05 109.989 -179.657 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 340' ' ' MET . . . . . . . . . . . . . 29.8 ttp -65.37 -56.24 13.71 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.242 -0.911 . . . . 1.1 110.208 -179.472 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 341' ' ' PHE . . . . . 0.452 ' CB ' HD12 ' C' ' 332' ' ' ILE . 63.9 m-85 -61.44 -53.51 55.53 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.091 -1.006 . . . . 0.21 110.155 -179.416 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' C' C ' 342' ' ' ARG . . . . . 0.438 ' NH1' ' CG ' ' C' ' 342' ' ' ARG . 0.0 OUTLIER -44.8 -41.15 6.73 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.255 -0.903 . . . . 3.42 110.051 -179.265 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' C' C ' 343' ' ' GLU . . . . . . . . . . . . . 36.6 tt0 -57.89 -51.42 69.67 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.162 -0.961 . . . . 2.14 109.77 -179.91 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 344' ' ' LEU . . . . . 0.458 ' O ' HD21 ' C' ' 348' ' ' LEU . 55.8 mt -62.73 -26.87 68.9 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.329 -0.857 . . . . 1.09 109.7 179.983 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' C' C ' 345' ' ' ASN . . . . . . . . . . . . . 13.2 t-20 -58.0 -58.54 7.96 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.281 -0.887 . . . . 1.38 109.501 -179.957 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 346' ' ' GLU . . . . . . . . . . . . . 10.0 tp10 -62.2 -28.88 69.99 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.456 -0.778 . . . . 2.21 109.722 -179.667 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 347' ' ' ALA . . . . . . . . . . . . . . . -60.7 -57.79 11.21 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.103 -0.998 . . . . 1.03 109.984 -179.72 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 348' ' ' LEU . . . . . 0.458 HD21 ' O ' ' C' ' 344' ' ' LEU . 3.5 mm? -62.5 -45.8 91.35 Favored 'General case' 0 N--CA 1.494 1.761 0 O-C-N 121.096 -1.002 . . . . 1.06 110.044 -179.494 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' C' C ' 349' ' ' GLU . . . . . . . . . . . . . 1.3 mm-40 -55.02 -36.02 65.04 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.276 -0.89 . . . . 2.19 109.886 -179.223 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 350' ' ' LEU . . . . . 0.496 HD21 ' CD1' ' D' ' 350' ' ' LEU . 7.0 tt -63.46 -46.88 84.22 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.355 -0.841 . . . . 1.2 109.894 -179.632 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' C' C ' 351' ' ' LYS . . . . . . . . . . . . . 22.8 tttt -58.32 -40.24 81.55 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.355 -0.841 . . . . 1.92 109.672 -179.66 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 352' ' ' ASP . . . . . . . . . . . . . 52.0 m-20 -57.12 -51.69 68.29 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.361 -0.837 . . . . 1.19 109.925 179.993 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 353' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 1.538 0 O-C-N 121.154 -0.966 . . . . 1.15 109.923 -179.233 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' D' D ' 326' ' ' GLU . . . . . . . . . . . . . 38.1 mm-40 . . . . . 0 N--CA 1.491 1.575 0 N-CA-C 109.237 -0.653 . . . . 2.13 109.237 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' D' D ' 327' ' ' TYR . . . . . 0.424 ' CD1' ' HG2' ' B' ' 333' ' ' ARG . 49.0 m-85 -149.67 111.92 4.67 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.22 -0.925 . . . . 1.0 109.553 179.977 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' D' D ' 328' ' ' PHE . . . . . . . . . . . . . 50.6 m-85 -112.12 -170.12 1.6 Allowed 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.265 -0.897 . . . . 0.34 109.206 179.856 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' D' D ' 329' ' ' THR . . . . . 0.448 ' HA ' ' O ' ' B' ' 330' ' ' LEU . 9.8 p -153.2 175.7 12.76 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.231 -0.918 . . . . 1.05 109.147 -179.85 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' D' D ' 330' ' ' LEU . . . . . . . . . . . . . 26.0 tp -151.63 134.03 15.35 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.116 -0.99 . . . . 1.07 109.631 -179.762 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' D' D ' 331' ' ' GLN . . . . . . . . . . . . . 1.9 tp60 -85.81 110.28 19.26 Favored 'General case' 0 N--CA 1.488 1.454 0 O-C-N 121.248 -0.907 . . . . 0.93 109.31 179.88 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' D' D ' 332' ' ' ILE . . . . . 0.439 ' CG2' ' HA ' ' D' ' 338' ' ' PHE . 86.1 mt -102.85 103.37 14.97 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.573 0 O-C-N 121.226 -0.921 . . . . 1.07 109.541 -179.819 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' D' D ' 333' ' ' ARG . . . . . . . . . . . . . 84.9 mtt180 -73.09 143.31 47.44 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.25 -0.906 . . . . 3.42 109.498 179.81 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' D' D ' 334' ' ' GLY . . . . . . . . . . . . . . . 89.16 131.65 4.22 Favored Glycine 0 N--CA 1.49 2.278 0 N-CA-C 109.49 -1.444 . . . . 0.41 109.49 -179.907 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' D' D ' 335' ' ' ARG . . . . . . . . . . . . . 55.9 ttt180 -79.77 -41.71 26.01 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.352 -1.087 . . . . 3.58 109.835 -179.672 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' D' D ' 336' ' ' GLU . . . . . . . . . . . . . 2.8 tt0 -58.26 -58.73 7.19 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.25 -0.906 . . . . 2.26 109.736 -179.724 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' D' D ' 337' ' ' ARG . . . . . 0.474 ' NH2' ' CD1' ' B' ' 348' ' ' LEU . 0.9 OUTLIER -59.75 -33.25 71.42 Favored 'General case' 0 N--CA 1.489 1.478 0 O-C-N 121.28 -0.887 . . . . 3.64 109.354 -179.965 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' D' D ' 338' ' ' PHE . . . . . 0.439 ' HA ' ' CG2' ' D' ' 332' ' ' ILE . 45.7 t80 -55.5 -57.03 13.57 Favored 'General case' 0 N--CA 1.489 1.478 0 O-C-N 121.22 -0.925 . . . . 0.4 109.435 179.978 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' D' D ' 339' ' ' GLU . . . . . . . . . . . . . 45.3 mt-10 -51.25 -31.37 20.69 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.229 -0.919 . . . . 1.99 109.726 -179.856 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' D' D ' 340' ' ' MET . . . . . . . . . . . . . 5.3 ttp -62.59 -53.96 46.8 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.223 -0.923 . . . . 1.13 109.859 -179.576 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' D' D ' 341' ' ' PHE . . . . . . . . . . . . . 40.2 m-85 -61.74 -43.38 98.97 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.145 -0.972 . . . . 0.21 109.692 -179.727 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' D' D ' 342' ' ' ARG . . . . . 0.435 ' NH1' ' CG ' ' D' ' 342' ' ' ARG . 0.1 OUTLIER -49.51 -41.13 40.14 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.268 -0.895 . . . . 3.15 109.608 -179.789 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' D' D ' 343' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -59.36 -48.0 83.3 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.293 -0.88 . . . . 2.35 109.647 -179.862 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' D' D ' 344' ' ' LEU . . . . . . . . . . . . . 57.4 mt -61.99 -30.94 71.28 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.171 -0.956 . . . . 1.06 109.815 -179.777 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' D' D ' 345' ' ' ASN . . . . . . . . . . . . . 10.6 t-20 -57.91 -57.4 12.98 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.157 -0.964 . . . . 1.35 109.559 -179.913 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' D' D ' 346' ' ' GLU . . . . . . . . . . . . . 60.3 tt0 -61.55 -26.63 68.07 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.104 -0.997 . . . . 1.69 109.543 -179.854 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' D' D ' 347' ' ' ALA . . . . . . . . . . . . . . . -60.94 -61.58 2.48 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.137 -0.977 . . . . 1.03 110.136 -179.784 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' D' D ' 348' ' ' LEU . . . . . 0.424 ' N ' HD23 ' D' ' 348' ' ' LEU . 4.2 mm? -60.03 -44.13 94.83 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.164 -0.96 . . . . 1.04 109.946 -179.495 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' D' D ' 349' ' ' GLU . . . . . . . . . . . . . 92.8 mt-10 -58.08 -33.1 68.7 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.067 -1.02 . . . . 1.95 109.851 -179.542 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' D' D ' 350' ' ' LEU . . . . . 0.496 ' CD1' HD21 ' C' ' 350' ' ' LEU . 5.9 tt -63.52 -45.99 88.08 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.201 -0.937 . . . . 1.16 109.352 -179.975 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' D' D ' 351' ' ' LYS . . . . . . . . . . . . . 88.1 tttt -59.68 -41.61 91.08 Favored 'General case' 0 N--CA 1.488 1.456 0 O-C-N 121.298 -0.876 . . . . 1.97 109.383 179.957 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' D' D ' 352' ' ' ASP . . . . . . . . . . . . . 20.9 m-20 -58.17 -40.42 81.41 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.399 -0.813 . . . . 1.17 109.881 179.955 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' D' D ' 353' ' ' ALA . . . . . . . . . . . . . . . -67.56 -20.86 65.45 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.203 -0.936 . . . . 1.21 109.602 -179.39 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' D' D ' 354' ' ' GLN . . . . . . . . . . . . . 5.6 tt0 . . . . . 0 N--CA 1.49 1.55 0 O-C-N 121.1 -1.0 . . . . 1.68 109.169 179.708 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 326' ' ' GLU . . . . . . . . . . . . . 2.9 mm-40 . . . . . 0 N--CA 1.49 1.566 0 N-CA-C 109.343 -0.614 . . . . 2.13 109.343 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 327' ' ' TYR . . . . . . . . . . . . . 44.0 m-85 -149.61 112.21 4.76 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.24 -0.912 . . . . 1.0 109.643 179.994 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 328' ' ' PHE . . . . . 0.511 ' CE2' ' HB2' ' C' ' 335' ' ' ARG . 95.9 m-85 -114.26 -168.07 1.31 Allowed 'General case' 0 N--CA 1.488 1.465 0 O-C-N 121.236 -0.915 . . . . 0.34 109.316 179.957 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 329' ' ' THR . . . . . . . . . . . . . 40.2 p -152.77 162.14 41.65 Favored 'General case' 0 N--CA 1.489 1.482 0 O-C-N 121.284 -0.885 . . . . 1.05 109.575 179.927 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 330' ' ' LEU . . . . . . . . . . . . . 18.4 tp -150.58 130.52 13.38 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.375 -0.828 . . . . 1.07 109.433 -179.958 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 331' ' ' GLN . . . . . 0.426 ' HG3' ' O ' ' C' ' 328' ' ' PHE . 1.5 tt0 -86.81 118.38 26.17 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.265 -0.897 . . . . 0.91 109.439 179.903 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 332' ' ' ILE . . . . . 0.408 HD11 ' CD1' ' A' ' 338' ' ' PHE . 9.9 mt -103.46 110.6 30.39 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.527 0 O-C-N 121.286 -0.884 . . . . 1.09 109.673 179.988 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 333' ' ' ARG . . . . . 0.576 ' HG2' ' CE2' ' C' ' 327' ' ' TYR . 44.7 mtt180 -72.92 149.31 43.52 Favored 'General case' 0 C--N 1.303 -1.448 0 O-C-N 121.373 -0.83 . . . . 3.41 109.238 179.728 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 334' ' ' GLY . . . . . . . . . . . . . . . 85.65 129.65 2.29 Favored Glycine 0 N--CA 1.49 2.251 0 N-CA-C 109.619 -1.392 . . . . 0.4 109.619 -179.982 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 335' ' ' ARG . . . . . 0.434 ' O ' ' HB3' ' A' ' 338' ' ' PHE . 31.5 ttp180 -78.92 -44.52 22.45 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.361 -1.082 . . . . 3.55 109.758 -179.92 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 336' ' ' GLU . . . . . . . . . . . . . 1.3 tt0 -58.7 -57.34 13.45 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.231 -0.918 . . . . 2.29 109.717 -179.743 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 337' ' ' ARG . . . . . 0.455 ' NH1' ' CG ' ' A' ' 337' ' ' ARG . 0.0 OUTLIER -59.21 -31.3 68.91 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.278 -0.889 . . . . 3.64 109.523 -179.83 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 338' ' ' PHE . . . . . 0.434 ' HB3' ' O ' ' A' ' 335' ' ' ARG . 60.2 t80 -54.74 -55.86 25.42 Favored 'General case' 0 N--CA 1.489 1.48 0 O-C-N 121.114 -0.991 . . . . 0.41 109.442 179.993 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 339' ' ' GLU . . . . . . . . . . . . . 13.7 mt-10 -51.41 -35.31 38.58 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.196 -0.94 . . . . 1.97 109.903 -179.798 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 340' ' ' MET . . . . . . . . . . . . . 26.2 ttp -63.11 -50.04 72.06 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.222 -0.923 . . . . 1.14 110.068 -179.474 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 341' ' ' PHE . . . . . 0.456 ' CZ ' ' HA ' ' C' ' 345' ' ' ASN . 41.1 m-85 -61.21 -46.16 91.6 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.12 -0.988 . . . . 0.21 109.561 -179.806 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 342' ' ' ARG . . . . . 0.47 ' NH1' ' CG ' ' A' ' 342' ' ' ARG . 0.0 OUTLIER -51.03 -37.55 45.95 Favored 'General case' 0 C--N 1.301 -1.506 0 O-C-N 121.278 -0.889 . . . . 3.15 109.627 -179.933 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 343' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -59.49 -51.7 68.74 Favored 'General case' 0 N--CA 1.489 1.483 0 O-C-N 121.257 -0.902 . . . . 2.35 109.694 -179.488 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 344' ' ' LEU . . . . . 0.474 ' O ' HD21 ' A' ' 348' ' ' LEU . 53.6 mt -60.9 -33.78 73.65 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.308 -0.87 . . . . 1.06 109.375 179.984 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 345' ' ' ASN . . . . . . . . . . . . . 28.5 t-20 -57.95 -56.31 23.6 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.233 -0.917 . . . . 1.36 109.802 -179.984 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 346' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -61.39 -32.79 72.73 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.278 -0.889 . . . . 1.65 110.034 -179.56 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 347' ' ' ALA . . . . . . . . . . . . . . . -58.75 -55.1 39.41 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.061 -1.024 . . . . 1.03 109.948 -179.773 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 348' ' ' LEU . . . . . 0.497 ' N ' ' CD2' ' A' ' 348' ' ' LEU . 4.1 mm? -60.61 -46.45 90.21 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.125 -0.985 . . . . 1.04 109.594 -179.717 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 349' ' ' GLU . . . . . 0.502 ' HG2' ' NH1' ' C' ' 333' ' ' ARG . 1.7 mt-10 -58.11 -29.87 65.83 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.128 -0.982 . . . . 1.94 110.02 -179.648 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 350' ' ' LEU . . . . . 0.456 ' O ' HD22 ' A' ' 350' ' ' LEU . 6.4 tt -64.09 -48.98 74.06 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.028 -1.045 . . . . 1.17 109.173 179.774 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 351' ' ' LYS . . . . . . . . . . . . . 19.3 tttt -58.98 -41.79 88.45 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.421 -0.799 . . . . 1.97 109.447 179.833 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 352' ' ' ASP . . . . . . . . . . . . . 15.1 m-20 -56.7 -39.23 73.48 Favored 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.399 -0.813 . . . . 1.16 109.537 -179.947 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 353' ' ' ALA . . . . . . . . . . . . . . . -66.73 -32.63 74.05 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.294 -0.879 . . . . 1.22 109.611 -179.875 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 354' ' ' GLN . . . . . . . . . . . . . 7.2 tt0 . . . . . 0 C--N 1.303 -1.451 0 O-C-N 121.23 -0.919 . . . . 1.71 109.629 -179.989 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' B' B ' 326' ' ' GLU . . . . . . . . . . . . . 3.0 mm-40 . . . . . 0 N--CA 1.49 1.537 0 N-CA-C 109.372 -0.603 . . . . 2.13 109.372 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' B' B ' 327' ' ' TYR . . . . . 0.564 ' CE1' ' HG2' ' D' ' 333' ' ' ARG . 42.7 m-85 -149.1 111.57 4.73 Favored 'General case' 0 N--CA 1.488 1.458 0 O-C-N 121.254 -0.904 . . . . 0.99 109.62 -179.834 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 328' ' ' PHE . . . . . 0.542 ' CE2' ' HA ' ' D' ' 335' ' ' ARG . 95.3 m-85 -113.72 -167.65 1.23 Allowed 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.245 -0.909 . . . . 0.36 109.415 179.904 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 329' ' ' THR . . . . . . . . . . . . . 38.9 p -153.5 161.35 42.33 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.174 -0.954 . . . . 1.05 109.601 -179.642 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 330' ' ' LEU . . . . . . . . . . . . . 16.3 tp -150.41 131.46 14.36 Favored 'General case' 0 N--CA 1.488 1.432 0 O-C-N 121.235 -0.916 . . . . 1.07 109.249 179.932 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 331' ' ' GLN . . . . . . . . . . . . . 1.5 tt0 -87.25 118.58 26.77 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.368 -0.832 . . . . 0.91 109.495 -179.917 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 332' ' ' ILE . . . . . 0.403 HD11 ' CD1' ' B' ' 338' ' ' PHE . 10.8 mt -103.59 110.14 29.13 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.496 0 O-C-N 121.166 -0.959 . . . . 1.08 109.7 -179.798 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 333' ' ' ARG . . . . . 0.501 ' HG2' ' CE1' ' D' ' 327' ' ' TYR . 46.6 mtt180 -72.65 148.81 44.42 Favored 'General case' 0 N--CA 1.487 1.381 0 O-C-N 121.19 -0.944 . . . . 3.42 109.323 179.585 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 334' ' ' GLY . . . . . . . . . . . . . . . 86.17 129.4 2.43 Favored Glycine 0 N--CA 1.49 2.277 0 N-CA-C 109.553 -1.419 . . . . 0.4 109.553 179.848 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 335' ' ' ARG . . . . . 0.456 ' HA ' ' CE2' ' D' ' 328' ' ' PHE . 31.8 ttp180 -78.5 -45.11 22.78 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.242 -1.152 . . . . 3.55 110.016 -179.844 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 336' ' ' GLU . . . . . . . . . . . . . 1.3 tt0 -58.45 -56.86 16.66 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.153 -0.967 . . . . 2.28 109.651 -179.706 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 337' ' ' ARG . . . . . 0.433 ' NH1' ' CG ' ' B' ' 337' ' ' ARG . 0.0 OUTLIER -59.09 -31.4 68.87 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.294 -0.879 . . . . 3.64 109.544 -179.793 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' B' B ' 338' ' ' PHE . . . . . 0.455 ' HB3' ' O ' ' B' ' 335' ' ' ARG . 60.9 t80 -55.02 -55.82 26.62 Favored 'General case' 0 N--CA 1.488 1.441 0 O-C-N 121.33 -0.856 . . . . 0.39 109.417 179.971 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 339' ' ' GLU . . . . . . . . . . . . . 15.4 mt-10 -51.74 -34.96 41.53 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.333 -0.855 . . . . 1.98 109.789 -179.882 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 340' ' ' MET . . . . . . . . . . . . . 28.8 ttp -63.2 -50.57 69.78 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.105 -0.997 . . . . 1.14 109.909 -179.641 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 341' ' ' PHE . . . . . . . . . . . . . 42.7 m-85 -60.62 -46.32 90.72 Favored 'General case' 0 N--CA 1.494 1.725 0 O-C-N 121.079 -1.013 . . . . 0.22 109.842 -179.906 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 342' ' ' ARG . . . . . 0.465 ' NH1' ' CG ' ' B' ' 342' ' ' ARG . 0.0 OUTLIER -50.86 -38.07 47.13 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.219 -0.926 . . . . 3.15 109.651 -179.862 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' B' B ' 343' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -58.8 -51.83 68.32 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.239 -0.913 . . . . 2.35 109.76 -179.823 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 344' ' ' LEU . . . . . 0.48 ' O ' HD21 ' B' ' 348' ' ' LEU . 52.6 mt -61.39 -32.94 72.88 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.182 -0.949 . . . . 1.05 109.53 -179.839 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 345' ' ' ASN . . . . . . . . . . . . . 28.8 t-20 -58.48 -56.58 20.23 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.301 -0.874 . . . . 1.35 109.573 -179.996 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 346' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -61.31 -32.12 71.97 Favored 'General case' 0 C--N 1.301 -1.54 0 O-C-N 121.417 -0.802 . . . . 1.66 110.086 -179.52 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 347' ' ' ALA . . . . . . . . . . . . . . . -59.15 -55.18 38.32 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.246 -0.909 . . . . 1.02 109.914 -179.577 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 348' ' ' LEU . . . . . 0.488 ' CD2' ' N ' ' B' ' 348' ' ' LEU . 4.1 mm? -60.61 -45.71 93.0 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.252 -0.905 . . . . 1.05 109.856 -179.717 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 349' ' ' GLU . . . . . . . . . . . . . 1.8 mt-10 -58.74 -29.84 67.04 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.137 -0.977 . . . . 1.95 109.762 -179.482 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 350' ' ' LEU . . . . . 0.449 HD23 HD23 ' A' ' 350' ' ' LEU . 6.4 tt -64.11 -48.87 74.42 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.26 -0.9 . . . . 1.18 109.159 179.651 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 351' ' ' LYS . . . . . . . . . . . . . 19.4 tttt -59.54 -41.67 90.59 Favored 'General case' 0 C--N 1.302 -1.462 0 O-C-N 121.348 -0.845 . . . . 1.96 109.437 179.966 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 352' ' ' ASP . . . . . . . . . . . . . 16.7 m-20 -56.55 -39.13 72.91 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.217 -0.927 . . . . 1.16 109.515 179.8 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 353' ' ' ALA . . . . . . . . . . . . . . . -66.76 -33.31 75.35 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.253 -0.904 . . . . 1.21 109.759 -179.91 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 354' ' ' GLN . . . . . . . . . . . . . 7.4 tt0 . . . . . 0 N--CA 1.489 1.484 0 O-C-N 121.239 -0.913 . . . . 1.69 109.491 179.927 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' C' C ' 326' ' ' GLU . . . . . . . . . . . . . 16.1 mm-40 . . . . . 0 N--CA 1.488 1.458 0 CA-C-O 121.227 0.537 . . . . 2.17 109.56 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' C' C ' 327' ' ' TYR . . . . . 0.576 ' CE2' ' HG2' ' A' ' 333' ' ' ARG . 46.4 m-85 -148.89 111.85 4.87 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.269 -0.895 . . . . 1.03 109.799 -179.978 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' C' C ' 328' ' ' PHE . . . . . 0.426 ' O ' ' HG3' ' A' ' 331' ' ' GLN . 93.5 m-85 -111.12 -167.03 1.13 Allowed 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.236 -0.915 . . . . 0.37 109.538 -179.924 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' C' C ' 329' ' ' THR . . . . . 0.401 HG22 ' O ' ' C' ' 328' ' ' PHE . 10.8 p -154.11 167.53 29.53 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.283 -0.886 . . . . 1.04 109.705 -179.434 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' C' C ' 330' ' ' LEU . . . . . . . . . . . . . 20.2 tp -152.5 132.06 13.04 Favored 'General case' 0 N--CA 1.489 1.525 0 O-C-N 121.15 -0.969 . . . . 1.09 109.89 179.886 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 331' ' ' GLN . . . . . . . . . . . . . 1.2 tt0 -89.23 116.96 27.85 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.337 -0.852 . . . . 1.48 109.428 179.79 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 332' ' ' ILE . . . . . 0.491 HD12 ' CD2' ' C' ' 341' ' ' PHE . 59.9 mt -103.85 115.96 46.74 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.783 0 O-C-N 121.151 -0.968 . . . . 1.08 109.805 -179.892 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' C' C ' 333' ' ' ARG . . . . . 0.502 ' NH1' ' HG2' ' A' ' 349' ' ' GLU . 0.1 OUTLIER -75.06 144.87 42.77 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.258 -0.901 . . . . 3.36 109.727 179.684 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' C' C ' 334' ' ' GLY . . . . . . . . . . . . . . . 82.53 123.7 0.79 Allowed Glycine 0 N--CA 1.491 2.36 0 C-N-CA 120.005 -1.093 . . . . 0.35 110.472 179.307 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 335' ' ' ARG . . . . . 0.52 ' HG2' ' NH1' ' C' ' 335' ' ' ARG . 0.4 OUTLIER -73.4 -31.19 63.73 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.372 -1.075 . . . . 3.23 109.034 179.438 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' C' C ' 336' ' ' GLU . . . . . 0.463 ' OE1' ' HG3' ' C' ' 337' ' ' ARG . 14.1 tm-20 -59.29 -63.57 1.26 Allowed 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.277 -0.889 . . . . 2.62 109.052 179.747 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' C' C ' 337' ' ' ARG . . . . . 0.463 ' HG3' ' OE1' ' C' ' 336' ' ' GLU . 4.0 mtt180 -60.75 -26.21 67.05 Favored 'General case' 0 N--CA 1.487 1.422 0 O-C-N 121.308 -0.87 . . . . 3.61 109.358 179.65 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' C' C ' 338' ' ' PHE . . . . . 0.451 ' HB3' ' O ' ' C' ' 335' ' ' ARG . 86.4 t80 -54.86 -62.2 1.81 Allowed 'General case' 0 C--N 1.305 -1.344 0 O-C-N 121.279 -0.888 . . . . 0.43 109.379 -179.97 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' C' C ' 339' ' ' GLU . . . . . . . . . . . . . 34.2 mt-10 -51.1 -31.58 19.71 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.227 -0.921 . . . . 2.05 110.032 -179.587 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 340' ' ' MET . . . . . 0.426 ' HB3' ' O ' ' C' ' 337' ' ' ARG . 7.1 ttp -63.93 -53.54 48.77 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.213 -0.929 . . . . 1.1 109.841 -179.756 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' C' C ' 341' ' ' PHE . . . . . 0.491 ' CD2' HD12 ' C' ' 332' ' ' ILE . 33.5 m-85 -61.19 -42.53 98.75 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.194 -0.941 . . . . 0.21 109.815 -179.661 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' C' C ' 342' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -46.6 -43.57 17.45 Favored 'General case' 0 C--N 1.301 -1.519 0 O-C-N 121.187 -0.946 . . . . 3.42 109.496 -179.823 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' C' C ' 343' ' ' GLU . . . . . . . . . . . . . 15.8 tp10 -61.45 -40.28 93.9 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 120.988 -1.07 . . . . 2.14 109.635 179.884 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 344' ' ' LEU . . . . . 0.478 HD23 HD23 ' D' ' 344' ' ' LEU . 43.6 mt -63.31 -52.93 59.89 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.156 -0.965 . . . . 1.09 109.77 -179.756 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' C' C ' 345' ' ' ASN . . . . . 0.456 ' HA ' ' CZ ' ' A' ' 341' ' ' PHE . 38.2 t30 -53.86 -44.91 70.76 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.277 -0.889 . . . . 1.38 109.656 -179.759 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' C' C ' 346' ' ' GLU . . . . . . . . . . . . . 3.2 tp10 -62.17 -37.58 85.81 Favored 'General case' 0 N--CA 1.488 1.435 0 O-C-N 121.209 -0.932 . . . . 2.21 109.823 -179.93 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 347' ' ' ALA . . . . . . . . . . . . . . . -59.35 -47.59 84.86 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.184 -0.948 . . . . 1.03 109.516 -179.662 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 348' ' ' LEU . . . . . 0.475 HD21 ' O ' ' C' ' 344' ' ' LEU . 3.9 mm? -63.66 -42.72 98.05 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.258 -0.901 . . . . 1.06 109.706 179.933 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' C' C ' 349' ' ' GLU . . . . . 0.404 ' OE1' ' CZ ' ' A' ' 333' ' ' ARG . 5.4 mm-40 -57.54 -39.14 75.95 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.046 -1.034 . . . . 2.19 109.341 179.996 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' C' C ' 350' ' ' LEU . . . . . 0.54 HD23 ' CD2' ' D' ' 350' ' ' LEU . 6.4 tt -61.31 -43.71 98.42 Favored 'General case' 0 N--CA 1.488 1.458 0 O-C-N 121.539 -0.726 . . . . 1.2 109.323 -179.992 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' C' C ' 351' ' ' LYS . . . . . . . . . . . . . 8.9 tttp -60.96 -41.91 97.25 Favored 'General case' 0 C--N 1.304 -1.395 0 O-C-N 121.116 -0.99 . . . . 1.92 109.085 179.867 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 352' ' ' ASP . . . . . . . . . . . . . 77.2 m-20 -52.76 -58.15 7.81 Favored 'General case' 0 N--CA 1.488 1.449 0 O-C-N 121.382 -0.824 . . . . 1.19 109.239 179.898 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 353' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 1.478 0 O-C-N 121.276 -0.89 . . . . 1.15 109.457 -179.956 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' D' D ' 326' ' ' GLU . . . . . . . . . . . . . 3.3 mm-40 . . . . . 0 N--CA 1.49 1.561 0 N-CA-C 109.348 -0.612 . . . . 2.13 109.348 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' D' D ' 327' ' ' TYR . . . . . 0.501 ' CE1' ' HG2' ' B' ' 333' ' ' ARG . 43.3 m-85 -149.75 111.37 4.51 Favored 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.012 -1.055 . . . . 1.0 109.436 179.959 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' D' D ' 328' ' ' PHE . . . . . 0.456 ' CE2' ' HA ' ' B' ' 335' ' ' ARG . 97.1 m-85 -113.4 -167.67 1.23 Allowed 'General case' 0 N--CA 1.488 1.472 0 O-C-N 121.375 -0.828 . . . . 0.34 109.184 -179.791 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' D' D ' 329' ' ' THR . . . . . . . . . . . . . 37.9 p -153.55 161.68 41.98 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.209 -0.932 . . . . 1.05 109.464 -179.957 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' D' D ' 330' ' ' LEU . . . . . . . . . . . . . 17.7 tp -150.48 130.89 13.78 Favored 'General case' 0 N--CA 1.488 1.474 0 O-C-N 121.464 -0.773 . . . . 1.07 109.473 -179.9 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' D' D ' 331' ' ' GLN . . . . . 0.44 ' HG3' ' O ' ' B' ' 328' ' ' PHE . 1.6 tt0 -86.69 119.87 27.38 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.017 -1.052 . . . . 0.93 109.325 179.835 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' D' D ' 332' ' ' ILE . . . . . 0.405 HD11 ' CD1' ' D' ' 338' ' ' PHE . 12.4 mt -104.4 109.58 27.86 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.564 0 O-C-N 121.094 -1.004 . . . . 1.07 109.636 -179.894 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' D' D ' 333' ' ' ARG . . . . . 0.564 ' HG2' ' CE1' ' B' ' 327' ' ' TYR . 46.1 mtt180 -72.28 149.97 44.01 Favored 'General case' 0 C--N 1.302 -1.465 0 O-C-N 121.106 -0.996 . . . . 3.42 109.209 179.827 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' D' D ' 334' ' ' GLY . . . . . . . . . . . . . . . 85.53 129.63 2.25 Favored Glycine 0 N--CA 1.493 2.486 0 N-CA-C 109.645 -1.382 . . . . 0.41 109.645 -179.911 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' D' D ' 335' ' ' ARG . . . . . 0.542 ' HA ' ' CE2' ' B' ' 328' ' ' PHE . 32.2 ttp180 -78.82 -45.96 19.75 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.007 -1.29 . . . . 3.58 109.647 179.898 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' D' D ' 336' ' ' GLU . . . . . . . . . . . . . 1.3 tt0 -57.65 -56.63 19.48 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.101 -0.999 . . . . 2.26 109.665 -179.821 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' D' D ' 337' ' ' ARG . . . . . 0.422 ' NH1' ' CG ' ' D' ' 337' ' ' ARG . 0.0 OUTLIER -59.32 -31.2 68.94 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.159 -0.963 . . . . 3.64 109.669 -179.769 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' D' D ' 338' ' ' PHE . . . . . 0.471 ' HB3' ' O ' ' D' ' 335' ' ' ARG . 61.2 t80 -55.26 -54.98 36.69 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.292 -0.88 . . . . 0.4 109.532 179.923 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' D' D ' 339' ' ' GLU . . . . . . . . . . . . . 17.1 mt-10 -52.36 -34.62 48.47 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.197 -0.94 . . . . 1.99 109.756 -179.687 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' D' D ' 340' ' ' MET . . . . . . . . . . . . . 31.1 ttp -63.52 -49.92 71.61 Favored 'General case' 0 N--CA 1.488 1.466 0 O-C-N 121.23 -0.919 . . . . 1.13 109.966 -179.616 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' D' D ' 341' ' ' PHE . . . . . . . . . . . . . 42.1 m-85 -61.37 -47.05 87.63 Favored 'General case' 0 N--CA 1.488 1.467 0 O-C-N 121.108 -0.995 . . . . 0.21 109.551 -179.687 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' D' D ' 342' ' ' ARG . . . . . 0.459 ' NH1' ' CG ' ' D' ' 342' ' ' ARG . 0.0 OUTLIER -50.24 -37.87 37.78 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.175 -0.953 . . . . 3.15 109.86 -179.876 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' D' D ' 343' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -59.07 -51.58 69.42 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.303 -0.873 . . . . 2.35 109.673 -179.701 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' D' D ' 344' ' ' LEU . . . . . 0.478 HD23 HD23 ' C' ' 344' ' ' LEU . 56.1 mt -61.52 -33.03 73.12 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.191 -0.943 . . . . 1.06 109.455 179.959 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' D' D ' 345' ' ' ASN . . . . . 0.42 ' ND2' ' OE2' ' D' ' 349' ' ' GLU . 29.3 t-20 -58.38 -56.29 24.01 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.258 -0.901 . . . . 1.35 109.718 179.932 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' D' D ' 346' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -61.63 -32.61 72.76 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.421 -0.8 . . . . 1.69 109.92 -179.634 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' D' D ' 347' ' ' ALA . . . . . . . . . . . . . . . -58.4 -55.22 37.86 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.053 -1.029 . . . . 1.03 109.827 -179.701 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' D' D ' 348' ' ' LEU . . . . . 0.492 ' CD2' ' N ' ' D' ' 348' ' ' LEU . 4.2 mm? -61.02 -46.47 90.62 Favored 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.17 -0.956 . . . . 1.04 109.844 -179.46 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' D' D ' 349' ' ' GLU . . . . . 0.42 ' OE2' ' ND2' ' D' ' 345' ' ' ASN . 1.8 mt-10 -57.85 -29.89 65.36 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.184 -0.947 . . . . 1.95 109.736 -179.582 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' D' D ' 350' ' ' LEU . . . . . 0.54 ' CD2' HD23 ' C' ' 350' ' ' LEU . 6.3 tt -63.88 -49.37 72.97 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.099 -1.001 . . . . 1.16 109.292 179.853 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' D' D ' 351' ' ' LYS . . . . . . . . . . . . . 19.8 tttt -59.19 -42.14 90.15 Favored 'General case' 0 C--N 1.303 -1.449 0 O-C-N 121.47 -0.769 . . . . 1.97 109.403 179.78 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' D' D ' 352' ' ' ASP . . . . . . . . . . . . . 17.8 m-20 -56.1 -38.85 71.3 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.396 -0.815 . . . . 1.17 109.562 179.601 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' D' D ' 353' ' ' ALA . . . . . . . . . . . . . . . -67.19 -33.49 75.5 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.116 -0.99 . . . . 1.21 109.608 -179.909 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' D' D ' 354' ' ' GLN . . . . . . . . . . . . . 7.6 tt0 . . . . . 0 N--CA 1.488 1.475 0 O-C-N 121.131 -0.98 . . . . 1.68 109.497 -179.934 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 326' ' ' GLU . . . . . . . . . . . . . 3.0 mt-10 . . . . . 0 N--CA 1.488 1.454 0 N-CA-C 109.07 -0.715 . . . . 2.13 109.07 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 327' ' ' TYR . . . . . . . . . . . . . 47.3 m-85 -148.83 111.4 4.75 Favored 'General case' 0 N--CA 1.489 1.476 0 O-C-N 121.256 -0.902 . . . . 1.0 109.527 -179.835 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 328' ' ' PHE . . . . . 0.409 ' CE2' ' HA ' ' C' ' 335' ' ' ARG . 86.4 m-85 -113.87 -168.47 1.35 Allowed 'General case' 0 N--CA 1.488 1.451 0 O-C-N 121.347 -0.845 . . . . 0.34 109.532 -179.808 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 329' ' ' THR . . . . . 0.451 ' HA ' ' O ' ' C' ' 330' ' ' LEU . 24.4 p -153.56 165.21 36.61 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.346 -0.846 . . . . 1.05 109.078 179.94 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 330' ' ' LEU . . . . . 0.448 ' O ' ' HA ' ' C' ' 329' ' ' THR . 14.7 tp -151.47 131.33 13.29 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.045 -1.034 . . . . 1.07 109.877 -179.803 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 331' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -87.55 120.77 29.19 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.279 -0.888 . . . . 0.91 109.165 179.615 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 332' ' ' ILE . . . . . . . . . . . . . 59.6 mt -103.56 111.1 32.0 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.548 0 O-C-N 121.235 -0.916 . . . . 1.09 109.664 -179.794 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 333' ' ' ARG . . . . . 0.443 ' NH1' ' CG ' ' A' ' 333' ' ' ARG . 0.0 OUTLIER -72.59 139.56 47.51 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.403 -0.811 . . . . 3.41 109.35 179.83 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 334' ' ' GLY . . . . . . . . . . . . . . . 85.76 136.6 4.09 Favored Glycine 0 N--CA 1.49 2.251 0 N-CA-C 109.697 -1.361 . . . . 0.4 109.697 179.878 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 335' ' ' ARG . . . . . 0.487 ' NH1' ' HG3' ' A' ' 335' ' ' ARG . 0.3 OUTLIER -80.11 -36.17 35.74 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.405 -1.056 . . . . 3.55 109.582 -179.921 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 336' ' ' GLU . . . . . . . . . . . . . 52.2 tt0 -58.58 -57.24 13.84 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.238 -0.914 . . . . 2.29 110.052 -179.634 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 337' ' ' ARG . . . . . 0.548 ' HG3' ' NH1' ' A' ' 337' ' ' ARG . 0.6 OUTLIER -60.0 -30.36 69.09 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.117 -0.989 . . . . 3.64 109.815 -179.625 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 338' ' ' PHE . . . . . . . . . . . . . 88.8 t80 -54.34 -62.99 1.29 Allowed 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.214 -0.929 . . . . 0.41 109.756 -179.73 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 339' ' ' GLU . . . . . . . . . . . . . 80.9 mt-10 -51.88 -31.46 28.22 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.211 -0.93 . . . . 1.97 110.205 -179.667 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 340' ' ' MET . . . . . . . . . . . . . 28.0 ttp -63.8 -53.62 47.94 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.134 -0.979 . . . . 1.14 110.121 -179.432 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 341' ' ' PHE . . . . . . . . . . . . . 39.2 m-85 -62.25 -48.59 79.26 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.171 -0.955 . . . . 0.21 110.023 -179.533 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 342' ' ' ARG . . . . . . . . . . . . . 70.3 ttt180 -48.85 -38.38 22.17 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.161 -0.962 . . . . 3.15 109.858 -179.71 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 343' ' ' GLU . . . . . . . . . . . . . 42.5 tt0 -59.42 -49.45 77.77 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.157 -0.964 . . . . 2.35 109.896 -179.705 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 344' ' ' LEU . . . . . 0.448 ' O ' HD21 ' A' ' 348' ' ' LEU . 42.2 mt -61.32 -37.96 85.14 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.092 -1.005 . . . . 1.06 109.714 -179.597 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 345' ' ' ASN . . . . . 0.437 ' HA ' ' CZ ' ' C' ' 341' ' ' PHE . 60.6 t-20 -57.01 -50.37 72.94 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.165 -0.959 . . . . 1.36 109.675 -179.936 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 346' ' ' GLU . . . . . . . . . . . . . 2.7 tt0 -60.71 -34.44 74.38 Favored 'General case' 0 N--CA 1.489 1.49 0 O-C-N 121.263 -0.898 . . . . 1.65 109.894 -179.755 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 347' ' ' ALA . . . . . . . . . . . . . . . -60.84 -51.65 68.42 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.128 -0.982 . . . . 1.03 110.047 -179.771 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 348' ' ' LEU . . . . . 0.478 ' N ' HD23 ' A' ' 348' ' ' LEU . 3.9 mm? -61.41 -44.84 96.44 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.165 -0.96 . . . . 1.04 110.003 -179.508 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 349' ' ' GLU . . . . . . . . . . . . . 39.3 mt-10 -58.02 -40.58 81.17 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.27 -0.894 . . . . 1.94 110.337 -179.281 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 350' ' ' LEU . . . . . 0.515 HD23 HD23 ' B' ' 350' ' ' LEU . 8.5 tt -63.59 -48.37 77.67 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.16 -0.963 . . . . 1.17 109.977 -179.317 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 351' ' ' LYS . . . . . . . . . . . . . 25.3 tttt -55.43 -41.84 73.35 Favored 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.259 -0.901 . . . . 1.97 109.329 -179.548 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 352' ' ' ASP . . . . . . . . . . . . . 23.0 m-20 -59.36 -48.32 82.07 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.38 -0.825 . . . . 1.16 109.778 179.902 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 353' ' ' ALA . . . . . . . . . . . . . . . -67.49 -9.5 42.82 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.29 -0.881 . . . . 1.22 110.177 -179.419 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 354' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.49 1.56 0 O-C-N 121.051 -1.03 . . . . 1.71 109.628 -179.945 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 326' ' ' GLU . . . . . . . . . . . . . 2.9 mt-10 . . . . . 0 N--CA 1.488 1.465 0 N-CA-C 109.093 -0.706 . . . . 2.13 109.093 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' B' B ' 327' ' ' TYR . . . . . . . . . . . . . 47.0 m-85 -148.85 111.41 4.75 Favored 'General case' 0 N--CA 1.488 1.44 0 O-C-N 121.203 -0.935 . . . . 0.99 109.531 -179.858 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 328' ' ' PHE . . . . . 0.41 ' CE2' ' HA ' ' D' ' 335' ' ' ARG . 86.3 m-85 -114.01 -168.58 1.37 Allowed 'General case' 0 N--CA 1.489 1.48 0 O-C-N 121.336 -0.852 . . . . 0.36 109.53 -179.845 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 329' ' ' THR . . . . . 0.407 ' HA ' ' O ' ' D' ' 330' ' ' LEU . 23.9 p -153.48 165.23 36.51 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.32 -0.862 . . . . 1.05 109.146 179.989 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 330' ' ' LEU . . . . . 0.419 ' O ' ' HA ' ' D' ' 329' ' ' THR . 14.8 tp -151.49 131.26 13.2 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.093 -1.004 . . . . 1.07 109.927 -179.739 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 331' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -87.48 120.65 28.99 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.225 -0.922 . . . . 0.91 109.166 179.63 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 332' ' ' ILE . . . . . . . . . . . . . 59.7 mt -103.52 111.1 31.96 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.526 0 O-C-N 121.15 -0.969 . . . . 1.08 109.722 -179.804 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 333' ' ' ARG . . . . . 0.448 ' CG ' ' NH1' ' B' ' 333' ' ' ARG . 0.0 OUTLIER -72.53 139.56 47.64 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.254 -0.903 . . . . 3.42 109.411 179.852 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' B' B ' 334' ' ' GLY . . . . . . . . . . . . . . . 85.87 136.37 4.08 Favored Glycine 0 N--CA 1.49 2.295 0 N-CA-C 109.655 -1.378 . . . . 0.4 109.655 179.861 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 335' ' ' ARG . . . . . 0.495 ' NH1' ' HG3' ' B' ' 335' ' ' ARG . 0.3 OUTLIER -80.03 -36.15 36.2 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.253 -1.145 . . . . 3.55 109.579 -179.975 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' B' B ' 336' ' ' GLU . . . . . . . . . . . . . 52.5 tt0 -58.56 -57.21 13.97 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.309 -0.87 . . . . 2.28 110.05 -179.719 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 337' ' ' ARG . . . . . 0.531 ' NH1' ' HG3' ' B' ' 337' ' ' ARG . 0.6 OUTLIER -60.04 -30.37 69.14 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.11 -0.994 . . . . 3.64 109.826 -179.548 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' B' B ' 338' ' ' PHE . . . . . . . . . . . . . 88.9 t80 -54.4 -62.86 1.38 Allowed 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.222 -0.924 . . . . 0.39 109.833 -179.751 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 339' ' ' GLU . . . . . . . . . . . . . 81.6 mt-10 -51.97 -31.38 28.92 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.235 -0.916 . . . . 1.98 110.178 -179.666 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 340' ' ' MET . . . . . . . . . . . . . 28.3 ttp -63.73 -53.73 46.56 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.091 -1.005 . . . . 1.14 110.139 -179.491 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 341' ' ' PHE . . . . . . . . . . . . . 39.3 m-85 -62.19 -48.66 79.05 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.167 -0.958 . . . . 0.22 109.978 -179.48 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 342' ' ' ARG . . . . . . . . . . . . . 70.4 ttt180 -48.72 -38.28 21.1 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.2 -0.937 . . . . 3.15 109.964 -179.734 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 343' ' ' GLU . . . . . . . . . . . . . 43.0 tt0 -59.63 -49.3 78.3 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.194 -0.941 . . . . 2.35 109.967 -179.713 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 344' ' ' LEU . . . . . 0.448 ' O ' HD21 ' B' ' 348' ' ' LEU . 42.6 mt -61.31 -38.03 85.36 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.205 -0.934 . . . . 1.05 109.747 -179.717 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 345' ' ' ASN . . . . . 0.414 ' HA ' ' CZ ' ' D' ' 341' ' ' PHE . 60.6 t-20 -57.07 -50.15 73.65 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.245 -0.909 . . . . 1.35 109.621 -179.879 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 346' ' ' GLU . . . . . . . . . . . . . 2.7 tt0 -60.87 -34.41 74.58 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.224 -0.922 . . . . 1.66 109.826 -179.709 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 347' ' ' ALA . . . . . . . . . . . . . . . -60.9 -51.56 68.77 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.153 -0.967 . . . . 1.02 110.087 -179.693 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 348' ' ' LEU . . . . . 0.482 ' N ' HD23 ' B' ' 348' ' ' LEU . 3.9 mm? -61.41 -44.94 96.27 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.211 -0.931 . . . . 1.05 110.049 -179.561 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 349' ' ' GLU . . . . . . . . . . . . . 39.5 mt-10 -58.08 -40.28 80.69 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.224 -0.922 . . . . 1.95 110.378 -179.343 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 350' ' ' LEU . . . . . 0.515 HD23 HD23 ' A' ' 350' ' ' LEU . 8.5 tt -63.79 -48.21 77.81 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.256 -0.902 . . . . 1.18 110.067 -179.411 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 351' ' ' LYS . . . . . . . . . . . . . 25.8 tttt -55.61 -41.83 74.02 Favored 'General case' 0 N--CA 1.488 1.441 0 O-C-N 121.198 -0.939 . . . . 1.96 109.27 -179.513 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 352' ' ' ASP . . . . . 0.504 ' OD2' ' NH2' ' D' ' 337' ' ' ARG . 23.3 m-20 -59.27 -48.43 81.66 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.282 -0.886 . . . . 1.16 109.828 179.797 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 353' ' ' ALA . . . . . . . . . . . . . . . -67.46 -9.7 44.46 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.241 -0.912 . . . . 1.21 110.116 -179.469 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 354' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.489 1.524 0 O-C-N 121.046 -1.034 . . . . 1.69 109.536 -179.824 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 326' ' ' GLU . . . . . 0.434 ' OE1' ' HB2' ' A' ' 335' ' ' ARG . 1.3 mp0 . . . . . 0 N--CA 1.489 1.501 0 CA-C-O 121.294 0.569 . . . . 2.17 109.48 . . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 327' ' ' TYR . . . . . . . . . . . . . 51.6 m-85 -149.66 115.03 5.5 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.33 -0.856 . . . . 1.03 109.394 -179.916 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 328' ' ' PHE . . . . . 0.464 ' O ' HG21 ' C' ' 329' ' ' THR . 84.4 m-85 -113.36 -169.77 1.56 Allowed 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.319 -0.863 . . . . 0.37 109.562 -179.934 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' C' C ' 329' ' ' THR . . . . . 0.464 HG21 ' O ' ' C' ' 328' ' ' PHE . 16.3 p -153.54 162.48 41.22 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.265 -0.897 . . . . 1.04 109.463 -179.873 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' C' C ' 330' ' ' LEU . . . . . 0.451 ' O ' ' HA ' ' A' ' 329' ' ' THR . 14.3 tp -150.26 129.78 13.04 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.206 -0.934 . . . . 1.09 109.782 -179.725 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' C' C ' 331' ' ' GLN . . . . . . . . . . . . . 4.1 tt0 -89.22 119.4 29.68 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.263 -0.898 . . . . 1.48 109.387 179.568 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 332' ' ' ILE . . . . . 0.472 HG23 ' HA ' ' C' ' 338' ' ' PHE . 21.5 mt -103.67 115.58 45.88 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.576 0 O-C-N 121.101 -1.0 . . . . 1.08 109.654 179.811 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' C' C ' 333' ' ' ARG . . . . . 0.552 ' CZ ' ' HB2' ' C' ' 333' ' ' ARG . 5.6 mtm-85 -73.45 151.58 41.05 Favored 'General case' 0 N--CA 1.489 1.493 0 O-C-N 121.348 -0.845 . . . . 3.36 109.375 179.788 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' C' C ' 334' ' ' GLY . . . . . . . . . . . . . . . 71.83 129.99 0.1 OUTLIER Glycine 0 N--CA 1.491 2.305 0 N-CA-C 109.737 -1.345 . . . . 0.35 109.737 179.798 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 335' ' ' ARG . . . . . 0.454 ' NH1' ' CG ' ' C' ' 335' ' ' ARG . 0.2 OUTLIER -73.98 -31.26 62.9 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.273 -1.133 . . . . 3.23 109.358 179.847 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' C' C ' 336' ' ' GLU . . . . . . . . . . . . . 1.7 mp0 -59.22 -57.85 11.21 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.293 -0.88 . . . . 2.62 110.216 -179.768 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 337' ' ' ARG . . . . . 0.537 ' HG2' ' NH1' ' C' ' 337' ' ' ARG . 0.0 OUTLIER -59.03 -32.97 70.21 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.241 -0.912 . . . . 3.61 109.735 -179.471 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' C' C ' 338' ' ' PHE . . . . . 0.472 ' HA ' HG23 ' C' ' 332' ' ' ILE . 80.8 t80 -54.05 -49.53 68.77 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.224 -0.923 . . . . 0.43 109.576 -179.884 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' C' C ' 339' ' ' GLU . . . . . . . . . . . . . 14.5 mt-10 -54.99 -36.67 65.64 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.07 -1.019 . . . . 2.05 110.307 -179.849 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 340' ' ' MET . . . . . . . . . . . . . 19.0 ttp -64.6 -57.7 8.38 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.131 -0.981 . . . . 1.1 110.861 -178.984 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 341' ' ' PHE . . . . . 0.437 ' CZ ' ' HA ' ' A' ' 345' ' ' ASN . 59.1 m-85 -59.74 -51.44 69.75 Favored 'General case' 0 N--CA 1.493 1.713 0 O-C-N 121.091 -1.005 . . . . 0.21 110.246 -178.956 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' C' C ' 342' ' ' ARG . . . . . 0.443 HH11 ' CG ' ' C' ' 342' ' ' ARG . 0.2 OUTLIER -47.21 -45.85 23.58 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.25 -0.906 . . . . 3.42 110.217 -179.374 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' C' C ' 343' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -58.84 -43.19 90.66 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.213 -0.929 . . . . 2.14 109.968 -179.496 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' C' C ' 344' ' ' LEU . . . . . 0.468 ' O ' HD21 ' C' ' 348' ' ' LEU . 25.6 mt -62.28 -40.66 96.97 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.093 -1.004 . . . . 1.09 109.823 -179.583 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' C' C ' 345' ' ' ASN . . . . . . . . . . . . . 51.2 t-20 -55.26 -51.79 65.51 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.238 -0.914 . . . . 1.38 109.98 -179.596 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 346' ' ' GLU . . . . . . . . . . . . . 63.1 tt0 -60.14 -31.68 70.31 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.108 -0.995 . . . . 2.21 109.742 -179.602 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 347' ' ' ALA . . . . . . . . . . . . . . . -62.7 -48.05 80.95 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.112 -0.993 . . . . 1.03 109.879 -179.998 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 348' ' ' LEU . . . . . 0.482 HD23 ' N ' ' C' ' 348' ' ' LEU . 4.3 mm? -62.16 -53.84 49.64 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.209 -0.932 . . . . 1.06 110.108 -179.637 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' C' C ' 349' ' ' GLU . . . . . . . . . . . . . 6.6 mm-40 -57.65 -34.06 68.96 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.256 -0.902 . . . . 2.19 110.231 -179.097 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 350' ' ' LEU . . . . . 0.522 HD21 ' N ' ' C' ' 351' ' ' LYS . 4.2 tt -63.49 -44.04 95.51 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.099 -1.001 . . . . 1.2 109.282 -179.817 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' C' C ' 351' ' ' LYS . . . . . 0.522 ' N ' HD21 ' C' ' 350' ' ' LEU . 41.6 tttp -59.9 -34.43 73.18 Favored 'General case' 0 N--CA 1.488 1.454 0 O-C-N 121.342 -0.849 . . . . 1.92 109.445 -179.923 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' C' C ' 352' ' ' ASP . . . . . . . . . . . . . 3.2 m-20 -56.52 -45.49 81.09 Favored 'General case' 0 N--CA 1.489 1.499 0 O-C-N 121.241 -0.912 . . . . 1.19 109.663 179.978 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 353' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 1.588 0 O-C-N 121.184 -0.947 . . . . 1.15 109.333 -179.971 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' D' D ' 326' ' ' GLU . . . . . . . . . . . . . 3.0 mt-10 . . . . . 0 N--CA 1.488 1.441 0 N-CA-C 109.07 -0.715 . . . . 2.13 109.07 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' D' D ' 327' ' ' TYR . . . . . . . . . . . . . 47.1 m-85 -148.79 111.53 4.8 Favored 'General case' 0 C--N 1.303 -1.427 0 O-C-N 121.173 -0.954 . . . . 1.0 109.469 -179.818 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' D' D ' 328' ' ' PHE . . . . . 0.411 ' CE2' ' HA ' ' B' ' 335' ' ' ARG . 86.2 m-85 -114.08 -168.64 1.38 Allowed 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.292 -0.88 . . . . 0.34 109.561 -179.842 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' D' D ' 329' ' ' THR . . . . . 0.419 ' HA ' ' O ' ' B' ' 330' ' ' LEU . 23.8 p -153.46 165.07 36.98 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.294 -0.879 . . . . 1.05 109.174 179.931 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' D' D ' 330' ' ' LEU . . . . . 0.407 ' O ' ' HA ' ' B' ' 329' ' ' THR . 14.9 tp -151.43 131.23 13.23 Favored 'General case' 0 N--CA 1.489 1.476 0 O-C-N 121.134 -0.978 . . . . 1.07 109.869 -179.768 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' D' D ' 331' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -87.39 120.75 29.0 Favored 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.341 -0.849 . . . . 0.93 109.234 179.54 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' D' D ' 332' ' ' ILE . . . . . . . . . . . . . 59.5 mt -103.46 111.26 32.51 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.574 0 O-C-N 121.149 -0.97 . . . . 1.07 109.656 -179.778 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' D' D ' 333' ' ' ARG . . . . . 0.433 ' NH1' ' CG ' ' D' ' 333' ' ' ARG . 0.0 OUTLIER -72.77 139.67 47.24 Favored 'General case' 0 N--CA 1.489 1.49 0 O-C-N 121.334 -0.854 . . . . 3.42 109.454 179.778 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' D' D ' 334' ' ' GLY . . . . . . . . . . . . . . . 85.76 136.62 4.1 Favored Glycine 0 N--CA 1.49 2.283 0 N-CA-C 109.658 -1.377 . . . . 0.41 109.658 179.925 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' D' D ' 335' ' ' ARG . . . . . 0.494 ' NH1' ' HG3' ' D' ' 335' ' ' ARG . 0.3 OUTLIER -80.13 -36.08 35.8 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.31 -1.112 . . . . 3.58 109.623 -179.951 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' D' D ' 336' ' ' GLU . . . . . . . . . . . . . 53.1 tt0 -58.72 -57.14 14.32 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.223 -0.923 . . . . 2.26 110.057 -179.666 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' D' D ' 337' ' ' ARG . . . . . 0.539 ' NH1' ' HG3' ' D' ' 337' ' ' ARG . 0.6 OUTLIER -60.07 -30.27 69.11 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.188 -0.945 . . . . 3.64 109.862 -179.608 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' D' D ' 338' ' ' PHE . . . . . . . . . . . . . 88.7 t80 -54.43 -62.89 1.36 Allowed 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.209 -0.932 . . . . 0.4 109.769 -179.756 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' D' D ' 339' ' ' GLU . . . . . . . . . . . . . 81.7 mt-10 -51.99 -31.32 28.93 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.279 -0.888 . . . . 1.99 110.155 -179.632 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' D' D ' 340' ' ' MET . . . . . . . . . . . . . 28.2 ttp -63.9 -53.6 47.95 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.101 -0.999 . . . . 1.13 110.098 -179.426 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' D' D ' 341' ' ' PHE . . . . . 0.414 ' CZ ' ' HA ' ' B' ' 345' ' ' ASN . 39.8 m-85 -62.17 -48.83 78.3 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.183 -0.948 . . . . 0.21 109.977 -179.532 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' D' D ' 342' ' ' ARG . . . . . . . . . . . . . 70.6 ttt180 -48.6 -38.47 20.87 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.185 -0.947 . . . . 3.15 109.827 -179.73 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' D' D ' 343' ' ' GLU . . . . . . . . . . . . . 43.7 tt0 -59.51 -49.29 78.37 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.218 -0.926 . . . . 2.35 109.927 -179.609 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' D' D ' 344' ' ' LEU . . . . . 0.447 ' O ' HD21 ' D' ' 348' ' ' LEU . 43.1 mt -61.26 -38.08 85.46 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.256 -0.902 . . . . 1.06 109.738 -179.659 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' D' D ' 345' ' ' ASN . . . . . . . . . . . . . 60.6 t-20 -57.09 -50.35 73.06 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.178 -0.951 . . . . 1.35 109.61 -179.787 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' D' D ' 346' ' ' GLU . . . . . . . . . . . . . 2.6 tt0 -60.56 -34.52 74.28 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.295 -0.878 . . . . 1.69 109.892 -179.774 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' D' D ' 347' ' ' ALA . . . . . . . . . . . . . . . -60.85 -51.48 69.12 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.243 -0.911 . . . . 1.03 110.07 -179.645 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' D' D ' 348' ' ' LEU . . . . . 0.487 ' N ' HD23 ' D' ' 348' ' ' LEU . 3.9 mm? -61.48 -45.05 95.88 Favored 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.158 -0.964 . . . . 1.04 109.948 -179.446 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' D' D ' 349' ' ' GLU . . . . . . . . . . . . . 39.2 mt-10 -57.91 -40.34 80.12 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.275 -0.891 . . . . 1.95 110.351 -179.327 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' D' D ' 350' ' ' LEU . . . . . 0.463 HD21 HD23 ' C' ' 350' ' ' LEU . 8.6 tt -63.73 -48.11 78.35 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.087 -1.008 . . . . 1.16 110.144 -179.369 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' D' D ' 351' ' ' LYS . . . . . . . . . . . . . 25.8 tttt -55.73 -41.8 74.41 Favored 'General case' 0 N--CA 1.488 1.451 0 O-C-N 121.244 -0.91 . . . . 1.97 109.291 -179.665 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' D' D ' 352' ' ' ASP . . . . . 0.433 ' OD2' ' NH2' ' B' ' 337' ' ' ARG . 23.5 m-20 -59.36 -48.35 81.96 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.294 -0.879 . . . . 1.17 109.806 179.802 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' D' D ' 353' ' ' ALA . . . . . . . . . . . . . . . -67.57 -9.56 43.85 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.22 -0.925 . . . . 1.21 110.101 -179.43 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' D' D ' 354' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.49 1.566 0 O-C-N 121.063 -1.023 . . . . 1.68 109.532 -179.807 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 326' ' ' GLU . . . . . . . . . . . . . 4.0 mm-40 . . . . . 0 N--CA 1.489 1.518 0 N-CA-C 109.378 -0.601 . . . . 2.13 109.378 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 327' ' ' TYR . . . . . 0.521 ' CE2' ' HG2' ' C' ' 333' ' ' ARG . 40.9 m-85 -148.35 111.05 4.76 Favored 'General case' 0 C--N 1.302 -1.464 0 O-C-N 121.412 -0.805 . . . . 1.0 109.553 179.725 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 328' ' ' PHE . . . . . 0.442 ' CZ ' ' HD3' ' C' ' 335' ' ' ARG . 59.5 m-85 -113.08 -172.75 2.12 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.431 -0.793 . . . . 0.34 109.291 -179.936 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 329' ' ' THR . . . . . . . . . . . . . 60.0 p -152.92 171.74 17.85 Favored 'General case' 0 C--N 1.302 -1.461 0 O-C-N 121.196 -0.94 . . . . 1.05 108.895 179.847 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 330' ' ' LEU . . . . . . . . . . . . . 24.1 tp -151.86 130.17 12.05 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.378 -0.826 . . . . 1.07 109.71 -179.721 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 331' ' ' GLN . . . . . . . . . . . . . 1.5 tp60 -87.18 111.96 21.5 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.25 -0.906 . . . . 0.91 109.679 179.932 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 332' ' ' ILE . . . . . . . . . . . . . 63.6 mt -103.2 103.1 14.59 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.587 0 O-C-N 121.107 -0.996 . . . . 1.09 109.291 179.891 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 333' ' ' ARG . . . . . 0.581 ' HG2' ' CE2' ' C' ' 327' ' ' TYR . 0.0 OUTLIER -72.45 147.58 45.98 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.253 -0.904 . . . . 3.41 109.41 -179.879 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 334' ' ' GLY . . . . . . . . . . . . . . . 82.0 130.59 1.3 Allowed Glycine 0 N--CA 1.493 2.436 0 N-CA-C 109.452 -1.459 . . . . 0.4 109.452 -179.961 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 335' ' ' ARG . . . . . 0.428 ' HA ' ' CE2' ' C' ' 328' ' ' PHE . 0.2 OUTLIER -76.44 -31.42 57.85 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.133 -1.216 . . . . 3.55 110.022 -179.938 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 336' ' ' GLU . . . . . . . . . . . . . 4.8 tp10 -57.45 -62.88 1.47 Allowed 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.048 -1.033 . . . . 2.29 109.667 -179.627 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 337' ' ' ARG . . . . . 0.417 ' HG3' ' NH1' ' A' ' 337' ' ' ARG . 8.3 mtm-85 -59.99 -31.43 69.91 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.249 -0.907 . . . . 3.64 109.508 -179.765 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 338' ' ' PHE . . . . . . . . . . . . . 73.1 t80 -56.35 -56.02 26.23 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.304 -0.872 . . . . 0.41 109.851 -179.97 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 339' ' ' GLU . . . . . . . . . . . . . 93.6 mt-10 -52.74 -37.17 58.87 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.151 -0.968 . . . . 1.97 110.446 -179.568 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 340' ' ' MET . . . . . 0.443 ' SD ' ' OE1' ' D' ' 343' ' ' GLU . 28.2 ttp -63.76 -47.99 78.74 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.024 -1.047 . . . . 1.14 110.162 -179.238 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 341' ' ' PHE . . . . . . . . . . . . . 52.4 m-85 -62.43 -40.41 96.48 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.148 -0.97 . . . . 0.21 109.684 -179.515 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 342' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -51.12 -43.68 61.19 Favored 'General case' 0 N--CA 1.488 1.47 0 O-C-N 121.399 -0.813 . . . . 3.15 109.823 -179.939 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 343' ' ' GLU . . . . . 0.457 ' OE1' ' SD ' ' D' ' 340' ' ' MET . 1.8 tt0 -57.94 -46.84 84.43 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.374 -0.829 . . . . 2.35 109.706 -179.646 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 344' ' ' LEU . . . . . . . . . . . . . 41.4 mt -61.59 -33.71 74.36 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.176 -0.953 . . . . 1.06 109.247 179.906 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 345' ' ' ASN . . . . . 0.433 ' O ' ' HG3' ' A' ' 349' ' ' GLU . 13.3 t-20 -57.96 -55.68 31.77 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.558 -0.714 . . . . 1.36 109.517 179.979 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 346' ' ' GLU . . . . . . . . . . . . . 65.2 tt0 -63.63 -29.28 70.54 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.224 -0.922 . . . . 1.65 110.205 -179.756 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 347' ' ' ALA . . . . . . . . . . . . . . . -60.85 -61.44 2.58 Favored 'General case' 0 N--CA 1.494 1.759 0 O-C-N 120.983 -1.073 . . . . 1.03 109.983 -179.613 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 348' ' ' LEU . . . . . 0.419 ' N ' ' CD2' ' A' ' 348' ' ' LEU . 3.9 mm? -61.74 -40.47 95.2 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.256 -0.903 . . . . 1.04 109.546 -179.789 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 349' ' ' GLU . . . . . 0.433 ' HG3' ' O ' ' A' ' 345' ' ' ASN . 93.4 mt-10 -58.56 -34.13 70.69 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.244 -0.91 . . . . 1.94 110.15 -179.446 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 350' ' ' LEU . . . . . 0.471 ' O ' HD22 ' A' ' 350' ' ' LEU . 4.1 tt -65.35 -47.08 77.71 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.179 -0.951 . . . . 1.17 109.661 -179.833 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 351' ' ' LYS . . . . . . . . . . . . . 14.4 tttm -58.96 -41.77 88.27 Favored 'General case' 0 N--CA 1.489 1.497 0 O-C-N 121.166 -0.959 . . . . 1.97 109.845 -179.453 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 352' ' ' ASP . . . . . . . . . . . . . 48.2 m-20 -53.45 -40.29 65.12 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.035 -1.041 . . . . 1.16 109.505 -179.837 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 353' ' ' ALA . . . . . . . . . . . . . . . -67.5 -31.45 71.59 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.161 -0.962 . . . . 1.22 109.727 -179.888 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 354' ' ' GLN . . . . . . . . . . . . . 3.7 tt0 . . . . . 0 N--CA 1.493 1.696 0 O-C-N 121.255 -0.903 . . . . 1.71 109.818 -179.767 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' B' B ' 326' ' ' GLU . . . . . . . . . . . . . 3.4 mm-40 . . . . . 0 N--CA 1.49 1.535 0 N-CA-C 109.354 -0.61 . . . . 2.13 109.354 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' B' B ' 327' ' ' TYR . . . . . 0.526 ' CE2' ' HG2' ' D' ' 333' ' ' ARG . 42.0 m-85 -148.13 111.51 4.96 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.373 -0.829 . . . . 0.99 109.446 179.637 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 328' ' ' PHE . . . . . . . . . . . . . 62.8 m-85 -113.08 -173.37 2.24 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.362 -0.836 . . . . 0.36 109.243 -179.904 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 329' ' ' THR . . . . . 0.485 ' HA ' ' O ' ' D' ' 330' ' ' LEU . 77.2 p -152.12 170.77 19.14 Favored 'General case' 0 C--N 1.302 -1.479 0 O-C-N 121.348 -0.845 . . . . 1.05 109.099 179.824 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 330' ' ' LEU . . . . . 0.449 ' O ' ' HA ' ' D' ' 329' ' ' THR . 28.3 tp -151.13 130.31 12.71 Favored 'General case' 0 C--N 1.303 -1.449 0 O-C-N 121.025 -1.047 . . . . 1.07 109.71 -179.661 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 331' ' ' GLN . . . . . . . . . . . . . 1.5 tp60 -87.48 112.28 22.04 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.384 -0.823 . . . . 0.91 109.641 -179.891 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 332' ' ' ILE . . . . . . . . . . . . . 63.6 mt -103.49 103.23 14.83 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.478 0 O-C-N 121.118 -0.989 . . . . 1.08 109.195 179.834 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 333' ' ' ARG . . . . . 0.539 ' HG2' ' NH1' ' B' ' 333' ' ' ARG . 0.0 OUTLIER -72.69 146.56 46.43 Favored 'General case' 0 N--CA 1.488 1.475 0 O-C-N 121.178 -0.951 . . . . 3.42 109.472 -179.924 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' B' B ' 334' ' ' GLY . . . . . . . . . . . . . . . 82.88 130.81 1.57 Allowed Glycine 0 N--CA 1.492 2.428 0 N-CA-C 109.583 -1.407 . . . . 0.4 109.583 179.995 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 335' ' ' ARG . . . . . 0.409 ' HG3' HH11 ' B' ' 335' ' ' ARG . 0.2 OUTLIER -76.37 -31.54 58.09 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.35 -1.088 . . . . 3.55 109.773 -179.657 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' B' B ' 336' ' ' GLU . . . . . . . . . . . . . 4.8 tp10 -57.01 -63.37 1.23 Allowed 'General case' 0 N--CA 1.488 1.454 0 O-C-N 121.092 -1.005 . . . . 2.28 109.881 -179.743 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 337' ' ' ARG . . . . . 0.401 HH11 ' HG3' ' B' ' 337' ' ' ARG . 9.1 mtm-85 -60.1 -31.42 70.02 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.233 -0.917 . . . . 3.64 109.686 -179.712 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 338' ' ' PHE . . . . . . . . . . . . . 72.4 t80 -56.37 -55.72 30.06 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.218 -0.926 . . . . 0.39 109.826 -179.903 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 339' ' ' GLU . . . . . . . . . . . . . 94.1 mt-10 -52.96 -37.33 61.05 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.256 -0.903 . . . . 1.98 110.426 -179.265 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 340' ' ' MET . . . . . . . . . . . . . 29.3 ttp -63.57 -47.88 79.7 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.133 -0.98 . . . . 1.14 110.041 -179.404 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 341' ' ' PHE . . . . . . . . . . . . . 50.9 m-85 -62.03 -40.95 97.47 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 120.963 -1.086 . . . . 0.22 109.818 -179.762 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 342' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -50.7 -43.29 57.66 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.287 -0.883 . . . . 3.15 109.904 -179.859 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 343' ' ' GLU . . . . . . . . . . . . . 1.7 tt0 -58.42 -46.5 86.36 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.303 -0.873 . . . . 2.35 109.665 -179.518 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 344' ' ' LEU . . . . . . . . . . . . . 39.5 mt -61.57 -33.55 74.07 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.324 -0.86 . . . . 1.05 109.07 179.966 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 345' ' ' ASN . . . . . . . . . . . . . 13.0 t-20 -57.88 -56.62 19.61 Favored 'General case' 0 N--CA 1.49 1.525 0 O-C-N 121.413 -0.805 . . . . 1.35 109.686 179.999 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 346' ' ' GLU . . . . . . . . . . . . . 61.9 tt0 -63.31 -29.06 70.45 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.239 -0.913 . . . . 1.66 110.199 -179.783 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 347' ' ' ALA . . . . . . . . . . . . . . . -60.76 -62.07 2.13 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 120.86 -1.15 . . . . 1.02 109.922 -179.622 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 348' ' ' LEU . . . . . 0.425 ' CD2' ' N ' ' B' ' 348' ' ' LEU . 3.9 mm? -61.2 -40.25 93.24 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.076 -1.015 . . . . 1.05 109.764 -179.651 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 349' ' ' GLU . . . . . . . . . . . . . 96.9 mt-10 -59.01 -33.97 71.33 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.295 -0.878 . . . . 1.95 110.077 -179.453 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 350' ' ' LEU . . . . . 0.476 ' C ' ' CD2' ' B' ' 350' ' ' LEU . 4.0 tt -65.2 -47.09 78.11 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.278 -0.889 . . . . 1.18 109.641 -179.78 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 351' ' ' LYS . . . . . . . . . . . . . 16.2 tttm -58.77 -41.75 87.34 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.303 -0.873 . . . . 1.96 109.788 -179.666 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 352' ' ' ASP . . . . . . . . . . . . . 45.5 m-20 -54.22 -40.1 67.35 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.163 -0.961 . . . . 1.16 109.513 -179.667 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 353' ' ' ALA . . . . . . . . . . . . . . . -67.02 -31.66 72.35 Favored 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.266 -0.897 . . . . 1.21 109.501 179.928 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 354' ' ' GLN . . . . . . . . . . . . . 3.6 tt0 . . . . . 0 N--CA 1.488 1.455 0 O-C-N 121.159 -0.963 . . . . 1.69 109.891 -179.906 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' C' C ' 326' ' ' GLU . . . . . 0.481 ' O ' ' CD1' ' C' ' 327' ' ' TYR . 1.7 mm-40 . . . . . 0 N--CA 1.494 1.741 0 CA-C-O 121.42 0.629 . . . . 2.17 109.645 . . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 327' ' ' TYR . . . . . 0.581 ' CE2' ' HG2' ' A' ' 333' ' ' ARG . 37.4 m-85 -150.41 113.61 4.87 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.341 -0.849 . . . . 1.03 109.678 179.745 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' C' C ' 328' ' ' PHE . . . . . 0.453 ' O ' HG21 ' C' ' 329' ' ' THR . 96.3 m-85 -113.62 -170.39 1.69 Allowed 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.317 -0.864 . . . . 0.37 109.356 179.695 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' C' C ' 329' ' ' THR . . . . . 0.453 HG21 ' O ' ' C' ' 328' ' ' PHE . 12.8 p -153.31 167.17 30.28 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.168 -0.957 . . . . 1.04 109.71 -179.748 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' C' C ' 330' ' ' LEU . . . . . . . . . . . . . 56.9 tp -148.57 130.35 15.11 Favored 'General case' 0 N--CA 1.488 1.452 0 O-C-N 121.148 -0.97 . . . . 1.09 109.518 -179.97 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 331' ' ' GLN . . . . . 0.437 ' OE1' ' O ' ' A' ' 328' ' ' PHE . 7.4 tp-100 -87.32 111.24 20.87 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.383 -0.823 . . . . 1.48 109.538 -179.922 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' C' C ' 332' ' ' ILE . . . . . . . . . . . . . 31.1 mt -103.7 101.43 12.23 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.624 0 O-C-N 121.009 -1.057 . . . . 1.08 109.615 179.858 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 333' ' ' ARG . . . . . 0.528 ' NH1' ' HG2' ' C' ' 333' ' ' ARG . 0.0 OUTLIER -73.67 137.23 43.98 Favored 'General case' 0 N--CA 1.489 1.476 0 O-C-N 121.151 -0.968 . . . . 3.36 109.113 179.539 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' C' C ' 334' ' ' GLY . . . . . . . . . . . . . . . 96.33 128.62 5.79 Favored Glycine 0 N--CA 1.488 2.131 0 N-CA-C 109.571 -1.412 . . . . 0.35 109.571 -179.985 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 335' ' ' ARG . . . . . 0.442 ' HD3' ' CZ ' ' A' ' 328' ' ' PHE . 3.6 ttp180 -75.87 -36.59 59.49 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.363 -1.081 . . . . 3.23 109.309 -179.983 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' C' C ' 336' ' ' GLU . . . . . . . . . . . . . 1.3 mt-10 -58.95 -60.28 4.11 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.218 -0.926 . . . . 2.62 109.875 -179.748 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 337' ' ' ARG . . . . . 0.471 ' NE ' ' HA ' ' C' ' 337' ' ' ARG . 10.5 mmm180 -60.04 -35.23 74.66 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.187 -0.946 . . . . 3.61 109.678 -179.731 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' C' C ' 338' ' ' PHE . . . . . 0.402 ' CD1' ' C ' ' C' ' 338' ' ' PHE . 16.8 t80 -56.44 -48.66 76.56 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.242 -0.911 . . . . 0.43 109.803 -179.816 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' C' C ' 339' ' ' GLU . . . . . . . . . . . . . 2.2 mt-10 -53.57 -37.52 63.01 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.056 -1.027 . . . . 2.05 110.44 -179.237 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 340' ' ' MET . . . . . . . . . . . . . 32.5 ttp -63.75 -47.32 81.49 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.062 -1.024 . . . . 1.1 109.84 -179.485 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 341' ' ' PHE . . . . . . . . . . . . . 56.8 m-85 -61.75 -45.05 95.59 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.1 -1.0 . . . . 0.21 109.982 -179.523 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 342' ' ' ARG . . . . . 0.423 ' CG ' ' NH1' ' C' ' 342' ' ' ARG . 0.0 OUTLIER -50.09 -42.34 50.03 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.255 -0.903 . . . . 3.42 109.962 -179.842 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' C' C ' 343' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -59.98 -51.71 68.5 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.262 -0.899 . . . . 2.14 110.173 -179.522 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' C' C ' 344' ' ' LEU . . . . . . . . . . . . . 42.1 mt -60.18 -30.99 69.71 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.128 -0.983 . . . . 1.09 109.68 -179.559 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 345' ' ' ASN . . . . . . . . . . . . . 14.3 t-20 -57.84 -56.61 19.69 Favored 'General case' 0 N--CA 1.488 1.428 0 O-C-N 121.242 -0.911 . . . . 1.38 109.442 179.93 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 346' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -62.05 -29.27 70.18 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.399 -0.813 . . . . 2.21 109.92 -179.898 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' C' C ' 347' ' ' ALA . . . . . . . . . . . . . . . -61.1 -60.33 3.94 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.206 -0.934 . . . . 1.03 110.104 -179.695 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 348' ' ' LEU . . . . . 0.528 HD23 ' N ' ' C' ' 348' ' ' LEU . 4.1 mm? -59.4 -48.54 81.26 Favored 'General case' 0 N--CA 1.495 1.795 0 O-C-N 121.017 -1.052 . . . . 1.06 109.872 -179.561 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' C' C ' 349' ' ' GLU . . . . . . . . . . . . . 5.3 mm-40 -57.85 -28.66 64.32 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.196 -0.94 . . . . 2.19 109.354 -179.845 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 350' ' ' LEU . . . . . 0.515 HD21 ' CD1' ' D' ' 350' ' ' LEU . 5.2 tt -64.1 -46.53 83.82 Favored 'General case' 0 N--CA 1.489 1.501 0 O-C-N 121.207 -0.933 . . . . 1.2 108.928 179.689 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' C' C ' 351' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -59.56 -45.55 91.5 Favored 'General case' 0 N--CA 1.487 1.379 0 O-C-N 121.576 -0.703 . . . . 1.92 109.132 179.83 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' C' C ' 352' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -56.86 -32.5 65.89 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.477 -0.764 . . . . 1.19 109.417 179.729 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 353' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 1.547 0 O-C-N 121.27 -0.893 . . . . 1.15 109.328 -179.992 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' D' D ' 326' ' ' GLU . . . . . . . . . . . . . 3.1 mm-40 . . . . . 0 N--CA 1.489 1.505 0 N-CA-C 109.428 -0.582 . . . . 2.13 109.428 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' D' D ' 327' ' ' TYR . . . . . 0.433 ' CE2' ' HG2' ' B' ' 333' ' ' ARG . 42.6 m-85 -148.54 112.09 5.03 Favored 'General case' 0 N--CA 1.488 1.453 0 O-C-N 121.409 -0.807 . . . . 1.0 109.267 179.675 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' D' D ' 328' ' ' PHE . . . . . . . . . . . . . 58.0 m-85 -113.6 -173.25 2.23 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.533 -0.73 . . . . 0.34 109.281 -179.901 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' D' D ' 329' ' ' THR . . . . . 0.449 ' HA ' ' O ' ' B' ' 330' ' ' LEU . 76.5 p -152.28 170.57 19.72 Favored 'General case' 0 N--CA 1.488 1.472 0 O-C-N 121.276 -0.89 . . . . 1.05 109.004 -179.938 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' D' D ' 330' ' ' LEU . . . . . 0.485 ' O ' ' HA ' ' B' ' 329' ' ' THR . 32.2 tp -150.65 130.65 13.41 Favored 'General case' 0 C--N 1.302 -1.463 0 O-C-N 121.068 -1.02 . . . . 1.07 109.522 -179.901 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' D' D ' 331' ' ' GLN . . . . . . . . . . . . . 1.5 tp60 -87.83 112.27 22.29 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.263 -0.898 . . . . 0.93 109.545 179.968 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' D' D ' 332' ' ' ILE . . . . . . . . . . . . . 64.4 mt -103.33 102.85 14.25 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.45 0 O-C-N 121.217 -0.927 . . . . 1.07 109.415 179.835 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' D' D ' 333' ' ' ARG . . . . . 0.54 ' HG2' ' NH1' ' D' ' 333' ' ' ARG . 0.0 OUTLIER -72.33 144.42 48.31 Favored 'General case' 0 N--CA 1.488 1.463 0 O-C-N 121.361 -0.837 . . . . 3.42 109.724 -179.981 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' D' D ' 334' ' ' GLY . . . . . . . . . . . . . . . 84.75 130.98 2.21 Favored Glycine 0 N--CA 1.492 2.398 0 N-CA-C 109.605 -1.398 . . . . 0.41 109.605 179.933 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' D' D ' 335' ' ' ARG . . . . . 0.426 ' HG3' HH11 ' D' ' 335' ' ' ARG . 0.2 OUTLIER -76.47 -31.79 57.99 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.291 -1.123 . . . . 3.58 109.873 -179.93 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' D' D ' 336' ' ' GLU . . . . . . . . . . . . . 4.5 tp10 -57.13 -62.95 1.4 Allowed 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.107 -0.996 . . . . 2.26 109.651 -179.635 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' D' D ' 337' ' ' ARG . . . . . 0.404 HH11 ' HG3' ' D' ' 337' ' ' ARG . 7.9 mtm-85 -60.23 -31.93 70.64 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.353 -0.842 . . . . 3.64 109.732 -179.824 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' D' D ' 338' ' ' PHE . . . . . . . . . . . . . 72.2 t80 -56.47 -55.74 29.92 Favored 'General case' 0 C--N 1.302 -1.459 0 O-C-N 121.132 -0.98 . . . . 0.4 109.992 -179.858 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' D' D ' 339' ' ' GLU . . . . . . . . . . . . . 96.5 mt-10 -52.16 -37.97 56.18 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.291 -0.881 . . . . 1.99 110.335 -179.399 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' D' D ' 340' ' ' MET . . . . . 0.457 ' SD ' ' OE1' ' A' ' 343' ' ' GLU . 28.3 ttp -62.84 -47.95 81.18 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.208 -0.932 . . . . 1.13 110.199 -179.292 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' D' D ' 341' ' ' PHE . . . . . . . . . . . . . 50.3 m-85 -62.69 -40.75 98.1 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.195 -0.941 . . . . 0.21 109.747 -179.755 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' D' D ' 342' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -50.86 -43.38 59.4 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.219 -0.925 . . . . 3.15 109.926 -179.882 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' D' D ' 343' ' ' GLU . . . . . 0.443 ' OE1' ' SD ' ' A' ' 340' ' ' MET . 1.6 tt0 -58.14 -46.87 84.9 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.378 -0.826 . . . . 2.35 109.672 -179.618 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' D' D ' 344' ' ' LEU . . . . . . . . . . . . . 34.5 mt -61.35 -33.15 73.16 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.14 -0.975 . . . . 1.06 109.176 179.96 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' D' D ' 345' ' ' ASN . . . . . . . . . . . . . 12.2 t-20 -57.99 -56.31 23.62 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.449 -0.782 . . . . 1.35 109.723 179.972 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' D' D ' 346' ' ' GLU . . . . . . . . . . . . . 56.8 tt0 -63.63 -28.6 70.03 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.163 -0.96 . . . . 1.69 110.161 -179.518 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' D' D ' 347' ' ' ALA . . . . . . . . . . . . . . . -61.16 -61.65 2.41 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.051 -1.031 . . . . 1.03 109.846 -179.674 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' D' D ' 348' ' ' LEU . . . . . 0.414 ' CD2' ' N ' ' D' ' 348' ' ' LEU . 3.9 mm? -61.74 -40.9 96.73 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.17 -0.956 . . . . 1.04 109.896 -179.695 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' D' D ' 349' ' ' GLU . . . . . . . . . . . . . 96.8 mt-10 -58.49 -34.39 70.87 Favored 'General case' 0 N--CA 1.495 1.787 0 O-C-N 121.281 -0.887 . . . . 1.95 109.895 -179.737 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' D' D ' 350' ' ' LEU . . . . . 0.515 ' CD1' HD21 ' C' ' 350' ' ' LEU . 3.8 tt -64.75 -46.84 80.48 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.229 -0.919 . . . . 1.16 109.672 -179.688 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' D' D ' 351' ' ' LYS . . . . . . . . . . . . . 18.6 tttm -59.08 -41.97 89.3 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.317 -0.864 . . . . 1.97 109.987 -179.641 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' D' D ' 352' ' ' ASP . . . . . . . . . . . . . 38.3 m-20 -53.83 -39.67 65.77 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.155 -0.966 . . . . 1.17 109.42 179.921 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' D' D ' 353' ' ' ALA . . . . . . . . . . . . . . . -67.24 -31.97 72.69 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.217 -0.927 . . . . 1.21 109.586 -179.995 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' D' D ' 354' ' ' GLN . . . . . . . . . . . . . 3.5 tt0 . . . . . 0 N--CA 1.488 1.463 0 O-C-N 121.209 -0.932 . . . . 1.68 109.667 -179.862 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 326' ' ' GLU . . . . . . . . . . . . . 2.8 mt-10 . . . . . 0 N--CA 1.488 1.454 0 CA-C-O 121.385 0.612 . . . . 2.13 109.397 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 327' ' ' TYR . . . . . 0.537 ' CE1' ' HG2' ' C' ' 333' ' ' ARG . 41.0 m-85 -150.54 112.68 4.6 Favored 'General case' 0 C--N 1.303 -1.449 0 O-C-N 121.071 -1.018 . . . . 1.0 109.56 179.753 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 328' ' ' PHE . . . . . . . . . . . . . 69.6 m-85 -112.99 -171.53 1.88 Allowed 'General case' 0 N--CA 1.488 1.475 0 O-C-N 121.386 -0.821 . . . . 0.34 109.083 179.952 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 329' ' ' THR . . . . . . . . . . . . . 35.3 p -152.39 168.88 24.04 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.254 -0.904 . . . . 1.05 109.387 179.908 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 330' ' ' LEU . . . . . 0.451 ' O ' ' HA ' ' C' ' 329' ' ' THR . 23.3 tp -152.15 132.54 13.75 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.207 -0.933 . . . . 1.07 109.679 -179.71 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 331' ' ' GLN . . . . . 0.42 ' OE1' ' O ' ' C' ' 328' ' ' PHE . 9.2 tp-100 -87.05 114.09 23.36 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.15 -0.969 . . . . 0.91 109.325 179.692 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 332' ' ' ILE . . . . . . . . . . . . . 57.9 mt -103.96 103.9 15.92 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.59 0 O-C-N 121.22 -0.925 . . . . 1.09 109.97 -179.572 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 333' ' ' ARG . . . . . 0.48 ' CG ' ' CE2' ' C' ' 327' ' ' TYR . 5.5 mpt_? -74.19 150.96 40.1 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.191 -0.943 . . . . 3.41 109.508 179.477 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 334' ' ' GLY . . . . . . . . . . . . . . . 74.39 131.25 0.22 Allowed Glycine 0 N--CA 1.491 2.349 0 N-CA-C 109.902 -1.279 . . . . 0.4 109.902 179.519 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 335' ' ' ARG . . . . . 0.513 ' NH1' ' HG2' ' A' ' 335' ' ' ARG . 1.9 ttt-85 -79.39 -27.96 41.86 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.47 -1.018 . . . . 3.55 109.585 179.976 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 336' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -58.13 -66.95 0.4 Allowed 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.344 -0.847 . . . . 2.29 109.781 -179.953 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 337' ' ' ARG . . . . . 0.48 ' NH2' ' OD1' ' C' ' 352' ' ' ASP . 3.0 mtt180 -60.17 -29.57 68.77 Favored 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.091 -1.006 . . . . 3.64 109.456 -179.817 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 338' ' ' PHE . . . . . . . . . . . . . 54.9 t80 -55.56 -60.09 3.92 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.129 -0.982 . . . . 0.41 109.802 -179.901 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 339' ' ' GLU . . . . . . . . . . . . . 1.6 mm-40 -50.41 -34.88 26.06 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.291 -0.881 . . . . 1.97 109.701 -179.609 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 340' ' ' MET . . . . . . . . . . . . . 41.8 ttp -63.3 -48.4 78.23 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.155 -0.966 . . . . 1.14 109.751 -179.83 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 341' ' ' PHE . . . . . . . . . . . . . 44.6 m-85 -62.21 -53.15 59.39 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.213 -0.929 . . . . 0.21 109.704 -179.956 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 342' ' ' ARG . . . . . 0.458 ' NH1' ' CG ' ' A' ' 342' ' ' ARG . 0.0 OUTLIER -45.68 -41.27 10.24 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.351 -0.843 . . . . 3.15 109.832 -179.881 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 343' ' ' GLU . . . . . . . . . . . . . 8.8 tp10 -59.37 -46.65 88.07 Favored 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.2 -0.937 . . . . 2.35 109.661 -179.816 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 344' ' ' LEU . . . . . . . . . . . . . 56.9 mt -62.06 -44.49 96.58 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.153 -0.967 . . . . 1.06 110.112 -179.586 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 345' ' ' ASN . . . . . . . . . . . . . 41.5 t-20 -55.68 -43.15 76.09 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.176 -0.953 . . . . 1.36 109.626 -179.625 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 346' ' ' GLU . . . . . . . . . . . . . 43.4 tt0 -61.13 -38.69 87.25 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.085 -1.009 . . . . 1.65 109.362 -179.921 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 347' ' ' ALA . . . . . 0.404 ' CB ' ' HB3' ' B' ' 347' ' ' ALA . . . -60.03 -50.27 74.39 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.305 -0.872 . . . . 1.03 109.898 -179.758 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 348' ' ' LEU . . . . . 0.529 ' N ' HD23 ' A' ' 348' ' ' LEU . 3.9 mm? -61.05 -47.3 86.99 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.235 -0.916 . . . . 1.04 110.065 -179.413 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 349' ' ' GLU . . . . . . . . . . . . . 1.6 mm-40 -57.54 -36.27 71.4 Favored 'General case' 0 N--CA 1.489 1.485 0 O-C-N 121.213 -0.929 . . . . 1.94 109.821 -179.347 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 350' ' ' LEU . . . . . 0.501 HD23 HD23 ' B' ' 350' ' ' LEU . 5.2 tt -62.07 -44.71 96.09 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.13 -0.981 . . . . 1.17 109.073 -179.992 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 351' ' ' LYS . . . . . . . . . . . . . 26.1 tttp -58.21 -44.83 88.35 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.31 -0.869 . . . . 1.97 109.239 179.762 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 352' ' ' ASP . . . . . . . . . . . . . 5.4 m-20 -56.46 -41.16 76.03 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.256 -0.903 . . . . 1.16 109.461 179.893 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 353' ' ' ALA . . . . . . . . . . . . . . . -67.45 -32.83 73.95 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.35 -0.844 . . . . 1.22 109.32 -179.963 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 354' ' ' GLN . . . . . . . . . . . . . 7.4 tt0 . . . . . 0 N--CA 1.489 1.489 0 O-C-N 121.179 -0.951 . . . . 1.71 109.167 179.693 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' B' B ' 326' ' ' GLU . . . . . . . . . . . . . 2.7 mt-10 . . . . . 0 N--CA 1.489 1.489 0 CA-C-O 121.247 0.546 . . . . 2.13 109.631 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' B' B ' 327' ' ' TYR . . . . . . . . . . . . . 41.3 m-85 -149.91 112.65 4.78 Favored 'General case' 0 N--CA 1.489 1.491 0 O-C-N 121.089 -1.007 . . . . 0.99 109.635 179.751 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 328' ' ' PHE . . . . . 0.446 ' O ' ' OE1' ' D' ' 331' ' ' GLN . 67.7 m-85 -113.57 -172.75 2.13 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.439 -0.788 . . . . 0.36 109.244 179.879 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 329' ' ' THR . . . . . . . . . . . . . 37.1 p -151.81 168.95 23.48 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.134 -0.979 . . . . 1.05 109.515 -179.799 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 330' ' ' LEU . . . . . . . . . . . . . 20.8 tp -152.29 132.66 13.71 Favored 'General case' 0 C--N 1.304 -1.398 0 O-C-N 121.039 -1.038 . . . . 1.07 109.532 -179.726 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 331' ' ' GLN . . . . . . . . . . . . . 9.0 tp-100 -87.03 114.01 23.27 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.33 -0.856 . . . . 0.91 109.354 179.727 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 332' ' ' ILE . . . . . . . . . . . . . 57.4 mt -103.94 103.54 15.37 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.633 0 O-C-N 121.151 -0.968 . . . . 1.08 110.11 -179.598 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 333' ' ' ARG . . . . . 0.494 ' CG ' ' CE1' ' D' ' 327' ' ' TYR . 5.7 mpt_? -73.65 150.8 41.07 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.193 -0.942 . . . . 3.42 109.399 179.798 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 334' ' ' GLY . . . . . . . . . . . . . . . 74.8 131.07 0.24 Allowed Glycine 0 N--CA 1.49 2.264 0 N-CA-C 109.857 -1.297 . . . . 0.4 109.857 179.417 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 335' ' ' ARG . . . . . 0.523 ' HG2' ' NH1' ' B' ' 335' ' ' ARG . 1.9 ttt-85 -79.46 -27.48 41.6 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.442 -1.034 . . . . 3.55 109.605 -179.976 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 336' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -58.42 -66.84 0.42 Allowed 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.341 -0.849 . . . . 2.28 109.63 -179.902 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 337' ' ' ARG . . . . . . . . . . . . . 3.0 mtt180 -60.23 -29.4 68.73 Favored 'General case' 0 N--CA 1.489 1.492 0 O-C-N 121.202 -0.936 . . . . 3.64 109.653 -179.841 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 338' ' ' PHE . . . . . . . . . . . . . 58.5 t80 -55.53 -60.0 4.04 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.257 -0.902 . . . . 0.39 109.872 -179.877 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 339' ' ' GLU . . . . . . . . . . . . . 1.9 mm-40 -50.66 -35.16 29.38 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.347 -0.845 . . . . 1.98 109.687 -179.615 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 340' ' ' MET . . . . . . . . . . . . . 43.4 ttp -63.19 -48.49 78.14 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.164 -0.96 . . . . 1.14 109.722 -179.702 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 341' ' ' PHE . . . . . . . . . . . . . 45.4 m-85 -62.56 -52.31 63.91 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.124 -0.985 . . . . 0.22 109.81 179.933 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 342' ' ' ARG . . . . . 0.436 ' NH1' ' CG ' ' B' ' 342' ' ' ARG . 0.0 OUTLIER -46.26 -40.98 12.4 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.266 -0.896 . . . . 3.15 109.693 -179.803 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' B' B ' 343' ' ' GLU . . . . . . . . . . . . . 8.9 tp10 -59.52 -46.47 88.75 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.255 -0.903 . . . . 2.35 109.611 -179.816 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 344' ' ' LEU . . . . . . . . . . . . . 57.7 mt -62.18 -44.88 95.62 Favored 'General case' 0 N--CA 1.49 1.525 0 O-C-N 121.177 -0.952 . . . . 1.05 110.219 -179.608 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 345' ' ' ASN . . . . . . . . . . . . . 43.1 t-20 -55.59 -42.64 75.08 Favored 'General case' 0 N--CA 1.489 1.476 0 O-C-N 121.177 -0.952 . . . . 1.35 109.694 -179.532 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 346' ' ' GLU . . . . . . . . . . . . . 40.9 tt0 -61.06 -39.02 88.28 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.251 -0.905 . . . . 1.66 109.391 -179.894 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 347' ' ' ALA . . . . . 0.404 ' HB3' ' CB ' ' A' ' 347' ' ' ALA . . . -60.21 -50.17 74.71 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.324 -0.86 . . . . 1.02 109.964 -179.857 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 348' ' ' LEU . . . . . 0.519 ' N ' HD23 ' B' ' 348' ' ' LEU . 3.9 mm? -60.81 -47.53 85.91 Favored 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.285 -0.884 . . . . 1.05 109.973 -179.369 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 349' ' ' GLU . . . . . . . . . . . . . 1.5 mm-40 -57.65 -35.56 70.69 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.222 -0.923 . . . . 1.95 109.983 -179.574 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 350' ' ' LEU . . . . . 0.501 HD23 HD23 ' A' ' 350' ' ' LEU . 5.2 tt -62.67 -44.69 95.6 Favored 'General case' 0 N--CA 1.489 1.505 0 O-C-N 120.968 -1.083 . . . . 1.18 108.999 179.799 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 351' ' ' LYS . . . . . . . . . . . . . 28.2 tttp -58.82 -44.69 90.9 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.195 -0.941 . . . . 1.96 109.428 179.647 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 352' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 -56.44 -41.85 77.15 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.261 -0.899 . . . . 1.16 109.286 179.659 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 353' ' ' ALA . . . . . . . . . . . . . . . -66.63 -32.77 74.31 Favored 'General case' 0 N--CA 1.494 1.749 0 O-C-N 121.27 -0.894 . . . . 1.21 109.47 179.656 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 354' ' ' GLN . . . . . . . . . . . . . 7.8 tt0 . . . . . 0 C--N 1.304 -1.387 0 O-C-N 121.222 -0.924 . . . . 1.69 109.38 179.951 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' C' C ' 326' ' ' GLU . . . . . . . . . . . . . 11.6 mm-40 . . . . . 0 N--CA 1.49 1.572 0 CA-C-O 121.248 0.547 . . . . 2.17 109.578 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' C' C ' 327' ' ' TYR . . . . . 0.48 ' CE2' ' CG ' ' A' ' 333' ' ' ARG . 59.5 m-85 -150.85 103.21 3.05 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.176 -0.953 . . . . 1.03 109.698 -179.877 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' C' C ' 328' ' ' PHE . . . . . 0.437 ' O ' HG21 ' C' ' 329' ' ' THR . 38.3 m-85 -102.13 -169.13 1.63 Allowed 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.294 -0.879 . . . . 0.37 109.432 -179.984 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' C' C ' 329' ' ' THR . . . . . 0.451 ' HA ' ' O ' ' A' ' 330' ' ' LEU . 68.1 p -154.41 170.4 21.46 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.107 -0.996 . . . . 1.04 109.259 179.991 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' C' C ' 330' ' ' LEU . . . . . . . . . . . . . 22.6 tp -151.31 124.76 8.91 Favored 'General case' 0 N--CA 1.489 1.495 0 O-C-N 121.272 -0.893 . . . . 1.09 109.746 -179.692 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' C' C ' 331' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -87.24 112.49 22.07 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.289 -0.882 . . . . 1.48 109.189 179.522 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' C' C ' 332' ' ' ILE . . . . . 0.452 HG22 ' HA ' ' C' ' 338' ' ' PHE . 94.2 mt -103.84 111.12 32.28 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.528 0 O-C-N 121.105 -0.997 . . . . 1.08 109.632 -179.895 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' C' C ' 333' ' ' ARG . . . . . 0.537 ' HG2' ' CE1' ' A' ' 327' ' ' TYR . 61.2 mtm180 -74.24 141.78 45.36 Favored 'General case' 0 C--N 1.301 -1.503 0 O-C-N 121.458 -0.776 . . . . 3.36 109.517 179.718 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' C' C ' 334' ' ' GLY . . . . . . . . . . . . . . . 86.73 132.85 3.43 Favored Glycine 0 N--CA 1.492 2.381 0 N-CA-C 109.667 -1.373 . . . . 0.35 109.667 179.921 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' C' C ' 335' ' ' ARG . . . . . . . . . . . . . 6.6 ttm180 -78.28 -27.21 47.36 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.264 -1.139 . . . . 3.23 109.437 179.889 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' C' C ' 336' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -58.02 -70.76 0.13 Allowed 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.411 -0.805 . . . . 2.62 110.126 -179.864 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' C' C ' 337' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -57.98 -30.66 66.21 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.328 -0.857 . . . . 3.61 109.677 -179.372 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' C' C ' 338' ' ' PHE . . . . . 0.452 ' HA ' HG22 ' C' ' 332' ' ' ILE . 77.8 t80 -53.38 -60.39 3.36 Favored 'General case' 0 C--N 1.303 -1.438 0 O-C-N 121.167 -0.958 . . . . 0.43 109.545 -179.797 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' C' C ' 339' ' ' GLU . . . . . . . . . . . . . 51.5 mt-10 -51.22 -32.41 23.94 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.391 -0.818 . . . . 2.05 109.954 -179.64 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' C' C ' 340' ' ' MET . . . . . . . . . . . . . 59.2 ttp -64.16 -51.12 65.38 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.222 -0.923 . . . . 1.1 109.643 -179.944 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' C' C ' 341' ' ' PHE . . . . . . . . . . . . . 49.3 m-85 -62.08 -49.86 74.25 Favored 'General case' 0 N--CA 1.489 1.495 0 O-C-N 121.184 -0.948 . . . . 0.21 110.022 -179.597 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' C' C ' 342' ' ' ARG . . . . . . . . . . . . . 22.7 tpt180 -49.32 -37.41 24.21 Favored 'General case' 0 N--CA 1.488 1.451 0 O-C-N 121.09 -1.006 . . . . 3.42 109.552 -179.879 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' C' C ' 343' ' ' GLU . . . . . . . . . . . . . 1.1 tp10 -59.18 -52.33 66.16 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.233 -0.917 . . . . 2.14 109.566 179.868 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' C' C ' 344' ' ' LEU . . . . . 0.452 ' O ' HD21 ' C' ' 348' ' ' LEU . 60.0 mt -62.59 -25.5 68.11 Favored 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.157 -0.964 . . . . 1.09 109.242 179.803 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' C' C ' 345' ' ' ASN . . . . . . . . . . . . . 16.2 t-20 -57.86 -56.8 17.28 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.414 -0.803 . . . . 1.38 109.383 -179.896 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' C' C ' 346' ' ' GLU . . . . . . . . . . . . . 20.8 tt0 -62.03 -29.45 70.29 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.34 -0.85 . . . . 2.21 110.042 -179.641 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' C' C ' 347' ' ' ALA . . . . . . . . . . . . . . . -61.29 -54.54 42.75 Favored 'General case' 0 N--CA 1.494 1.74 0 O-C-N 121.018 -1.051 . . . . 1.03 110.199 -179.311 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' C' C ' 348' ' ' LEU . . . . . 0.518 HD23 ' N ' ' C' ' 348' ' ' LEU . 4.2 mm? -61.7 -51.49 68.18 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.318 -0.864 . . . . 1.06 110.463 -179.402 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' C' C ' 349' ' ' GLU . . . . . . . . . . . . . 11.5 mt-10 -57.41 -33.37 67.79 Favored 'General case' 0 N--CA 1.494 1.757 0 O-C-N 121.11 -0.994 . . . . 2.19 110.244 -179.352 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' C' C ' 350' ' ' LEU . . . . . 0.58 ' CD2' ' CD1' ' D' ' 350' ' ' LEU . 9.3 tt -62.9 -42.86 99.93 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.116 -0.99 . . . . 1.2 109.365 -179.758 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' C' C ' 351' ' ' LYS . . . . . . . . . . . . . 38.4 tttp -60.14 -51.62 68.82 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.288 -0.882 . . . . 1.92 109.445 179.547 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' C' C ' 352' ' ' ASP . . . . . 0.48 ' OD1' ' NH2' ' A' ' 337' ' ' ARG . 18.1 m-20 -55.46 -37.91 68.37 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.297 -0.877 . . . . 1.19 109.84 179.887 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' C' C ' 353' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 1.565 0 O-C-N 121.298 -0.876 . . . . 1.15 109.958 -179.581 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' D' D ' 326' ' ' GLU . . . . . . . . . . . . . 2.6 mt-10 . . . . . 0 N--CA 1.491 1.578 0 N-CA-C 109.469 -0.567 . . . . 2.13 109.469 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' D' D ' 327' ' ' TYR . . . . . 0.494 ' CE1' ' CG ' ' B' ' 333' ' ' ARG . 42.5 m-85 -150.53 112.49 4.55 Favored 'General case' 0 N--CA 1.488 1.442 0 O-C-N 121.204 -0.935 . . . . 1.0 109.421 179.913 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' D' D ' 328' ' ' PHE . . . . . . . . . . . . . 69.7 m-85 -114.06 -173.02 2.2 Favored 'General case' 0 N--CA 1.489 1.52 0 N-CA-C 108.985 -0.746 . . . . 0.34 108.985 179.802 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' D' D ' 329' ' ' THR . . . . . . . . . . . . . 39.7 p -151.44 169.65 21.52 Favored 'General case' 0 C--N 1.302 -1.473 0 O-C-N 121.288 -0.883 . . . . 1.05 109.379 -179.916 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' D' D ' 330' ' ' LEU . . . . . . . . . . . . . 19.5 tp -152.4 132.4 13.41 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.311 -0.868 . . . . 1.07 109.706 -179.767 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' D' D ' 331' ' ' GLN . . . . . 0.446 ' OE1' ' O ' ' B' ' 328' ' ' PHE . 9.0 tp-100 -86.83 113.77 22.92 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.313 -0.867 . . . . 0.93 109.306 179.639 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' D' D ' 332' ' ' ILE . . . . . . . . . . . . . 54.3 mt -103.72 102.97 14.46 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.746 0 O-C-N 121.242 -0.911 . . . . 1.07 110.235 -179.593 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' D' D ' 333' ' ' ARG . . . . . . . . . . . . . 5.6 mpt_? -73.45 150.92 41.31 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.027 -1.045 . . . . 3.42 109.639 179.615 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' D' D ' 334' ' ' GLY . . . . . . . . . . . . . . . 74.86 130.73 0.24 Allowed Glycine 0 N--CA 1.491 2.33 0 N-CA-C 109.836 -1.305 . . . . 0.41 109.836 179.57 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' D' D ' 335' ' ' ARG . . . . . 0.521 ' HG2' ' NH1' ' D' ' 335' ' ' ARG . 1.9 ttt-85 -79.06 -27.88 43.14 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.299 -1.118 . . . . 3.58 109.642 -179.997 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' D' D ' 336' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -57.71 -66.54 0.45 Allowed 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.21 -0.931 . . . . 2.26 109.695 -179.937 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' D' D ' 337' ' ' ARG . . . . . . . . . . . . . 2.9 mpt_? -60.73 -29.29 69.28 Favored 'General case' 0 N--CA 1.489 1.486 0 O-C-N 121.223 -0.923 . . . . 3.64 109.386 -179.772 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' D' D ' 338' ' ' PHE . . . . . . . . . . . . . 57.1 t80 -55.52 -60.55 3.26 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.19 -0.944 . . . . 0.4 109.611 -179.785 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' D' D ' 339' ' ' GLU . . . . . . . . . . . . . 2.2 mm-40 -49.91 -34.9 21.8 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.259 -0.901 . . . . 1.99 109.898 -179.745 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' D' D ' 340' ' ' MET . . . . . . . . . . . . . 42.0 ttp -63.36 -48.87 76.15 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.144 -0.972 . . . . 1.13 109.796 -179.663 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' D' D ' 341' ' ' PHE . . . . . . . . . . . . . 45.9 m-85 -62.39 -52.64 62.81 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.137 -0.977 . . . . 0.21 109.583 -179.875 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' D' D ' 342' ' ' ARG . . . . . 0.449 ' NH1' ' CG ' ' D' ' 342' ' ' ARG . 0.0 OUTLIER -45.78 -40.58 9.8 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.24 -0.913 . . . . 3.15 109.638 -179.896 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' D' D ' 343' ' ' GLU . . . . . . . . . . . . . 9.1 tp10 -59.67 -46.56 88.67 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.171 -0.956 . . . . 2.35 109.724 -179.835 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' D' D ' 344' ' ' LEU . . . . . 0.428 ' O ' HD21 ' D' ' 348' ' ' LEU . 57.1 mt -62.5 -44.92 95.19 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.289 -0.882 . . . . 1.06 110.186 -179.374 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' D' D ' 345' ' ' ASN . . . . . . . . . . . . . 44.9 t-20 -55.52 -42.47 74.58 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.176 -0.953 . . . . 1.35 109.632 -179.622 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' D' D ' 346' ' ' GLU . . . . . . . . . . . . . 33.7 tt0 -60.86 -39.49 89.36 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.204 -0.935 . . . . 1.69 109.614 -179.962 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' D' D ' 347' ' ' ALA . . . . . . . . . . . . . . . -60.5 -49.62 76.83 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.393 -0.817 . . . . 1.03 109.97 -179.861 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' D' D ' 348' ' ' LEU . . . . . 0.499 ' N ' HD23 ' D' ' 348' ' ' LEU . 3.9 mm? -60.93 -47.18 87.62 Favored 'General case' 0 N--CA 1.493 1.711 0 O-C-N 121.237 -0.914 . . . . 1.04 110.024 -179.327 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' D' D ' 349' ' ' GLU . . . . . . . . . . . . . 1.4 mm-40 -58.12 -36.01 72.32 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.11 -0.994 . . . . 1.95 109.796 -179.66 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' D' D ' 350' ' ' LEU . . . . . 0.58 ' CD1' ' CD2' ' C' ' 350' ' ' LEU . 5.2 tt -62.32 -44.54 96.26 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.124 -0.985 . . . . 1.16 109.01 -179.971 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' D' D ' 351' ' ' LYS . . . . . . . . . . . . . 28.4 tttp -59.09 -44.64 91.93 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.292 -0.88 . . . . 1.97 109.289 179.767 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' D' D ' 352' ' ' ASP . . . . . . . . . . . . . 4.2 m-20 -56.66 -41.2 76.81 Favored 'General case' 0 N--CA 1.488 1.434 0 O-C-N 121.343 -0.848 . . . . 1.17 109.255 179.823 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' D' D ' 353' ' ' ALA . . . . . . . . . . . . . . . -67.63 -31.81 72.08 Favored 'General case' 0 N--CA 1.488 1.447 0 O-C-N 121.22 -0.925 . . . . 1.21 109.31 -179.799 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' D' D ' 354' ' ' GLN . . . . . . . . . . . . . 7.6 tt0 . . . . . 0 N--CA 1.49 1.557 0 O-C-N 121.442 -0.786 . . . . 1.68 109.485 179.897 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 326' ' ' GLU . . . . . . . . . . . . . 19.9 mm-40 . . . . . 0 N--CA 1.487 1.422 0 N-CA-C 109.217 -0.66 . . . . 2.13 109.217 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 327' ' ' TYR . . . . . 0.58 ' CE2' ' HG2' ' C' ' 333' ' ' ARG . 42.4 m-85 -148.14 109.24 4.29 Favored 'General case' 0 C--N 1.302 -1.499 0 O-C-N 121.317 -0.864 . . . . 1.0 109.318 -179.938 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 328' ' ' PHE . . . . . 0.413 ' CE1' ' HA ' ' C' ' 335' ' ' ARG . 81.5 m-85 -110.65 -170.22 1.6 Allowed 'General case' 0 N--CA 1.488 1.446 0 O-C-N 121.356 -0.84 . . . . 0.34 109.344 -179.901 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 329' ' ' THR . . . . . . . . . . . . . 73.2 p -153.7 162.22 41.43 Favored 'General case' 0 C--N 1.302 -1.462 0 O-C-N 121.267 -0.896 . . . . 1.05 109.3 -179.905 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 330' ' ' LEU . . . . . 0.472 ' O ' ' HA ' ' C' ' 329' ' ' THR . 15.8 tp -149.32 130.06 14.14 Favored 'General case' 0 N--CA 1.488 1.434 0 O-C-N 121.166 -0.959 . . . . 1.07 109.367 -179.752 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 331' ' ' GLN . . . . . . . . . . . . . 2.0 tp60 -86.03 121.64 28.93 Favored 'General case' 0 N--CA 1.489 1.482 0 O-C-N 121.35 -0.844 . . . . 0.91 109.54 -179.906 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 332' ' ' ILE . . . . . . . . . . . . . 72.1 mt -103.45 103.73 15.59 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.561 0 O-C-N 121.238 -0.914 . . . . 1.09 109.425 -179.999 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 333' ' ' ARG . . . . . 0.565 ' HG2' ' CE1' ' C' ' 327' ' ' TYR . 0.3 OUTLIER -72.68 146.24 46.66 Favored 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.258 -0.901 . . . . 3.41 109.461 -179.985 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 334' ' ' GLY . . . . . . . . . . . . . . . 75.68 119.67 0.13 Allowed Glycine 0 N--CA 1.491 2.319 0 N-CA-C 109.621 -1.392 . . . . 0.4 109.621 179.993 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 335' ' ' ARG . . . . . 0.442 ' O ' ' HB3' ' A' ' 338' ' ' PHE . 1.8 ttt180 -65.6 -27.31 68.31 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.308 -1.113 . . . . 3.55 109.612 179.951 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 336' ' ' GLU . . . . . . . . . . . . . 23.4 tt0 -57.37 -63.79 1.11 Allowed 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.198 -0.939 . . . . 2.29 109.656 -179.941 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 337' ' ' ARG . . . . . 0.538 ' HG3' ' NH1' ' A' ' 337' ' ' ARG . 0.6 OUTLIER -60.03 -27.15 66.68 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.193 -0.942 . . . . 3.64 109.376 -179.93 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 338' ' ' PHE . . . . . 0.442 ' HB3' ' O ' ' A' ' 335' ' ' ARG . 83.8 t80 -55.31 -61.61 2.22 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.38 -0.825 . . . . 0.41 109.841 -179.808 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 339' ' ' GLU . . . . . . . . . . . . . 18.0 mt-10 -51.54 -33.62 32.89 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.26 -0.9 . . . . 1.97 110.164 -179.543 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 340' ' ' MET . . . . . . . . . . . . . 38.0 ttp -64.38 -52.7 56.96 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.126 -0.984 . . . . 1.14 110.453 -179.353 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 341' ' ' PHE . . . . . . . . . . . . . 42.5 m-85 -62.1 -46.22 90.02 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.164 -0.96 . . . . 0.21 110.142 -179.284 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 342' ' ' ARG . . . . . 0.437 ' CG ' HH11 ' A' ' 342' ' ' ARG . 0.0 OUTLIER -48.17 -38.51 18.27 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.054 -1.029 . . . . 3.15 109.883 -179.678 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 343' ' ' GLU . . . . . . . . . . . . . 33.3 tt0 -59.76 -51.27 70.5 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.113 -0.992 . . . . 2.35 109.833 -179.757 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 344' ' ' LEU . . . . . 0.494 ' CD2' HD21 ' B' ' 344' ' ' LEU . 34.9 mt -61.57 -31.39 71.43 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.154 -0.966 . . . . 1.06 109.556 -179.817 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 345' ' ' ASN . . . . . . . . . . . . . 13.2 t-20 -57.82 -60.3 3.91 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.297 -0.877 . . . . 1.36 109.72 -179.868 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 346' ' ' GLU . . . . . . . . . . . . . 26.1 tt0 -61.25 -26.45 67.77 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.295 -0.878 . . . . 1.65 109.916 -179.723 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 347' ' ' ALA . . . . . . . . . . . . . . . -61.11 -58.98 6.12 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.196 -0.94 . . . . 1.03 109.966 -179.81 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 348' ' ' LEU . . . . . 0.49 ' CD1' ' NH2' ' C' ' 337' ' ' ARG . 3.8 mm? -62.22 -42.19 99.08 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.237 -0.914 . . . . 1.04 109.974 -179.541 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 349' ' ' GLU . . . . . . . . . . . . . 31.5 mt-10 -57.67 -37.51 73.54 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.209 -0.932 . . . . 1.94 110.209 -179.287 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 350' ' ' LEU . . . . . 0.528 HD21 ' CD1' ' B' ' 350' ' ' LEU . 6.0 tt -64.37 -44.38 91.58 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.142 -0.974 . . . . 1.17 109.943 -179.573 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 351' ' ' LYS . . . . . . . . . . . . . 40.1 tttp -57.96 -37.67 74.6 Favored 'General case' 0 N--CA 1.488 1.466 0 O-C-N 121.093 -1.004 . . . . 1.97 109.508 -179.676 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 352' ' ' ASP . . . . . . . . . . . . . 11.3 m-20 -55.34 -41.44 72.51 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.278 -0.889 . . . . 1.16 109.42 179.868 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 353' ' ' ALA . . . . . . . . . . . . . . . -67.81 -30.76 70.26 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.282 -0.886 . . . . 1.22 109.707 -179.866 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 354' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 N--CA 1.492 1.636 0 O-C-N 121.154 -0.966 . . . . 1.71 109.631 -179.948 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 326' ' ' GLU . . . . . . . . . . . . . 20.0 mm-40 . . . . . 0 N--CA 1.487 1.421 0 N-CA-C 109.138 -0.689 . . . . 2.13 109.138 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' B' B ' 327' ' ' TYR . . . . . 0.471 ' CE1' ' HG2' ' D' ' 333' ' ' ARG . 41.7 m-85 -148.4 109.24 4.24 Favored 'General case' 0 N--CA 1.488 1.471 0 O-C-N 121.24 -0.913 . . . . 0.99 109.345 179.988 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 328' ' ' PHE . . . . . . . . . . . . . 81.3 m-85 -110.56 -170.23 1.6 Allowed 'General case' 0 N--CA 1.489 1.488 0 O-C-N 121.287 -0.883 . . . . 0.36 109.374 -179.869 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 329' ' ' THR . . . . . . . . . . . . . 73.6 p -153.68 162.17 41.48 Favored 'General case' 0 N--CA 1.488 1.443 0 O-C-N 121.254 -0.904 . . . . 1.05 109.312 -179.99 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 330' ' ' LEU . . . . . . . . . . . . . 15.9 tp -149.13 130.18 14.42 Favored 'General case' 0 N--CA 1.488 1.469 0 O-C-N 121.288 -0.883 . . . . 1.07 109.476 -179.869 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 331' ' ' GLN . . . . . . . . . . . . . 2.0 tp60 -86.02 121.52 28.76 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.283 -0.885 . . . . 0.91 109.563 -179.957 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 332' ' ' ILE . . . . . . . . . . . . . 71.7 mt -103.37 103.7 15.53 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.526 0 O-C-N 121.248 -0.907 . . . . 1.08 109.519 179.889 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 333' ' ' ARG . . . . . 0.505 ' HG2' ' CE1' ' D' ' 327' ' ' TYR . 0.3 OUTLIER -72.6 146.22 46.81 Favored 'General case' 0 N--CA 1.489 1.487 0 O-C-N 121.219 -0.925 . . . . 3.42 109.527 179.941 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' B' B ' 334' ' ' GLY . . . . . . . . . . . . . . . 75.78 119.56 0.13 Allowed Glycine 0 N--CA 1.49 2.242 0 N-CA-C 109.63 -1.388 . . . . 0.4 109.63 179.992 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 335' ' ' ARG . . . . . 0.485 ' HG3' ' CZ ' ' D' ' 328' ' ' PHE . 1.8 ttt180 -65.61 -27.39 68.37 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.267 -1.137 . . . . 3.55 109.462 -179.961 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 336' ' ' GLU . . . . . . . . . . . . . 23.5 tt0 -57.38 -63.73 1.13 Allowed 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.264 -0.897 . . . . 2.28 109.615 -179.873 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 337' ' ' ARG . . . . . 0.557 ' NH1' ' HG3' ' B' ' 337' ' ' ARG . 0.5 OUTLIER -59.88 -27.24 66.53 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.237 -0.914 . . . . 3.64 109.417 179.937 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' B' B ' 338' ' ' PHE . . . . . 0.433 ' HB3' ' O ' ' B' ' 335' ' ' ARG . 84.4 t80 -55.38 -61.48 2.31 Favored 'General case' 0 N--CA 1.488 1.455 0 O-C-N 121.273 -0.892 . . . . 0.39 109.865 -179.722 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 339' ' ' GLU . . . . . . . . . . . . . 18.0 mt-10 -51.67 -33.48 34.03 Favored 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.176 -0.953 . . . . 1.98 110.171 -179.533 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 340' ' ' MET . . . . . . . . . . . . . 38.1 ttp -64.5 -52.75 56.23 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.08 -1.012 . . . . 1.14 110.388 -179.312 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 341' ' ' PHE . . . . . . . . . . . . . 42.2 m-85 -61.96 -46.42 89.35 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.115 -0.99 . . . . 0.22 110.08 -179.285 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 342' ' ' ARG . . . . . 0.455 ' NH1' ' CG ' ' B' ' 342' ' ' ARG . 0.0 OUTLIER -47.98 -38.83 17.78 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.202 -0.936 . . . . 3.15 109.868 -179.691 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' B' B ' 343' ' ' GLU . . . . . . . . . . . . . 33.1 tt0 -59.45 -51.35 70.26 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.139 -0.976 . . . . 2.35 109.818 -179.731 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 344' ' ' LEU . . . . . 0.494 HD21 ' CD2' ' A' ' 344' ' ' LEU . 34.3 mt -61.57 -31.5 71.55 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.144 -0.972 . . . . 1.05 109.586 -179.757 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 345' ' ' ASN . . . . . . . . . . . . . 13.1 t-20 -57.86 -60.14 4.16 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.302 -0.874 . . . . 1.35 109.747 -179.849 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 346' ' ' GLU . . . . . . . . . . . . . 26.1 tt0 -61.28 -26.63 67.9 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.34 -0.85 . . . . 1.66 109.745 -179.736 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 347' ' ' ALA . . . . . . . . . . . . . . . -60.93 -59.17 5.8 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.125 -0.984 . . . . 1.02 109.934 -179.702 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 348' ' ' LEU . . . . . 0.436 HD21 ' O ' ' B' ' 344' ' ' LEU . 3.8 mm? -62.01 -42.15 98.85 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.212 -0.93 . . . . 1.05 110.042 -179.526 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 349' ' ' GLU . . . . . . . . . . . . . 31.6 mt-10 -57.81 -37.38 73.68 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.145 -0.972 . . . . 1.95 110.246 -179.303 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 350' ' ' LEU . . . . . 0.528 ' CD1' HD21 ' A' ' 350' ' ' LEU . 6.0 tt -64.45 -44.28 91.59 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.163 -0.96 . . . . 1.18 109.969 -179.565 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 351' ' ' LYS . . . . . . . . . . . . . 40.1 tttp -58.01 -37.73 74.85 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.161 -0.962 . . . . 1.96 109.43 -179.704 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 352' ' ' ASP . . . . . . . . . . . . . 11.4 m-20 -55.3 -41.44 72.34 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.219 -0.926 . . . . 1.16 109.45 179.829 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 353' ' ' ALA . . . . . . . . . . . . . . . -67.78 -30.75 70.27 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.29 -0.881 . . . . 1.21 109.705 -179.891 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 354' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 N--CA 1.491 1.587 0 O-C-N 121.18 -0.95 . . . . 1.69 109.577 -179.863 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' C' C ' 326' ' ' GLU . . . . . . . . . . . . . 9.9 mm-40 . . . . . 0 N--CA 1.488 1.47 0 N-CA-C 109.241 -0.652 . . . . 2.17 109.241 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' C' C ' 327' ' ' TYR . . . . . 0.565 ' CE1' ' HG2' ' A' ' 333' ' ' ARG . 41.1 m-85 -148.95 108.16 3.92 Favored 'General case' 0 N--CA 1.488 1.464 0 O-C-N 121.395 -0.816 . . . . 1.03 109.257 179.906 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' C' C ' 328' ' ' PHE . . . . . 0.551 ' CD1' ' N ' ' C' ' 328' ' ' PHE . 5.0 m-85 -112.95 -168.41 1.32 Allowed 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.374 -0.829 . . . . 0.37 109.251 -179.887 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' C' C ' 329' ' ' THR . . . . . 0.472 ' HA ' ' O ' ' A' ' 330' ' ' LEU . 57.0 p -151.65 174.59 13.29 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.202 -0.936 . . . . 1.04 109.376 -179.926 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' C' C ' 330' ' ' LEU . . . . . . . . . . . . . 14.8 tp -151.28 125.93 9.59 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.186 -0.946 . . . . 1.09 109.695 -179.736 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' C' C ' 331' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -87.91 114.49 24.57 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.246 -0.909 . . . . 1.48 108.999 179.636 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' C' C ' 332' ' ' ILE . . . . . 0.549 HD12 ' CD2' ' C' ' 341' ' ' PHE . 11.2 mt -103.36 112.36 36.55 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.566 0 O-C-N 121.15 -0.969 . . . . 1.08 110.006 -179.73 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' C' C ' 333' ' ' ARG . . . . . 0.58 ' HG2' ' CE2' ' A' ' 327' ' ' TYR . 0.7 OUTLIER -72.6 154.46 40.75 Favored 'General case' 0 N--CA 1.488 1.44 0 O-C-N 121.283 -0.886 . . . . 3.36 109.127 179.443 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' C' C ' 334' ' ' GLY . . . . . . . . . . . . . . . 73.84 128.17 0.14 Allowed Glycine 0 N--CA 1.489 2.223 0 N-CA-C 109.552 -1.419 . . . . 0.35 109.552 179.956 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' C' C ' 335' ' ' ARG . . . . . 0.413 ' HA ' ' CE1' ' A' ' 328' ' ' PHE . 9.0 ttt180 -73.64 -40.0 64.08 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.324 -1.103 . . . . 3.23 109.656 -179.853 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' C' C ' 336' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -56.97 -48.84 77.45 Favored 'General case' 0 N--CA 1.494 1.739 0 O-C-N 121.262 -0.899 . . . . 2.62 109.684 -179.789 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' C' C ' 337' ' ' ARG . . . . . 0.518 ' HG2' ' NH1' ' C' ' 337' ' ' ARG . 0.0 OUTLIER -62.9 -37.76 88.24 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.139 -0.976 . . . . 3.61 109.502 179.822 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' C' C ' 338' ' ' PHE . . . . . 0.44 ' HA ' HG23 ' C' ' 332' ' ' ILE . 82.2 t80 -55.16 -51.18 67.3 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.35 -0.844 . . . . 0.43 109.861 -179.73 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' C' C ' 339' ' ' GLU . . . . . . . . . . . . . 10.3 mt-10 -52.55 -36.64 56.18 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.113 -0.992 . . . . 2.05 110.38 -179.557 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' C' C ' 340' ' ' MET . . . . . . . . . . . . . 35.5 ttp -63.77 -51.52 64.45 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.073 -1.017 . . . . 1.1 110.402 -179.262 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' C' C ' 341' ' ' PHE . . . . . 0.549 ' CD2' HD12 ' C' ' 332' ' ' ILE . 40.2 m-85 -61.84 -41.24 97.56 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.146 -0.971 . . . . 0.21 110.1 -179.281 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' C' C ' 342' ' ' ARG . . . . . . . . . . . . . 1.4 ttt180 -52.24 -40.97 62.36 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.093 -1.004 . . . . 3.42 109.526 179.934 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' C' C ' 343' ' ' GLU . . . . . . . . . . . . . 25.2 tt0 -58.95 -53.87 53.49 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.25 -0.906 . . . . 2.14 109.59 -179.743 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' C' C ' 344' ' ' LEU . . . . . 0.468 ' O ' HD21 ' C' ' 348' ' ' LEU . 30.6 mt -59.87 -26.08 65.58 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.217 -0.927 . . . . 1.09 108.939 179.915 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' C' C ' 345' ' ' ASN . . . . . . . . . . . . . 6.4 t-20 -59.52 -64.09 1.07 Allowed 'General case' 0 N--CA 1.488 1.453 0 O-C-N 121.414 -0.804 . . . . 1.38 109.534 179.823 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' C' C ' 346' ' ' GLU . . . . . . . . . . . . . 9.1 tp10 -62.77 -25.42 68.21 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.396 -0.815 . . . . 2.21 109.972 -179.743 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' C' C ' 347' ' ' ALA . . . . . . . . . . . . . . . -60.58 -57.32 13.21 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.185 -0.947 . . . . 1.03 109.862 -179.687 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' C' C ' 348' ' ' LEU . . . . . 0.485 HD23 ' N ' ' C' ' 348' ' ' LEU . 3.6 mm? -62.57 -45.0 94.93 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.184 -0.948 . . . . 1.06 110.045 -179.503 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' C' C ' 349' ' ' GLU . . . . . 0.421 ' O ' ' HB2' ' C' ' 352' ' ' ASP . 97.7 mt-10 -57.37 -34.4 68.79 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.267 -0.895 . . . . 2.19 110.157 -179.312 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' C' C ' 350' ' ' LEU . . . . . 0.526 HD23 ' CD1' ' D' ' 350' ' ' LEU . 7.9 tt -63.23 -44.55 94.93 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.067 -1.021 . . . . 1.2 109.209 -179.929 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' C' C ' 351' ' ' LYS . . . . . . . . . . . . . 62.9 tttm -60.65 -33.29 72.58 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.323 -0.861 . . . . 1.92 109.576 179.955 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' C' C ' 352' ' ' ASP . . . . . 0.421 ' HB2' ' O ' ' C' ' 349' ' ' GLU . 4.0 m-20 -52.75 -50.76 62.83 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.164 -0.96 . . . . 1.19 109.172 -179.979 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' C' C ' 353' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.488 1.447 0 O-C-N 121.316 -0.865 . . . . 1.15 108.968 179.564 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' D' D ' 326' ' ' GLU . . . . . . . . . . . . . 20.0 mm-40 . . . . . 0 N--CA 1.487 1.418 0 N-CA-C 109.229 -0.656 . . . . 2.13 109.229 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' D' D ' 327' ' ' TYR . . . . . 0.505 ' CE1' ' HG2' ' B' ' 333' ' ' ARG . 42.1 m-85 -148.23 109.28 4.28 Favored 'General case' 0 C--N 1.303 -1.453 0 O-C-N 121.339 -0.85 . . . . 1.0 109.368 -179.998 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' D' D ' 328' ' ' PHE . . . . . 0.485 ' CZ ' ' HG3' ' B' ' 335' ' ' ARG . 81.6 m-85 -110.59 -170.11 1.58 Allowed 'General case' 0 N--CA 1.489 1.487 0 O-C-N 121.346 -0.846 . . . . 0.34 109.319 -179.867 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' D' D ' 329' ' ' THR . . . . . . . . . . . . . 73.4 p -153.8 162.14 41.49 Favored 'General case' 0 N--CA 1.488 1.449 0 O-C-N 121.222 -0.924 . . . . 1.05 109.271 -179.963 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' D' D ' 330' ' ' LEU . . . . . . . . . . . . . 16.0 tp -149.05 130.24 14.55 Favored 'General case' 0 N--CA 1.489 1.491 0 O-C-N 121.295 -0.878 . . . . 1.07 109.43 -179.753 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' D' D ' 331' ' ' GLN . . . . . . . . . . . . . 2.0 tp60 -86.24 121.6 29.06 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.251 -0.906 . . . . 0.93 109.474 -179.92 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' D' D ' 332' ' ' ILE . . . . . . . . . . . . . 71.9 mt -103.5 103.54 15.31 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.537 0 O-C-N 121.263 -0.898 . . . . 1.07 109.461 179.969 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' D' D ' 333' ' ' ARG . . . . . 0.471 ' HG2' ' CE1' ' B' ' 327' ' ' TYR . 0.3 OUTLIER -72.5 146.35 46.9 Favored 'General case' 0 N--CA 1.489 1.495 0 O-C-N 121.241 -0.912 . . . . 3.42 109.407 179.976 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' D' D ' 334' ' ' GLY . . . . . . . . . . . . . . . 75.76 119.39 0.13 Allowed Glycine 0 N--CA 1.491 2.364 0 N-CA-C 109.574 -1.411 . . . . 0.41 109.574 179.921 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' D' D ' 335' ' ' ARG . . . . . 0.437 ' O ' ' HB3' ' D' ' 338' ' ' PHE . 1.8 ttt180 -65.49 -27.49 68.52 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.245 -1.15 . . . . 3.58 109.513 179.911 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' D' D ' 336' ' ' GLU . . . . . . . . . . . . . 23.2 tt0 -57.24 -63.75 1.12 Allowed 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.209 -0.932 . . . . 2.26 109.643 -179.897 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' D' D ' 337' ' ' ARG . . . . . 0.556 ' NH1' ' HG3' ' D' ' 337' ' ' ARG . 0.6 OUTLIER -60.04 -27.16 66.7 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.225 -0.922 . . . . 3.64 109.374 179.999 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' D' D ' 338' ' ' PHE . . . . . 0.437 ' HB3' ' O ' ' D' ' 335' ' ' ARG . 83.8 t80 -55.39 -61.6 2.23 Favored 'General case' 0 N--CA 1.488 1.474 0 O-C-N 121.351 -0.843 . . . . 0.4 109.893 -179.8 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' D' D ' 339' ' ' GLU . . . . . . . . . . . . . 17.8 mt-10 -51.5 -33.72 32.8 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.173 -0.955 . . . . 1.99 110.131 -179.551 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' D' D ' 340' ' ' MET . . . . . . . . . . . . . 37.9 ttp -64.24 -52.85 56.75 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.143 -0.973 . . . . 1.13 110.382 -179.336 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' D' D ' 341' ' ' PHE . . . . . . . . . . . . . 42.5 m-85 -62.01 -46.16 90.44 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.223 -0.923 . . . . 0.21 110.147 -179.228 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' D' D ' 342' ' ' ARG . . . . . 0.453 ' NH1' ' CG ' ' D' ' 342' ' ' ARG . 0.0 OUTLIER -48.28 -38.63 19.26 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.113 -0.992 . . . . 3.15 109.869 -179.676 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' D' D ' 343' ' ' GLU . . . . . . . . . . . . . 33.1 tt0 -59.7 -51.32 70.27 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.121 -0.987 . . . . 2.35 109.779 -179.705 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' D' D ' 344' ' ' LEU . . . . . 0.467 ' CD2' HD23 ' C' ' 344' ' ' LEU . 34.1 mt -61.45 -31.35 71.3 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.176 -0.953 . . . . 1.06 109.667 -179.911 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' D' D ' 345' ' ' ASN . . . . . . . . . . . . . 13.0 t-20 -57.91 -60.21 4.06 Favored 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.297 -0.877 . . . . 1.35 109.758 -179.907 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' D' D ' 346' ' ' GLU . . . . . . . . . . . . . 25.9 tt0 -61.19 -26.76 67.94 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.279 -0.888 . . . . 1.69 109.782 -179.741 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' D' D ' 347' ' ' ALA . . . . . . . . . . . . . . . -60.83 -59.1 5.91 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.127 -0.983 . . . . 1.03 110.016 -179.743 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' D' D ' 348' ' ' LEU . . . . . 0.433 HD21 ' O ' ' D' ' 344' ' ' LEU . 3.8 mm? -62.17 -42.04 98.89 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.166 -0.959 . . . . 1.04 110.016 -179.533 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' D' D ' 349' ' ' GLU . . . . . . . . . . . . . 30.9 mt-10 -57.89 -37.31 73.76 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.195 -0.941 . . . . 1.95 110.182 -179.249 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' D' D ' 350' ' ' LEU . . . . . 0.526 ' CD1' HD23 ' C' ' 350' ' ' LEU . 6.0 tt -64.58 -44.28 91.19 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.106 -0.996 . . . . 1.16 109.904 -179.563 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' D' D ' 351' ' ' LYS . . . . . . . . . . . . . 40.1 tttp -57.95 -37.82 74.85 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.208 -0.932 . . . . 1.97 109.501 -179.746 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' D' D ' 352' ' ' ASP . . . . . . . . . . . . . 11.6 m-20 -55.22 -41.5 72.14 Favored 'General case' 0 N--CA 1.489 1.49 0 O-C-N 121.22 -0.925 . . . . 1.17 109.433 179.834 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' D' D ' 353' ' ' ALA . . . . . . . . . . . . . . . -67.89 -30.71 70.12 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.316 -0.865 . . . . 1.21 109.692 -179.837 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' D' D ' 354' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 N--CA 1.491 1.609 0 O-C-N 121.112 -0.993 . . . . 1.68 109.59 -179.94 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 326' ' ' GLU . . . . . 0.419 ' HB2' ' CE1' ' A' ' 328' ' ' PHE . 30.6 mm-40 . . . . . 0 N--CA 1.489 1.489 0 CA-C-O 121.274 0.559 . . . . 2.13 109.779 . . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 327' ' ' TYR . . . . . 0.632 ' CE2' ' CG ' ' C' ' 333' ' ' ARG . 44.2 m-85 -148.87 107.16 3.75 Favored 'General case' 0 N--CA 1.489 1.485 0 O-C-N 121.326 -0.859 . . . . 1.0 109.523 -179.967 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 328' ' ' PHE . . . . . 0.419 ' CE1' ' HB2' ' A' ' 326' ' ' GLU . 5.5 m-85 -112.93 -166.17 1.06 Allowed 'General case' 0 N--CA 1.488 1.45 0 O-C-N 121.533 -0.729 . . . . 0.34 109.081 -179.891 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 329' ' ' THR . . . . . 0.433 ' HA ' ' O ' ' C' ' 330' ' ' LEU . 36.5 p -155.32 178.5 10.15 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.109 -0.995 . . . . 1.05 109.552 179.768 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 330' ' ' LEU . . . . . 0.455 ' O ' ' HA ' ' C' ' 329' ' ' THR . 67.8 tp -151.98 130.15 11.94 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.241 -0.912 . . . . 1.07 109.024 179.937 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 331' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -87.54 109.2 19.45 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.365 -0.834 . . . . 0.91 109.688 -179.724 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 332' ' ' ILE . . . . . . . . . . . . . 52.7 mt -102.25 110.7 29.69 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.521 0 O-C-N 120.941 -1.099 . . . . 1.09 109.577 179.794 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 333' ' ' ARG . . . . . 0.518 ' NH1' ' HG2' ' A' ' 333' ' ' ARG . 0.0 OUTLIER -73.33 142.74 47.09 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.461 -0.774 . . . . 3.41 109.632 179.523 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 334' ' ' GLY . . . . . . . . . . . . . . . 82.64 132.78 1.8 Allowed Glycine 0 N--CA 1.488 2.106 0 N-CA-C 109.653 -1.379 . . . . 0.4 109.653 179.815 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 335' ' ' ARG . . . . . . . . . . . . . 10.2 ttp180 -79.95 -26.14 40.17 Favored 'General case' 0 C--N 1.302 -1.493 0 O-C-N 121.416 -1.049 . . . . 3.55 109.002 179.696 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 336' ' ' GLU . . . . . . . . . . . . . 2.2 tt0 -58.2 -68.77 0.22 Allowed 'General case' 0 N--CA 1.488 1.467 0 O-C-N 121.14 -0.975 . . . . 2.29 109.649 -179.732 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 337' ' ' ARG . . . . . . . . . . . . . 2.8 mmt180 -60.17 -27.45 67.12 Favored 'General case' 0 N--CA 1.489 1.481 0 O-C-N 121.115 -0.991 . . . . 3.64 109.421 179.752 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 338' ' ' PHE . . . . . . . . . . . . . 47.1 t80 -54.79 -58.72 6.45 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.254 -0.904 . . . . 0.41 109.604 179.914 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 339' ' ' GLU . . . . . . . . . . . . . 11.4 mt-10 -53.42 -31.82 46.93 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.176 -0.953 . . . . 1.97 109.996 -179.675 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 340' ' ' MET . . . . . . . . . . . . . 9.4 ttp -64.19 -50.64 67.32 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.249 -0.907 . . . . 1.14 109.953 -179.781 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 341' ' ' PHE . . . . . . . . . . . . . 48.2 m-85 -63.58 -50.38 69.68 Favored 'General case' 0 C--N 1.3 -1.57 0 O-C-N 121.246 -0.909 . . . . 0.21 110.001 -179.327 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 342' ' ' ARG . . . . . . . . . . . . . 71.5 ttt180 -48.87 -40.39 29.5 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.142 -0.974 . . . . 3.15 110.041 -179.373 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 343' ' ' GLU . . . . . . . . . . . . . 3.2 tt0 -61.57 -43.68 98.41 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.121 -0.987 . . . . 2.35 110.038 -179.441 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 344' ' ' LEU . . . . . 0.471 ' O ' HD21 ' A' ' 348' ' ' LEU . 45.9 mt -63.4 -41.69 98.74 Favored 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.084 -1.01 . . . . 1.06 109.587 179.985 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 345' ' ' ASN . . . . . . . . . . . . . 46.4 t30 -56.45 -49.19 75.31 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.149 -0.969 . . . . 1.36 109.932 -179.746 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 346' ' ' GLU . . . . . . . . . . . . . 11.5 tt0 -61.27 -30.16 70.3 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.177 -0.952 . . . . 1.65 109.686 -179.702 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 347' ' ' ALA . . . . . . . . . . . . . . . -63.28 -49.21 74.96 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.333 -0.854 . . . . 1.03 109.745 -179.983 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 348' ' ' LEU . . . . . 0.474 ' N ' ' CD2' ' A' ' 348' ' ' LEU . 4.3 mm? -62.66 -51.44 67.23 Favored 'General case' 0 N--CA 1.494 1.754 0 O-C-N 121.444 -0.785 . . . . 1.04 109.833 -179.789 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 349' ' ' GLU . . . . . . . . . . . . . 26.2 mt-10 -58.09 -30.83 66.55 Favored 'General case' 0 N--CA 1.488 1.446 0 O-C-N 121.352 -0.842 . . . . 1.94 109.738 -179.406 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 350' ' ' LEU . . . . . 0.461 ' O ' HD22 ' A' ' 350' ' ' LEU . 4.1 tt -63.93 -41.62 97.58 Favored 'General case' 0 C--N 1.304 -1.393 0 O-C-N 121.271 -0.893 . . . . 1.17 109.064 179.972 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 351' ' ' LYS . . . . . . . . . . . . . 15.8 tttt -60.41 -41.8 94.66 Favored 'General case' 0 N--CA 1.486 1.37 0 O-C-N 121.336 -0.853 . . . . 1.97 109.5 -179.863 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 352' ' ' ASP . . . . . . . . . . . . . 94.9 m-20 -55.71 -39.45 71.08 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.083 -1.01 . . . . 1.16 109.951 -179.8 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 353' ' ' ALA . . . . . . . . . . . . . . . -66.05 -40.13 90.7 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.079 -1.013 . . . . 1.22 109.815 -179.669 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 354' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.489 1.512 0 O-C-N 121.127 -0.983 . . . . 1.71 109.573 -179.722 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 326' ' ' GLU . . . . . 0.406 ' HB2' ' CE1' ' B' ' 328' ' ' PHE . 26.2 mm-40 . . . . . 0 N--CA 1.492 1.642 0 CA-C-O 121.189 0.519 . . . . 2.13 109.846 . . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 327' ' ' TYR . . . . . 0.494 ' CE2' ' HG2' ' D' ' 333' ' ' ARG . 42.0 m-85 -147.38 108.04 4.14 Favored 'General case' 0 N--CA 1.488 1.457 0 O-C-N 121.149 -0.969 . . . . 0.99 109.699 -179.934 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 328' ' ' PHE . . . . . 0.406 ' CE1' ' HB2' ' B' ' 326' ' ' GLU . 4.9 m-85 -113.04 -166.46 1.08 Allowed 'General case' 0 N--CA 1.488 1.438 0 O-C-N 121.441 -0.787 . . . . 0.36 109.486 179.772 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 329' ' ' THR . . . . . 0.464 HG21 ' HA ' ' D' ' 331' ' ' GLN . 28.8 p -155.27 178.66 9.97 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.003 -1.061 . . . . 1.05 109.847 179.917 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 330' ' ' LEU . . . . . 0.452 ' O ' ' HA ' ' D' ' 329' ' ' THR . 62.9 tp -151.24 129.98 12.36 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.557 -0.714 . . . . 1.07 109.396 179.823 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 331' ' ' GLN . . . . . 0.444 ' HA ' HG21 ' D' ' 329' ' ' THR . 0.3 OUTLIER -88.45 110.81 21.14 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.126 -0.984 . . . . 0.91 109.557 -179.75 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' B' B ' 332' ' ' ILE . . . . . . . . . . . . . 50.7 mt -103.68 109.27 26.61 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.759 0 O-C-N 121.257 -0.902 . . . . 1.08 110.075 -179.516 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 333' ' ' ARG . . . . . 0.498 ' NH1' ' HG2' ' B' ' 333' ' ' ARG . 0.0 OUTLIER -72.1 142.72 49.17 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.086 -1.009 . . . . 3.42 109.349 179.798 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' B' B ' 334' ' ' GLY . . . . . . . . . . . . . . . 82.12 132.63 1.61 Allowed Glycine 0 N--CA 1.489 2.224 0 N-CA-C 109.814 -1.314 . . . . 0.4 109.814 179.68 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 335' ' ' ARG . . . . . . . . . . . . . 11.3 ttp180 -78.95 -26.71 43.55 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.488 -1.007 . . . . 3.55 109.437 179.77 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 336' ' ' GLU . . . . . . . . . . . . . 2.5 tt0 -58.04 -69.16 0.19 Allowed 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.191 -0.943 . . . . 2.28 109.578 179.864 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 337' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -59.86 -28.0 67.14 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.273 -0.892 . . . . 3.64 109.336 -179.898 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 338' ' ' PHE . . . . . . . . . . . . . 49.7 t80 -55.15 -59.58 4.57 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.214 -0.929 . . . . 0.39 109.534 179.775 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 339' ' ' GLU . . . . . . . . . . . . . 9.4 mt-10 -53.13 -33.08 50.78 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.199 -0.938 . . . . 1.98 109.748 -179.873 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 340' ' ' MET . . . . . . . . . . . . . 9.7 ttp -62.95 -51.33 67.33 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 120.955 -1.091 . . . . 1.14 109.808 -179.637 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 341' ' ' PHE . . . . . . . . . . . . . 48.7 m-85 -62.6 -48.78 77.94 Favored 'General case' 0 N--CA 1.488 1.465 0 O-C-N 121.171 -0.956 . . . . 0.22 109.968 -179.606 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 342' ' ' ARG . . . . . . . . . . . . . 70.7 ttt180 -48.62 -44.11 36.97 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.066 -1.021 . . . . 3.15 109.834 -179.791 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 343' ' ' GLU . . . . . . . . . . . . . 3.1 tt0 -58.05 -44.14 87.27 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.321 -0.862 . . . . 2.35 110.086 -179.309 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 344' ' ' LEU . . . . . 0.432 ' CD2' HD21 ' A' ' 344' ' ' LEU . 58.8 mt -63.85 -40.85 97.55 Favored 'General case' 0 N--CA 1.494 1.74 0 O-C-N 121.186 -0.946 . . . . 1.05 109.746 -179.982 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 345' ' ' ASN . . . . . 0.415 ' HA ' ' CZ ' ' D' ' 341' ' ' PHE . 48.6 t30 -57.02 -50.21 73.43 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.354 -0.841 . . . . 1.35 109.753 -179.852 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 346' ' ' GLU . . . . . . . . . . . . . 12.4 tt0 -61.58 -30.37 70.63 Favored 'General case' 0 N--CA 1.488 1.447 0 O-C-N 121.04 -1.038 . . . . 1.66 109.552 -179.876 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 347' ' ' ALA . . . . . . . . . . . . . . . -62.46 -48.85 77.8 Favored 'General case' 0 N--CA 1.493 1.692 0 O-C-N 121.2 -0.938 . . . . 1.02 110.038 -179.836 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 348' ' ' LEU . . . . . 0.504 ' N ' HD23 ' B' ' 348' ' ' LEU . 4.2 mm? -64.07 -50.87 66.65 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 120.996 -1.065 . . . . 1.05 109.584 -179.859 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 349' ' ' GLU . . . . . . . . . . . . . 29.3 mt-10 -56.5 -31.63 64.26 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.401 -0.812 . . . . 1.95 110.055 -179.321 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 350' ' ' LEU . . . . . 0.454 HD23 HD23 ' A' ' 350' ' ' LEU . 3.6 tt -63.88 -40.56 96.83 Favored 'General case' 0 N--CA 1.489 1.493 0 O-C-N 121.352 -0.842 . . . . 1.18 109.321 -179.934 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 351' ' ' LYS . . . . . . . . . . . . . 15.9 tttt -60.68 -41.99 96.19 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.199 -0.938 . . . . 1.96 109.452 179.949 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 352' ' ' ASP . . . . . . . . . . . . . 94.6 m-20 -56.0 -40.22 73.04 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.311 -0.868 . . . . 1.16 109.883 -179.723 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 353' ' ' ALA . . . . . . . . . . . . . . . -66.22 -40.34 90.22 Favored 'General case' 0 N--CA 1.494 1.74 0 O-C-N 121.073 -1.017 . . . . 1.21 109.572 -179.644 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 354' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 C--N 1.302 -1.471 0 O-C-N 121.323 -0.861 . . . . 1.69 109.817 -179.588 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' C' C ' 326' ' ' GLU . . . . . . . . . . . . . 69.0 mm-40 . . . . . 0 N--CA 1.491 1.613 0 N-CA-C 109.098 -0.705 . . . . 2.17 109.098 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' C' C ' 327' ' ' TYR . . . . . 0.504 ' CE1' ' HG2' ' A' ' 333' ' ' ARG . 47.9 m-85 -151.76 90.61 1.56 Allowed 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.005 -1.06 . . . . 1.03 109.961 -179.514 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' C' C ' 328' ' ' PHE . . . . . 0.489 ' O ' ' CG2' ' C' ' 329' ' ' THR . 37.4 m-85 -99.34 -159.57 0.75 Allowed 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.171 -0.955 . . . . 0.37 109.361 179.588 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' C' C ' 329' ' ' THR . . . . . 0.489 ' CG2' ' O ' ' C' ' 328' ' ' PHE . 75.7 p -157.55 -177.96 6.98 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.452 -0.78 . . . . 1.04 109.481 -179.948 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' C' C ' 330' ' ' LEU . . . . . 0.433 ' O ' ' HA ' ' A' ' 329' ' ' THR . 38.6 tp -154.45 127.61 8.37 Favored 'General case' 0 C--N 1.302 -1.492 0 O-C-N 121.32 -0.862 . . . . 1.09 109.798 -179.705 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' C' C ' 331' ' ' GLN . . . . . . . . . . . . . 37.5 tp60 -84.68 107.21 16.76 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.163 -0.961 . . . . 1.48 109.625 179.776 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' C' C ' 332' ' ' ILE . . . . . 0.432 HD12 ' CD2' ' C' ' 341' ' ' PHE . 61.1 mt -104.63 107.88 23.52 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.56 0 O-C-N 121.148 -0.97 . . . . 1.08 109.8 -179.831 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' C' C ' 333' ' ' ARG . . . . . 0.632 ' CG ' ' CE2' ' A' ' 327' ' ' TYR . 6.8 mpt_? -74.14 139.52 44.57 Favored 'General case' 0 N--CA 1.488 1.43 0 O-C-N 121.454 -0.779 . . . . 3.36 109.757 179.969 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' C' C ' 334' ' ' GLY . . . . . . . . . . . . . . . 87.92 129.98 3.21 Favored Glycine 0 N--CA 1.494 2.528 0 N-CA-C 109.985 -1.246 . . . . 0.35 109.985 179.506 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' C' C ' 335' ' ' ARG . . . . . 0.469 ' NH2' ' OE1' ' C' ' 339' ' ' GLU . 2.9 ttp180 -79.87 -28.76 39.91 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.522 -0.987 . . . . 3.23 110.002 -179.95 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' C' C ' 336' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -56.04 -72.7 0.07 Allowed 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.136 -0.977 . . . . 2.62 109.873 -179.388 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' C' C ' 337' ' ' ARG . . . . . . . . . . . . . 99.3 mtt180 -60.09 -27.47 67.03 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.355 -0.841 . . . . 3.61 109.566 179.942 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' C' C ' 338' ' ' PHE . . . . . . . . . . . . . 45.7 t80 -53.15 -61.34 2.36 Favored 'General case' 0 N--CA 1.487 1.39 0 O-C-N 121.19 -0.944 . . . . 0.43 109.249 179.942 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' C' C ' 339' ' ' GLU . . . . . 0.469 ' OE1' ' NH2' ' C' ' 335' ' ' ARG . 57.6 mt-10 -50.01 -30.74 11.22 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.406 -0.809 . . . . 2.05 109.823 -180.0 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' C' C ' 340' ' ' MET . . . . . . . . . . . . . 27.1 ttp -64.72 -51.04 64.52 Favored 'General case' 0 N--CA 1.496 1.833 0 O-C-N 121.361 -0.837 . . . . 1.1 109.995 -179.49 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' C' C ' 341' ' ' PHE . . . . . 0.432 ' CD2' HD12 ' C' ' 332' ' ' ILE . 49.7 m-85 -63.82 -49.58 72.3 Favored 'General case' 0 N--CA 1.494 1.732 0 O-C-N 121.229 -0.919 . . . . 0.21 109.888 -179.507 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' C' C ' 342' ' ' ARG . . . . . . . . . . . . . 16.3 ttp180 -48.3 -43.16 32.68 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.172 -0.955 . . . . 3.42 109.804 -179.916 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' C' C ' 343' ' ' GLU . . . . . . . . . . . . . 4.0 tt0 -59.4 -44.32 92.84 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.075 -1.016 . . . . 2.14 110.408 -179.361 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' C' C ' 344' ' ' LEU . . . . . . . . . . . . . 46.2 mt -64.19 -37.03 85.99 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 120.802 -1.186 . . . . 1.09 109.96 -179.604 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' C' C ' 345' ' ' ASN . . . . . . . . . . . . . 52.2 t-20 -56.68 -46.91 80.87 Favored 'General case' 0 C--N 1.301 -1.536 0 O-C-N 121.065 -1.022 . . . . 1.38 109.107 -179.825 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' C' C ' 346' ' ' GLU . . . . . . . . . . . . . 32.6 tt0 -62.11 -30.65 71.16 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.281 -0.887 . . . . 2.21 109.518 179.737 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' C' C ' 347' ' ' ALA . . . . . . . . . . . . . . . -61.66 -51.55 67.99 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.098 -1.001 . . . . 1.03 109.735 179.668 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' C' C ' 348' ' ' LEU . . . . . 0.447 ' N ' ' CD2' ' C' ' 348' ' ' LEU . 4.4 mm? -61.88 -53.22 58.82 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.162 -0.961 . . . . 1.06 110.471 -179.249 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' C' C ' 349' ' ' GLU . . . . . 0.414 ' O ' ' HB2' ' C' ' 352' ' ' ASP . 9.6 mt-10 -57.23 -32.47 66.57 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.097 -1.002 . . . . 2.19 109.21 -179.727 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' C' C ' 350' ' ' LEU . . . . . 0.53 ' CD2' ' CD1' ' D' ' 350' ' ' LEU . 5.1 tt -62.48 -42.51 99.54 Favored 'General case' 0 C--N 1.301 -1.506 0 N-CA-C 109.383 -0.599 . . . . 1.2 109.383 179.926 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' C' C ' 351' ' ' LYS . . . . . 0.413 ' N ' HD21 ' C' ' 350' ' ' LEU . 0.0 OUTLIER -58.6 -34.06 70.69 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.158 -0.964 . . . . 1.92 109.593 179.983 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' C' C ' 352' ' ' ASP . . . . . 0.414 ' HB2' ' O ' ' C' ' 349' ' ' GLU . 7.9 m-20 -55.62 -40.3 71.94 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.254 -0.904 . . . . 1.19 109.015 179.98 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' C' C ' 353' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.488 1.467 0 O-C-N 121.244 -0.91 . . . . 1.15 109.114 179.809 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' D' D ' 326' ' ' GLU . . . . . 0.405 ' O ' ' CD1' ' D' ' 327' ' ' TYR . 24.9 mm-40 . . . . . 0 N--CA 1.49 1.569 0 CA-C-O 121.167 0.508 . . . . 2.13 109.721 . . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' D' D ' 327' ' ' TYR . . . . . 0.476 ' CE2' ' HG2' ' B' ' 333' ' ' ARG . 42.5 m-85 -149.01 108.8 4.03 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.353 -0.842 . . . . 1.0 109.674 -179.988 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' D' D ' 328' ' ' PHE . . . . . 0.423 ' CD1' ' N ' ' D' ' 328' ' ' PHE . 4.3 m-85 -114.02 -167.51 1.22 Allowed 'General case' 0 N--CA 1.489 1.499 0 O-C-N 121.473 -0.767 . . . . 0.34 108.986 179.813 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' D' D ' 329' ' ' THR . . . . . 0.452 ' HA ' ' O ' ' B' ' 330' ' ' LEU . 27.0 p -154.71 176.7 12.11 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.017 -1.052 . . . . 1.05 109.701 179.953 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' D' D ' 330' ' ' LEU . . . . . 0.457 ' O ' ' HA ' ' B' ' 329' ' ' THR . 64.5 tp -149.81 129.32 13.05 Favored 'General case' 0 N--CA 1.489 1.488 0 O-C-N 121.057 -1.027 . . . . 1.07 109.508 -179.786 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' D' D ' 331' ' ' GLN . . . . . 0.464 ' HA ' HG21 ' B' ' 329' ' ' THR . 0.0 OUTLIER -87.79 111.01 20.91 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.395 -0.816 . . . . 0.93 109.695 -179.882 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' D' D ' 332' ' ' ILE . . . . . . . . . . . . . 57.8 mt -103.57 111.89 34.99 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.595 0 O-C-N 121.308 -0.87 . . . . 1.07 109.793 179.987 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' D' D ' 333' ' ' ARG . . . . . 0.494 ' HG2' ' CE2' ' B' ' 327' ' ' TYR . 0.0 OUTLIER -73.86 141.13 46.12 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.145 -0.972 . . . . 3.42 109.4 179.72 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' D' D ' 334' ' ' GLY . . . . . . . . . . . . . . . 83.29 132.27 1.94 Allowed Glycine 0 N--CA 1.493 2.473 0 N-CA-C 109.866 -1.294 . . . . 0.41 109.866 179.921 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' D' D ' 335' ' ' ARG . . . . . . . . . . . . . 11.7 ttp180 -78.32 -25.86 46.67 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.206 -1.173 . . . . 3.58 109.12 179.668 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' D' D ' 336' ' ' GLU . . . . . . . . . . . . . 2.8 tt0 -58.93 -67.96 0.32 Allowed 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.318 -0.864 . . . . 2.26 109.991 -179.692 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' D' D ' 337' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -61.97 -26.46 68.22 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 120.857 -1.152 . . . . 3.64 109.026 179.951 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' D' D ' 338' ' ' PHE . . . . . . . . . . . . . 47.7 t80 -54.67 -60.9 2.72 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.344 -0.847 . . . . 0.4 109.303 179.553 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' D' D ' 339' ' ' GLU . . . . . . . . . . . . . 8.4 mt-10 -52.02 -34.03 41.13 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.247 -0.908 . . . . 1.99 109.848 -179.754 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' D' D ' 340' ' ' MET . . . . . . . . . . . . . 8.9 ttp -62.02 -50.26 72.76 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.2 -0.937 . . . . 1.13 109.923 -179.735 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' D' D ' 341' ' ' PHE . . . . . 0.415 ' CZ ' ' HA ' ' B' ' 345' ' ' ASN . 52.2 m-85 -63.73 -48.9 75.17 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 120.797 -1.19 . . . . 0.21 110.209 -179.638 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' D' D ' 342' ' ' ARG . . . . . . . . . . . . . 71.3 ttt180 -48.66 -44.96 38.13 Favored 'General case' 0 C--N 1.302 -1.498 0 O-C-N 121.296 -0.878 . . . . 3.15 109.834 -179.358 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' D' D ' 343' ' ' GLU . . . . . . . . . . . . . 3.0 tt0 -56.49 -45.48 80.95 Favored 'General case' 0 N--CA 1.489 1.494 0 O-C-N 121.204 -0.935 . . . . 2.35 109.902 -179.489 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' D' D ' 344' ' ' LEU . . . . . 0.409 ' O ' HD21 ' D' ' 348' ' ' LEU . 47.4 mt -62.94 -40.51 97.86 Favored 'General case' 0 N--CA 1.494 1.757 0 O-C-N 121.147 -0.971 . . . . 1.06 110.088 -179.712 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' D' D ' 345' ' ' ASN . . . . . . . . . . . . . 55.5 t30 -56.86 -49.47 75.4 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.173 -0.954 . . . . 1.35 109.71 -179.605 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' D' D ' 346' ' ' GLU . . . . . . . . . . . . . 9.2 tt0 -61.9 -29.91 70.53 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.365 -0.834 . . . . 1.69 109.747 -179.929 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' D' D ' 347' ' ' ALA . . . . . . . . . . . . . . . -62.52 -49.47 75.19 Favored 'General case' 0 N--CA 1.494 1.739 0 O-C-N 121.112 -0.993 . . . . 1.03 109.977 -179.984 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' D' D ' 348' ' ' LEU . . . . . 0.519 ' N ' HD23 ' D' ' 348' ' ' LEU . 4.2 mm? -63.23 -52.61 61.51 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.154 -0.966 . . . . 1.04 109.524 -179.683 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' D' D ' 349' ' ' GLU . . . . . . . . . . . . . 25.1 mt-10 -55.36 -31.18 61.54 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.494 -0.754 . . . . 1.95 109.948 -179.683 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' D' D ' 350' ' ' LEU . . . . . 0.53 ' CD1' ' CD2' ' C' ' 350' ' ' LEU . 4.4 tt -64.6 -41.3 96.31 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.316 -0.865 . . . . 1.16 109.106 179.982 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' D' D ' 351' ' ' LYS . . . . . . . . . . . . . 17.8 tttt -59.04 -44.01 91.72 Favored 'General case' 0 N--CA 1.489 1.497 0 O-C-N 121.278 -0.889 . . . . 1.97 109.648 -179.973 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' D' D ' 352' ' ' ASP . . . . . . . . . . . . . 86.6 m-20 -55.1 -40.32 70.32 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.421 -0.799 . . . . 1.17 110.125 -179.404 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' D' D ' 353' ' ' ALA . . . . . . . . . . . . . . . -66.19 -38.39 87.9 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.239 -0.913 . . . . 1.21 109.741 -179.658 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' D' D ' 354' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--N 1.302 -1.484 0 O-C-N 121.238 -0.914 . . . . 1.68 109.873 -179.541 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 326' ' ' GLU . . . . . . . . . . . . . 4.3 mm-40 . . . . . 0 N--CA 1.491 1.595 0 CA-C-O 121.283 0.563 . . . . 2.13 109.499 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 327' ' ' TYR . . . . . 0.579 ' CE2' ' HG2' ' C' ' 333' ' ' ARG . 43.4 m-85 -149.52 106.11 3.53 Favored 'General case' 0 N--CA 1.488 1.444 0 O-C-N 121.289 -0.882 . . . . 1.0 109.56 179.837 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 328' ' ' PHE . . . . . 0.442 ' O ' ' NE2' ' C' ' 331' ' ' GLN . 22.6 m-85 -111.98 -167.57 1.2 Allowed 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.388 -0.82 . . . . 0.34 108.938 179.717 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 329' ' ' THR . . . . . 0.412 ' HA ' ' O ' ' C' ' 330' ' ' LEU . 77.7 p -153.59 -179.73 8.05 Favored 'General case' 0 C--N 1.303 -1.441 0 O-C-N 121.152 -0.968 . . . . 1.05 109.374 179.883 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 330' ' ' LEU . . . . . 0.42 ' O ' ' HA ' ' C' ' 329' ' ' THR . 52.1 tp -152.73 131.96 12.76 Favored 'General case' 0 N--CA 1.488 1.469 0 O-C-N 121.18 -0.95 . . . . 1.07 109.564 -179.892 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 331' ' ' GLN . . . . . . . . . . . . . 44.6 tp60 -87.99 106.64 18.27 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.359 -0.838 . . . . 0.91 109.5 179.933 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 332' ' ' ILE . . . . . 0.443 HG23 ' HA ' ' A' ' 338' ' ' PHE . 31.9 mt -103.49 103.1 14.63 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.541 0 O-C-N 121.129 -0.982 . . . . 1.09 109.534 179.926 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 333' ' ' ARG . . . . . 0.538 ' NH1' ' HG2' ' A' ' 333' ' ' ARG . 0.0 OUTLIER -72.46 151.49 42.51 Favored 'General case' 0 N--CA 1.488 1.464 0 O-C-N 121.265 -0.897 . . . . 3.41 109.445 179.861 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 334' ' ' GLY . . . . . . . . . . . . . . . 86.47 128.99 2.45 Favored Glycine 0 N--CA 1.491 2.315 0 N-CA-C 109.593 -1.403 . . . . 0.4 109.593 -179.984 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 335' ' ' ARG . . . . . 0.45 ' HA ' ' CE2' ' C' ' 328' ' ' PHE . 3.5 ttm180 -79.66 -39.09 32.2 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.278 -1.131 . . . . 3.55 109.586 179.988 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 336' ' ' GLU . . . . . . . . . . . . . 2.2 mt-10 -58.05 -61.42 2.56 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.225 -0.922 . . . . 2.29 109.7 -179.916 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 337' ' ' ARG . . . . . 0.457 ' NH1' ' CG ' ' A' ' 337' ' ' ARG . 0.0 OUTLIER -59.75 -29.33 68.08 Favored 'General case' 0 N--CA 1.489 1.494 0 O-C-N 121.168 -0.957 . . . . 3.64 109.528 -179.842 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 338' ' ' PHE . . . . . 0.443 ' HA ' HG23 ' A' ' 332' ' ' ILE . 48.3 t80 -55.69 -56.03 25.17 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.145 -0.972 . . . . 0.41 109.465 179.993 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 339' ' ' GLU . . . . . . . . . . . . . 24.0 mt-10 -50.24 -33.27 19.05 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.195 -0.941 . . . . 1.97 110.045 -179.647 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 340' ' ' MET . . . . . . . . . . . . . 32.1 ttp -63.19 -51.0 68.13 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.158 -0.963 . . . . 1.14 109.878 -179.713 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 341' ' ' PHE . . . . . . . . . . . . . 38.9 m-85 -62.67 -52.02 64.93 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.177 -0.952 . . . . 0.21 109.704 -179.741 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 342' ' ' ARG . . . . . . . . . . . . . 9.7 ttm180 -47.63 -36.65 11.21 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.188 -0.945 . . . . 3.15 109.438 -179.948 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 343' ' ' GLU . . . . . . . . . . . . . 32.2 tt0 -59.18 -49.61 77.18 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.219 -0.926 . . . . 2.35 109.433 -179.92 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 344' ' ' LEU . . . . . 0.429 ' O ' HD21 ' A' ' 348' ' ' LEU . 57.5 mt -62.42 -32.31 73.14 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.223 -0.923 . . . . 1.06 109.437 179.984 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 345' ' ' ASN . . . . . . . . . . . . . 9.6 t-20 -56.81 -54.93 40.77 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.302 -0.874 . . . . 1.36 109.618 -179.886 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 346' ' ' GLU . . . . . . . . . . . . . 43.8 tp10 -61.35 -31.66 71.54 Favored 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.274 -0.891 . . . . 1.65 109.813 -179.797 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 347' ' ' ALA . . . . . . . . . . . . . . . -59.91 -57.86 11.04 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.204 -0.935 . . . . 1.03 109.988 -179.73 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 348' ' ' LEU . . . . . 0.484 ' N ' ' CD2' ' A' ' 348' ' ' LEU . 4.2 mm? -61.59 -41.91 98.11 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.206 -0.934 . . . . 1.04 109.81 -179.584 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 349' ' ' GLU . . . . . . . . . . . . . 98.5 mt-10 -58.08 -34.93 70.69 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.264 -0.898 . . . . 1.94 110.007 -179.53 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 350' ' ' LEU . . . . . 0.539 HD21 ' CD1' ' B' ' 350' ' ' LEU . 5.7 tt -63.54 -46.46 85.89 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.111 -0.993 . . . . 1.17 109.523 -179.819 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 351' ' ' LYS . . . . . . . . . . . . . 42.4 tttt -59.38 -38.0 79.37 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.274 -0.891 . . . . 1.97 109.443 -179.978 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 352' ' ' ASP . . . . . . . . . . . . . 23.0 m-20 -55.71 -36.14 66.86 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.199 -0.938 . . . . 1.16 109.671 -179.995 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 353' ' ' ALA . . . . . . . . . . . . . . . -66.88 -35.75 80.74 Favored 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.235 -0.916 . . . . 1.22 109.76 -179.745 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 354' ' ' GLN . . . . . . . . . . . . . 5.9 mt-30 . . . . . 0 N--CA 1.49 1.556 0 O-C-N 121.215 -0.928 . . . . 1.71 109.657 -179.92 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' B' B ' 326' ' ' GLU . . . . . . . . . . . . . 4.3 mm-40 . . . . . 0 N--CA 1.49 1.568 0 N-CA-C 109.43 -0.582 . . . . 2.13 109.43 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' B' B ' 327' ' ' TYR . . . . . 0.499 ' CE2' ' HG2' ' D' ' 333' ' ' ARG . 43.1 m-85 -149.59 106.1 3.52 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.365 -0.835 . . . . 0.99 109.46 179.823 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 328' ' ' PHE . . . . . 0.482 ' CE1' ' HA ' ' D' ' 335' ' ' ARG . 22.5 m-85 -111.97 -167.74 1.22 Allowed 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.236 -0.915 . . . . 0.36 108.974 179.653 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 329' ' ' THR . . . . . . . . . . . . . 75.7 p -153.38 -179.55 7.85 Favored 'General case' 0 N--CA 1.488 1.453 0 O-C-N 121.195 -0.941 . . . . 1.05 109.331 179.899 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 330' ' ' LEU . . . . . . . . . . . . . 52.2 tp -152.93 131.87 12.53 Favored 'General case' 0 N--CA 1.489 1.484 0 O-C-N 121.274 -0.891 . . . . 1.07 109.484 -179.867 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 331' ' ' GLN . . . . . . . . . . . . . 44.6 tp60 -88.09 106.41 18.14 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.284 -0.885 . . . . 0.91 109.505 179.967 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 332' ' ' ILE . . . . . 0.439 HG23 ' HA ' ' B' ' 338' ' ' PHE . 31.5 mt -103.28 103.26 14.84 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.601 0 O-C-N 121.198 -0.939 . . . . 1.08 109.609 179.86 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 333' ' ' ARG . . . . . 0.547 ' HG2' ' CE2' ' D' ' 327' ' ' TYR . 0.0 OUTLIER -72.55 151.39 42.45 Favored 'General case' 0 N--CA 1.489 1.5 0 O-C-N 121.278 -0.889 . . . . 3.42 109.465 179.835 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' B' B ' 334' ' ' GLY . . . . . . . . . . . . . . . 86.6 128.96 2.48 Favored Glycine 0 N--CA 1.49 2.254 0 N-CA-C 109.556 -1.418 . . . . 0.4 109.556 -179.977 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 335' ' ' ARG . . . . . 0.44 ' O ' ' HB3' ' B' ' 338' ' ' PHE . 3.4 ttm180 -79.58 -39.29 32.06 Favored 'General case' 0 N--CA 1.489 1.495 0 O-C-N 121.3 -1.117 . . . . 3.55 109.506 -179.994 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 336' ' ' GLU . . . . . . . . . . . . . 2.2 mt-10 -57.89 -61.36 2.59 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.221 -0.924 . . . . 2.28 109.77 -179.921 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 337' ' ' ARG . . . . . 0.455 ' NH1' ' CG ' ' B' ' 337' ' ' ARG . 0.0 OUTLIER -59.82 -29.35 68.19 Favored 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.226 -0.921 . . . . 3.64 109.502 -179.871 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' B' B ' 338' ' ' PHE . . . . . 0.44 ' HB3' ' O ' ' B' ' 335' ' ' ARG . 48.0 t80 -55.54 -56.12 23.96 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.184 -0.948 . . . . 0.39 109.469 179.943 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 339' ' ' GLU . . . . . . . . . . . . . 23.9 mt-10 -50.36 -33.17 19.49 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.27 -0.894 . . . . 1.98 109.99 -179.657 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 340' ' ' MET . . . . . . . . . . . . . 32.3 ttp -63.39 -50.85 68.24 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.052 -1.03 . . . . 1.14 109.812 -179.73 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 341' ' ' PHE . . . . . . . . . . . . . 39.3 m-85 -62.74 -51.8 65.75 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.19 -0.944 . . . . 0.22 109.819 -179.812 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 342' ' ' ARG . . . . . . . . . . . . . 9.7 ttm180 -47.78 -36.83 12.26 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.245 -0.91 . . . . 3.15 109.522 -179.988 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 343' ' ' GLU . . . . . . . . . . . . . 32.5 tt0 -58.88 -49.72 76.72 Favored 'General case' 0 N--CA 1.489 1.486 0 O-C-N 121.214 -0.929 . . . . 2.35 109.47 179.957 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 344' ' ' LEU . . . . . 0.43 ' O ' HD21 ' B' ' 348' ' ' LEU . 56.8 mt -62.39 -32.34 73.14 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.174 -0.954 . . . . 1.05 109.466 179.947 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 345' ' ' ASN . . . . . . . . . . . . . 9.6 t-20 -56.81 -54.88 41.26 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.352 -0.842 . . . . 1.35 109.678 -179.87 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 346' ' ' GLU . . . . . . . . . . . . . 43.8 tp10 -61.37 -31.66 71.56 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.237 -0.914 . . . . 1.66 109.787 -179.849 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 347' ' ' ALA . . . . . . . . . . . . . . . -59.93 -57.8 11.29 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.235 -0.916 . . . . 1.02 109.974 -179.663 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 348' ' ' LEU . . . . . 0.474 ' CD2' ' N ' ' B' ' 348' ' ' LEU . 4.2 mm? -61.6 -41.91 98.11 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.198 -0.939 . . . . 1.05 109.828 -179.558 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 349' ' ' GLU . . . . . . . . . . . . . 98.5 mt-10 -57.97 -35.18 70.81 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.246 -0.909 . . . . 1.95 109.946 -179.492 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 350' ' ' LEU . . . . . 0.539 ' CD1' HD21 ' A' ' 350' ' ' LEU . 5.7 tt -63.33 -46.59 85.92 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.157 -0.964 . . . . 1.18 109.576 -179.836 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 351' ' ' LYS . . . . . . . . . . . . . 42.4 tttt -59.37 -37.86 78.98 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.294 -0.879 . . . . 1.96 109.398 -179.899 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 352' ' ' ASP . . . . . . . . . . . . . 22.8 m-20 -55.72 -36.17 66.93 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.349 -0.844 . . . . 1.16 109.717 179.992 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 353' ' ' ALA . . . . . . . . . . . . . . . -66.91 -35.75 80.7 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.217 -0.927 . . . . 1.21 109.838 -179.752 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 354' ' ' GLN . . . . . . . . . . . . . 5.9 mt-30 . . . . . 0 N--CA 1.491 1.597 0 O-C-N 121.115 -0.991 . . . . 1.69 109.543 -179.892 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' C' C ' 326' ' ' GLU . . . . . 0.522 ' O ' ' CD1' ' C' ' 327' ' ' TYR . 5.2 mt-10 . . . . . 0 N--CA 1.49 1.542 0 N-CA-C 109.428 -0.582 . . . . 2.17 109.428 . . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' C' C ' 327' ' ' TYR . . . . . 0.522 ' CD1' ' O ' ' C' ' 326' ' ' GLU . 40.3 m-85 -149.77 109.11 3.96 Favored 'General case' 0 N--CA 1.489 1.494 0 O-C-N 121.149 -0.97 . . . . 1.03 109.723 -179.973 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' C' C ' 328' ' ' PHE . . . . . 0.45 ' CE2' ' HA ' ' A' ' 335' ' ' ARG . 83.7 m-85 -113.89 -167.04 1.15 Allowed 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.401 -0.812 . . . . 0.37 109.137 179.81 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' C' C ' 329' ' ' THR . . . . . 0.432 HG21 ' O ' ' C' ' 328' ' ' PHE . 22.4 p -153.73 179.19 9.08 Favored 'General case' 0 N--CA 1.489 1.487 0 O-C-N 121.124 -0.985 . . . . 1.04 109.494 179.988 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' C' C ' 330' ' ' LEU . . . . . 0.412 ' O ' ' HA ' ' A' ' 329' ' ' THR . 54.1 tp -152.99 131.61 12.27 Favored 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.243 -0.911 . . . . 1.09 109.761 -179.802 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' C' C ' 331' ' ' GLN . . . . . 0.442 ' NE2' ' O ' ' A' ' 328' ' ' PHE . 0.0 OUTLIER -88.52 102.35 14.83 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.268 -0.895 . . . . 1.48 108.838 179.818 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' C' C ' 332' ' ' ILE . . . . . . . . . . . . . 53.6 mt -104.01 112.04 36.01 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.704 0 O-C-N 121.118 -0.988 . . . . 1.08 110.204 -179.606 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' C' C ' 333' ' ' ARG . . . . . 0.579 ' HG2' ' CE2' ' A' ' 327' ' ' TYR . 1.4 mpp_? -75.18 163.94 27.01 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.294 -0.879 . . . . 3.36 109.656 179.407 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' C' C ' 334' ' ' GLY . . . . . . . . . . . . . . . 72.55 130.3 0.12 Allowed Glycine 0 N--CA 1.493 2.476 0 N-CA-C 110.344 -1.102 . . . . 0.35 110.344 179.172 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' C' C ' 335' ' ' ARG . . . . . 0.472 ' O ' ' HB3' ' C' ' 338' ' ' PHE . 3.9 ttp180 -80.67 -37.98 29.88 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.401 -1.058 . . . . 3.23 109.414 179.684 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' C' C ' 336' ' ' GLU . . . . . . . . . . . . . 4.0 mt-10 -58.36 -60.98 2.94 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.218 -0.927 . . . . 2.62 109.676 -179.738 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' C' C ' 337' ' ' ARG . . . . . 0.434 ' NH1' ' CG ' ' C' ' 337' ' ' ARG . 0.0 OUTLIER -59.47 -29.24 67.68 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.208 -0.932 . . . . 3.61 109.463 -179.789 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' C' C ' 338' ' ' PHE . . . . . 0.472 ' HB3' ' O ' ' C' ' 335' ' ' ARG . 47.6 t80 -54.87 -55.55 29.2 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.228 -0.92 . . . . 0.43 109.245 179.825 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' C' C ' 339' ' ' GLU . . . . . . . . . . . . . 85.4 mt-10 -50.84 -29.17 11.08 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.297 -0.877 . . . . 2.05 109.672 -179.985 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' C' C ' 340' ' ' MET . . . . . . . . . . . . . 14.9 ttp -63.4 -53.83 46.29 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.132 -0.98 . . . . 1.1 109.64 -179.766 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' C' C ' 341' ' ' PHE . . . . . . . . . . . . . 38.8 m-85 -62.76 -46.1 89.61 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.211 -0.931 . . . . 0.21 109.729 -179.783 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' C' C ' 342' ' ' ARG . . . . . 0.441 ' CG ' ' NH1' ' C' ' 342' ' ' ARG . 0.0 OUTLIER -49.72 -42.45 46.01 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.215 -0.928 . . . . 3.42 109.621 -179.89 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' C' C ' 343' ' ' GLU . . . . . . . . . . . . . 23.1 tt0 -57.89 -47.26 83.32 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.134 -0.978 . . . . 2.14 109.298 -179.966 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' C' C ' 344' ' ' LEU . . . . . 0.474 HD21 ' CD2' ' D' ' 344' ' ' LEU . 76.3 mt -62.61 -29.07 70.33 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.211 -0.93 . . . . 1.09 109.232 179.704 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' C' C ' 345' ' ' ASN . . . . . . . . . . . . . 13.1 t-20 -58.84 -58.33 9.1 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.491 -0.756 . . . . 1.38 109.837 179.998 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' C' C ' 346' ' ' GLU . . . . . . . . . . . . . 6.6 tm-20 -60.8 -25.86 66.87 Favored 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.322 -0.861 . . . . 2.21 109.785 -179.644 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' C' C ' 347' ' ' ALA . . . . . . . . . . . . . . . -63.84 -58.2 7.53 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.137 -0.977 . . . . 1.03 110.028 -179.945 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' C' C ' 348' ' ' LEU . . . . . 0.46 HD21 ' O ' ' C' ' 344' ' ' LEU . 3.9 mm? -62.6 -49.61 74.54 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.202 -0.936 . . . . 1.06 110.582 -179.355 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' C' C ' 349' ' ' GLU . . . . . . . . . . . . . 54.3 mt-10 -56.97 -39.05 73.88 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.187 -0.946 . . . . 2.19 110.301 -179.096 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' C' C ' 350' ' ' LEU . . . . . 0.528 ' CD2' ' CD1' ' D' ' 350' ' ' LEU . 7.1 tt -64.57 -30.42 71.44 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.046 -1.033 . . . . 1.2 109.653 -179.761 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' C' C ' 351' ' ' LYS . . . . . . . . . . . . . 10.2 tttt -59.34 -48.88 79.94 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.308 -0.87 . . . . 1.92 109.414 -179.854 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' C' C ' 352' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -60.03 -47.06 87.41 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.331 -0.856 . . . . 1.19 109.588 179.867 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' C' C ' 353' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 1.597 0 O-C-N 121.224 -0.922 . . . . 1.15 109.461 -179.787 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' D' D ' 326' ' ' GLU . . . . . 0.401 ' O ' ' CD1' ' D' ' 327' ' ' TYR . 4.3 mm-40 . . . . . 0 N--CA 1.49 1.54 0 N-CA-C 109.451 -0.574 . . . . 2.13 109.451 . . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' D' D ' 327' ' ' TYR . . . . . 0.547 ' CE2' ' HG2' ' B' ' 333' ' ' ARG . 43.7 m-85 -149.61 106.04 3.51 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.268 -0.895 . . . . 1.0 109.534 179.824 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' D' D ' 328' ' ' PHE . . . . . 0.433 ' CE1' ' HA ' ' B' ' 335' ' ' ARG . 23.4 m-85 -111.87 -167.5 1.19 Allowed 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.339 -0.85 . . . . 0.34 109.007 179.683 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' D' D ' 329' ' ' THR . . . . . . . . . . . . . 75.5 p -153.59 -179.76 8.08 Favored 'General case' 0 N--CA 1.488 1.452 0 O-C-N 121.158 -0.964 . . . . 1.05 109.424 179.925 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' D' D ' 330' ' ' LEU . . . . . . . . . . . . . 52.2 tp -152.75 131.91 12.71 Favored 'General case' 0 N--CA 1.488 1.467 0 O-C-N 121.205 -0.934 . . . . 1.07 109.532 -179.877 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' D' D ' 331' ' ' GLN . . . . . . . . . . . . . 44.6 tp60 -88.13 106.55 18.25 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.274 -0.891 . . . . 0.93 109.521 179.922 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' D' D ' 332' ' ' ILE . . . . . 0.437 HG23 ' HA ' ' D' ' 338' ' ' PHE . 31.9 mt -103.41 103.37 15.04 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.545 0 O-C-N 121.168 -0.957 . . . . 1.07 109.519 179.919 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' D' D ' 333' ' ' ARG . . . . . 0.555 ' HG2' ' NH1' ' D' ' 333' ' ' ARG . 0.0 OUTLIER -72.66 151.45 42.25 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.249 -0.907 . . . . 3.42 109.398 179.861 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' D' D ' 334' ' ' GLY . . . . . . . . . . . . . . . 86.56 128.87 2.46 Favored Glycine 0 N--CA 1.49 2.235 0 N-CA-C 109.595 -1.402 . . . . 0.41 109.595 -179.978 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' D' D ' 335' ' ' ARG . . . . . 0.482 ' HA ' ' CE1' ' B' ' 328' ' ' PHE . 3.4 ttm180 -79.54 -39.18 32.51 Favored 'General case' 0 N--CA 1.489 1.487 0 O-C-N 121.202 -1.175 . . . . 3.58 109.524 -179.975 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' D' D ' 336' ' ' GLU . . . . . . . . . . . . . 2.2 mt-10 -57.98 -61.4 2.57 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.252 -0.905 . . . . 2.26 109.731 -179.89 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' D' D ' 337' ' ' ARG . . . . . 0.44 HH11 ' CG ' ' D' ' 337' ' ' ARG . 0.0 OUTLIER -59.85 -29.35 68.23 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.18 -0.95 . . . . 3.64 109.504 -179.84 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' D' D ' 338' ' ' PHE . . . . . 0.437 ' HA ' HG23 ' D' ' 332' ' ' ILE . 48.2 t80 -55.53 -56.2 23.04 Favored 'General case' 0 N--CA 1.488 1.474 0 O-C-N 121.219 -0.926 . . . . 0.4 109.483 179.886 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' D' D ' 339' ' ' GLU . . . . . . . . . . . . . 24.1 mt-10 -50.09 -33.49 18.76 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.23 -0.919 . . . . 1.99 110.03 -179.716 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' D' D ' 340' ' ' MET . . . . . . . . . . . . . 32.2 ttp -63.13 -51.11 67.78 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.2 -0.938 . . . . 1.13 109.814 -179.674 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' D' D ' 341' ' ' PHE . . . . . . . . . . . . . 39.3 m-85 -62.46 -51.99 65.28 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.146 -0.971 . . . . 0.21 109.757 -179.741 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' D' D ' 342' ' ' ARG . . . . . . . . . . . . . 9.7 ttm180 -47.69 -36.76 11.69 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.156 -0.965 . . . . 3.15 109.483 -179.926 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' D' D ' 343' ' ' GLU . . . . . . . . . . . . . 32.7 tt0 -58.91 -49.64 77.03 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.278 -0.889 . . . . 2.35 109.504 179.935 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' D' D ' 344' ' ' LEU . . . . . 0.474 ' CD2' HD21 ' C' ' 344' ' ' LEU . 57.5 mt -62.47 -32.37 73.25 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.177 -0.952 . . . . 1.06 109.453 -179.996 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' D' D ' 345' ' ' ASN . . . . . . . . . . . . . 9.6 t-20 -56.77 -54.93 40.6 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.266 -0.896 . . . . 1.35 109.63 -179.858 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' D' D ' 346' ' ' GLU . . . . . . . . . . . . . 44.0 tp10 -61.4 -31.61 71.53 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.258 -0.902 . . . . 1.69 109.755 -179.746 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' D' D ' 347' ' ' ALA . . . . . . . . . . . . . . . -59.93 -57.82 11.21 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.236 -0.915 . . . . 1.03 109.988 -179.709 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' D' D ' 348' ' ' LEU . . . . . 0.478 ' CD2' ' N ' ' D' ' 348' ' ' LEU . 4.2 mm? -61.53 -42.0 98.18 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.219 -0.926 . . . . 1.04 109.885 -179.664 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' D' D ' 349' ' ' GLU . . . . . . . . . . . . . 98.5 mt-10 -57.9 -35.12 70.59 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.245 -0.91 . . . . 1.95 109.943 -179.541 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' D' D ' 350' ' ' LEU . . . . . 0.528 ' CD1' ' CD2' ' C' ' 350' ' ' LEU . 5.7 tt -63.39 -46.37 86.73 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.125 -0.985 . . . . 1.16 109.603 -179.814 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' D' D ' 351' ' ' LYS . . . . . . . . . . . . . 42.4 tttt -59.48 -37.87 79.36 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.253 -0.904 . . . . 1.97 109.475 -179.996 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' D' D ' 352' ' ' ASP . . . . . . . . . . . . . 22.9 m-20 -55.76 -36.15 66.99 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.258 -0.901 . . . . 1.17 109.635 179.975 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' D' D ' 353' ' ' ALA . . . . . . . . . . . . . . . -66.95 -35.83 80.85 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.239 -0.913 . . . . 1.21 109.738 -179.739 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' D' D ' 354' ' ' GLN . . . . . . . . . . . . . 5.8 mt-30 . . . . . 0 N--CA 1.49 1.541 0 O-C-N 121.229 -0.919 . . . . 1.68 109.595 -179.829 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 326' ' ' GLU . . . . . . . . . . . . . 20.8 mt-10 . . . . . 0 N--CA 1.49 1.572 0 N-CA-C 109.354 -0.61 . . . . 2.13 109.354 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 327' ' ' TYR . . . . . 0.574 ' CE1' ' HG2' ' C' ' 333' ' ' ARG . 48.0 m-85 -148.54 111.36 4.81 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.303 -0.873 . . . . 1.0 109.338 179.978 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 328' ' ' PHE . . . . . . . . . . . . . 94.5 m-85 -113.3 -169.88 1.58 Allowed 'General case' 0 N--CA 1.488 1.467 0 O-C-N 121.114 -0.991 . . . . 0.34 109.466 -179.706 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 329' ' ' THR . . . . . 0.491 ' HA ' ' O ' ' C' ' 330' ' ' LEU . 29.4 p -152.16 166.31 32.1 Favored 'General case' 0 C--N 1.303 -1.424 0 O-C-N 121.298 -0.876 . . . . 1.05 109.022 179.879 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 330' ' ' LEU . . . . . . . . . . . . . 49.2 tp -149.71 128.32 12.35 Favored 'General case' 0 C--N 1.303 -1.444 0 O-C-N 121.107 -0.996 . . . . 1.07 109.972 -179.396 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 331' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -86.74 109.92 19.55 Favored 'General case' 0 N--CA 1.488 1.471 0 O-C-N 121.321 -0.862 . . . . 0.91 109.184 179.681 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 332' ' ' ILE . . . . . . . . . . . . . 10.6 mt -103.65 108.44 24.54 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.536 0 O-C-N 121.203 -0.936 . . . . 1.09 109.766 -179.716 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 333' ' ' ARG . . . . . 0.521 ' NH1' ' HG3' ' A' ' 333' ' ' ARG . 37.8 mtm-85 -71.95 151.86 42.95 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.192 -0.942 . . . . 3.41 109.337 179.804 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 334' ' ' GLY . . . . . . . . . . . . . . . 79.8 129.85 0.77 Allowed Glycine 0 N--CA 1.491 2.335 0 N-CA-C 109.703 -1.359 . . . . 0.4 109.703 179.746 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 335' ' ' ARG . . . . . . . . . . . . . 9.6 ttm180 -79.92 -37.47 34.54 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.275 -1.132 . . . . 3.55 109.579 179.919 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 336' ' ' GLU . . . . . . . . . . . . . 4.2 mm-40 -57.15 -63.48 1.2 Allowed 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.325 -0.859 . . . . 2.29 109.807 -179.744 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 337' ' ' ARG . . . . . 0.408 HH11 ' HG2' ' A' ' 337' ' ' ARG . 5.0 mmt-85 -60.39 -30.44 69.59 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.266 -0.896 . . . . 3.64 109.788 -179.737 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 338' ' ' PHE . . . . . . . . . . . . . 25.8 t80 -55.26 -56.89 14.82 Favored 'General case' 0 N--CA 1.489 1.487 0 O-C-N 121.063 -1.023 . . . . 0.41 109.122 179.716 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 339' ' ' GLU . . . . . . . . . . . . . 32.1 mt-10 -51.32 -30.6 18.82 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.428 -0.795 . . . . 1.97 109.574 -179.755 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 340' ' ' MET . . . . . . . . . . . . . 41.5 ttp -63.66 -50.57 68.74 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.286 -0.884 . . . . 1.14 109.593 -179.834 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 341' ' ' PHE . . . . . 0.407 ' CZ ' ' HA ' ' C' ' 345' ' ' ASN . 75.7 m-85 -62.74 -46.49 87.81 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.205 -0.934 . . . . 0.21 109.718 -179.873 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 342' ' ' ARG . . . . . 0.433 HH11 ' HG3' ' A' ' 342' ' ' ARG . 0.3 OUTLIER -49.03 -42.69 39.11 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.257 -0.902 . . . . 3.15 109.987 -179.578 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 343' ' ' GLU . . . . . . . . . . . . . 25.1 tt0 -59.82 -44.62 93.94 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.38 -0.825 . . . . 2.35 109.846 -179.72 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 344' ' ' LEU . . . . . 0.412 ' O ' HD21 ' A' ' 348' ' ' LEU . 41.1 mt -62.49 -36.01 81.17 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.1 -1.0 . . . . 1.06 109.933 -179.661 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 345' ' ' ASN . . . . . . . . . . . . . 63.8 t-20 -57.41 -54.66 44.34 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.298 -0.876 . . . . 1.36 109.906 -179.626 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 346' ' ' GLU . . . . . . . . . . . . . 83.5 tt0 -60.92 -30.33 70.13 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.139 -0.976 . . . . 1.65 109.946 -179.59 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 347' ' ' ALA . . . . . . . . . . . . . . . -60.58 -56.34 22.5 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.176 -0.953 . . . . 1.03 110.014 -179.616 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 348' ' ' LEU . . . . . 0.462 ' N ' HD23 ' A' ' 348' ' ' LEU . 3.9 mm? -61.33 -48.93 79.08 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.16 -0.962 . . . . 1.04 110.073 -179.398 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 349' ' ' GLU . . . . . . . . . . . . . 80.6 mm-40 -57.13 -30.27 64.26 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.24 -0.912 . . . . 1.94 110.127 -179.453 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 350' ' ' LEU . . . . . 0.471 HD23 HD23 ' B' ' 350' ' ' LEU . 4.2 tt -64.28 -48.0 77.38 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.127 -0.983 . . . . 1.17 109.419 -179.984 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 351' ' ' LYS . . . . . . . . . . . . . 68.0 tttt -59.17 -48.83 80.15 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.277 -0.889 . . . . 1.97 109.538 -179.964 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 352' ' ' ASP . . . . . . . . . . . . . 3.4 m-20 -54.82 -29.36 54.62 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.251 -0.905 . . . . 1.16 109.478 -179.995 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 353' ' ' ALA . . . . . . . . . . . . . . . -67.2 -37.98 84.56 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.276 -0.89 . . . . 1.22 109.512 179.945 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 354' ' ' GLN . . . . . . . . . . . . . 26.0 mt-30 . . . . . 0 N--CA 1.488 1.461 0 O-C-N 121.252 -0.905 . . . . 1.71 109.475 -179.999 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' B' B ' 326' ' ' GLU . . . . . . . . . . . . . 20.0 mt-10 . . . . . 0 N--CA 1.488 1.475 0 CA-C-O 121.354 0.597 . . . . 2.13 109.449 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' B' B ' 327' ' ' TYR . . . . . 0.474 ' CE1' ' HG2' ' D' ' 333' ' ' ARG . 48.7 m-85 -148.86 112.04 4.93 Favored 'General case' 0 N--CA 1.488 1.454 0 O-C-N 121.286 -0.884 . . . . 0.99 109.322 179.891 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 328' ' ' PHE . . . . . 0.414 ' CE1' ' HB2' ' D' ' 335' ' ' ARG . 94.0 m-85 -113.5 -169.45 1.5 Allowed 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.246 -0.908 . . . . 0.36 109.514 -179.865 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 329' ' ' THR . . . . . . . . . . . . . 29.6 p -152.64 166.46 32.04 Favored 'General case' 0 N--CA 1.487 1.42 0 O-C-N 121.274 -0.891 . . . . 1.05 109.055 179.771 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 330' ' ' LEU . . . . . 0.402 ' O ' ' HA ' ' D' ' 329' ' ' THR . 49.3 tp -149.87 128.85 12.61 Favored 'General case' 0 C--N 1.302 -1.473 0 O-C-N 121.033 -1.042 . . . . 1.07 109.812 -179.46 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 331' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -87.3 109.69 19.69 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.398 -0.813 . . . . 0.91 109.184 179.773 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 332' ' ' ILE . . . . . . . . . . . . . 10.3 mt -103.61 108.67 25.03 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.499 0 O-C-N 121.16 -0.962 . . . . 1.08 109.778 -179.686 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 333' ' ' ARG . . . . . 0.509 ' NH1' ' HG3' ' B' ' 333' ' ' ARG . 39.3 mtm-85 -71.93 152.24 42.69 Favored 'General case' 0 N--CA 1.488 1.455 0 O-C-N 121.312 -0.868 . . . . 3.42 109.387 179.73 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 334' ' ' GLY . . . . . . . . . . . . . . . 78.46 129.83 0.57 Allowed Glycine 0 N--CA 1.49 2.236 0 N-CA-C 109.719 -1.352 . . . . 0.4 109.719 179.811 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 335' ' ' ARG . . . . . . . . . . . . . 9.6 ttm180 -79.77 -37.99 34.15 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.29 -1.123 . . . . 3.55 109.65 -179.938 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 336' ' ' GLU . . . . . . . . . . . . . 4.5 mm-40 -56.21 -63.68 1.11 Allowed 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.232 -0.917 . . . . 2.28 109.783 -179.8 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 337' ' ' ARG . . . . . 0.42 HH11 ' HG2' ' B' ' 337' ' ' ARG . 4.7 mmt-85 -60.53 -30.44 69.74 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.282 -0.886 . . . . 3.64 109.608 -179.634 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 338' ' ' PHE . . . . . . . . . . . . . 25.6 t80 -55.09 -57.49 11.51 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.185 -0.947 . . . . 0.39 109.015 179.599 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 339' ' ' GLU . . . . . . . . . . . . . 31.5 mt-10 -50.76 -30.78 14.92 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.313 -0.867 . . . . 1.98 109.695 -179.82 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 340' ' ' MET . . . . . . . . . . . . . 41.5 ttp -63.54 -50.94 67.57 Favored 'General case' 0 N--CA 1.488 1.468 0 O-C-N 121.325 -0.859 . . . . 1.14 109.58 -179.93 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 341' ' ' PHE . . . . . . . . . . . . . 76.6 m-85 -62.35 -46.78 87.11 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.086 -1.009 . . . . 0.22 109.685 -179.905 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 342' ' ' ARG . . . . . 0.435 ' HG3' HH11 ' B' ' 342' ' ' ARG . 0.2 OUTLIER -48.41 -43.37 34.07 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.294 -0.878 . . . . 3.15 109.795 -179.612 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' B' B ' 343' ' ' GLU . . . . . . . . . . . . . 26.0 tt0 -59.42 -44.79 92.81 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.298 -0.876 . . . . 2.35 109.895 -179.569 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 344' ' ' LEU . . . . . 0.416 ' O ' HD21 ' B' ' 348' ' ' LEU . 41.2 mt -62.17 -36.47 81.97 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.197 -0.939 . . . . 1.05 109.889 -179.618 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 345' ' ' ASN . . . . . 0.416 ' HA ' ' CZ ' ' D' ' 341' ' ' PHE . 62.7 t-20 -57.05 -54.86 41.98 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.203 -0.935 . . . . 1.35 109.982 -179.669 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 346' ' ' GLU . . . . . . . . . . . . . 83.7 tt0 -61.06 -30.49 70.36 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.14 -0.975 . . . . 1.66 109.842 -179.472 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 347' ' ' ALA . . . . . . . . . . . . . . . -60.31 -56.29 23.35 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.2 -0.937 . . . . 1.02 110.116 -179.741 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 348' ' ' LEU . . . . . 0.467 ' N ' HD23 ' B' ' 348' ' ' LEU . 3.9 mm? -61.66 -48.4 81.02 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.087 -1.008 . . . . 1.05 110.06 -179.366 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 349' ' ' GLU . . . . . . . . . . . . . 80.8 mm-40 -57.32 -30.66 64.95 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.158 -0.964 . . . . 1.95 110.079 -179.351 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 350' ' ' LEU . . . . . 0.471 HD23 HD23 ' A' ' 350' ' ' LEU . 4.2 tt -63.95 -47.98 78.3 Favored 'General case' 0 C--N 1.302 -1.465 0 O-C-N 121.204 -0.935 . . . . 1.18 109.398 -179.909 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 351' ' ' LYS . . . . . . . . . . . . . 68.3 tttt -59.15 -48.35 81.92 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.331 -0.856 . . . . 1.96 109.566 -179.973 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 352' ' ' ASP . . . . . . . . . . . . . 3.2 m-20 -55.26 -29.68 58.58 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.243 -0.911 . . . . 1.16 109.371 179.988 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 353' ' ' ALA . . . . . . . . . . . . . . . -66.74 -38.3 86.38 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.329 -0.857 . . . . 1.21 109.487 -179.967 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 354' ' ' GLN . . . . . . . . . . . . . 25.6 mt-30 . . . . . 0 N--CA 1.489 1.515 0 O-C-N 121.236 -0.915 . . . . 1.69 109.467 179.863 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' C' C ' 326' ' ' GLU . . . . . . . . . . . . . 34.3 mt-10 . . . . . 0 N--CA 1.489 1.513 0 CA-C-O 121.348 0.594 . . . . 2.17 109.608 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' C' C ' 327' ' ' TYR . . . . . 0.516 ' CE1' ' HG2' ' A' ' 333' ' ' ARG . 39.1 m-85 -148.11 111.41 4.93 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.387 -0.82 . . . . 1.03 109.399 179.973 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' C' C ' 328' ' ' PHE . . . . . . . . . . . . . 97.8 m-85 -113.98 -168.16 1.31 Allowed 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.155 -0.966 . . . . 0.37 109.629 -179.978 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' C' C ' 329' ' ' THR . . . . . . . . . . . . . 9.4 p -153.13 165.83 34.4 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.392 -0.818 . . . . 1.04 108.962 -179.99 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' C' C ' 330' ' ' LEU . . . . . 0.491 ' O ' ' HA ' ' A' ' 329' ' ' THR . 16.3 tp -151.94 126.31 9.36 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.202 -0.936 . . . . 1.09 109.858 -179.521 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' C' C ' 331' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -85.89 118.65 25.51 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.298 -0.876 . . . . 1.48 109.044 179.433 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' C' C ' 332' ' ' ILE . . . . . . . . . . . . . 83.1 mt -103.45 109.86 28.24 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.508 0 O-C-N 121.163 -0.961 . . . . 1.08 110.111 -179.452 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' C' C ' 333' ' ' ARG . . . . . 0.574 ' HG2' ' CE1' ' A' ' 327' ' ' TYR . 10.9 mtt180 -72.8 128.74 36.41 Favored 'General case' 0 N--CA 1.489 1.479 0 O-C-N 121.284 -0.885 . . . . 3.36 109.289 179.674 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' C' C ' 334' ' ' GLY . . . . . . . . . . . . . . . 101.46 131.56 7.43 Favored Glycine 0 N--CA 1.489 2.212 0 N-CA-C 109.426 -1.47 . . . . 0.35 109.426 -179.913 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' C' C ' 335' ' ' ARG . . . . . 0.461 ' O ' ' HB3' ' C' ' 338' ' ' PHE . 12.1 ttt180 -80.42 -37.28 32.4 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.239 -1.154 . . . . 3.23 109.991 -179.653 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' C' C ' 336' ' ' GLU . . . . . . . . . . . . . 6.2 mm-40 -58.51 -57.15 14.22 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.052 -1.03 . . . . 2.62 109.943 -179.586 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' C' C ' 337' ' ' ARG . . . . . . . . . . . . . 2.0 mtp180 -59.96 -24.61 64.55 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.235 -0.916 . . . . 3.61 109.629 -179.603 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' C' C ' 338' ' ' PHE . . . . . 0.461 ' HB3' ' O ' ' C' ' 335' ' ' ARG . 85.3 t80 -54.95 -63.08 1.27 Allowed 'General case' 0 N--CA 1.489 1.489 0 O-C-N 121.289 -0.882 . . . . 0.43 109.387 -179.973 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' C' C ' 339' ' ' GLU . . . . . . . . . . . . . 42.5 mt-10 -50.03 -30.17 10.18 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.287 -0.883 . . . . 2.05 109.917 -179.68 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' C' C ' 340' ' ' MET . . . . . . . . . . . . . 27.4 ttp -64.22 -55.95 18.04 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.169 -0.957 . . . . 1.1 110.051 -179.882 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' C' C ' 341' ' ' PHE . . . . . . . . . . . . . 52.9 m-85 -62.32 -51.4 67.8 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.157 -0.965 . . . . 0.21 109.76 -179.51 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' C' C ' 342' ' ' ARG . . . . . . . . . . . . . 2.7 ttp180 -45.49 -40.85 8.93 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.268 -0.895 . . . . 3.42 109.577 179.999 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' C' C ' 343' ' ' GLU . . . . . . . . . . . . . 16.9 tt0 -60.5 -48.62 80.95 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.208 -0.932 . . . . 2.14 110.297 -179.637 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' C' C ' 344' ' ' LEU . . . . . 0.519 HD23 ' CD2' ' D' ' 344' ' ' LEU . 37.5 mt -60.51 -42.43 96.4 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 120.937 -1.102 . . . . 1.09 109.852 -179.481 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' C' C ' 345' ' ' ASN . . . . . 0.407 ' HA ' ' CZ ' ' A' ' 341' ' ' PHE . 44.4 t-20 -56.03 -47.9 76.97 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.161 -0.962 . . . . 1.38 109.436 179.906 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' C' C ' 346' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -62.42 -37.31 85.36 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.173 -0.955 . . . . 2.21 109.785 -179.756 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' C' C ' 347' ' ' ALA . . . . . . . . . . . . . . . -59.04 -55.4 35.53 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.137 -0.977 . . . . 1.03 110.251 -179.664 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' C' C ' 348' ' ' LEU . . . . . 0.509 HD23 ' N ' ' C' ' 348' ' ' LEU . 4.1 mm? -60.13 -38.62 83.61 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.109 -0.994 . . . . 1.06 109.548 -179.578 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' C' C ' 349' ' ' GLU . . . . . . . . . . . . . 89.3 mt-10 -59.0 -41.68 88.25 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.352 -0.842 . . . . 2.19 110.206 -179.481 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' C' C ' 350' ' ' LEU . . . . . 0.537 HD23 ' CD1' ' D' ' 350' ' ' LEU . 6.6 tt -63.21 -40.77 98.43 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.216 -0.928 . . . . 1.2 110.022 -179.439 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' C' C ' 351' ' ' LYS . . . . . . . . . . . . . 2.8 tttm -59.38 -41.27 88.95 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.242 -0.911 . . . . 1.92 109.886 -179.602 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' C' C ' 352' ' ' ASP . . . . . . . . . . . . . 3.1 m-20 -56.08 -41.11 74.62 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.171 -0.955 . . . . 1.19 110.064 -179.774 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' C' C ' 353' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 1.585 0 O-C-N 121.219 -0.926 . . . . 1.15 109.578 -179.881 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' D' D ' 326' ' ' GLU . . . . . . . . . . . . . 19.7 mt-10 . . . . . 0 N--CA 1.489 1.482 0 CA-C-O 121.316 0.579 . . . . 2.13 109.566 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' D' D ' 327' ' ' TYR . . . . . 0.46 ' CE1' ' HG2' ' B' ' 333' ' ' ARG . 49.9 m-85 -148.84 111.7 4.84 Favored 'General case' 0 N--CA 1.488 1.455 0 O-C-N 121.167 -0.958 . . . . 1.0 109.285 179.935 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' D' D ' 328' ' ' PHE . . . . . . . . . . . . . 94.4 m-85 -113.45 -169.5 1.51 Allowed 'General case' 0 N--CA 1.487 1.405 0 O-C-N 121.337 -0.852 . . . . 0.34 109.459 -179.859 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' D' D ' 329' ' ' THR . . . . . 0.402 ' HA ' ' O ' ' B' ' 330' ' ' LEU . 25.7 p -152.69 166.95 30.54 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.285 -0.885 . . . . 1.05 108.937 179.953 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' D' D ' 330' ' ' LEU . . . . . . . . . . . . . 49.2 tp -150.1 128.51 12.17 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.151 -0.968 . . . . 1.07 109.737 -179.441 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' D' D ' 331' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -86.95 109.74 19.56 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.231 -0.918 . . . . 0.93 109.134 179.632 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' D' D ' 332' ' ' ILE . . . . . . . . . . . . . 10.7 mt -103.62 108.55 24.76 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.539 0 O-C-N 121.201 -0.937 . . . . 1.07 109.765 -179.647 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' D' D ' 333' ' ' ARG . . . . . 0.511 ' NH1' ' HG3' ' D' ' 333' ' ' ARG . 39.0 mtm-85 -72.0 152.51 42.41 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.267 -0.895 . . . . 3.42 109.375 179.736 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' D' D ' 334' ' ' GLY . . . . . . . . . . . . . . . 78.41 129.73 0.56 Allowed Glycine 0 N--CA 1.492 2.405 0 N-CA-C 109.635 -1.386 . . . . 0.41 109.635 179.889 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' D' D ' 335' ' ' ARG . . . . . 0.414 ' HB2' ' CE1' ' B' ' 328' ' ' PHE . 9.6 ttm180 -80.1 -37.04 34.52 Favored 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.343 -1.092 . . . . 3.58 109.421 -179.937 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' D' D ' 336' ' ' GLU . . . . . . . . . . . . . 4.7 mm-40 -56.76 -63.88 1.06 Allowed 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.254 -0.904 . . . . 2.26 109.726 -179.788 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' D' D ' 337' ' ' ARG . . . . . 0.412 ' HG2' HH11 ' D' ' 337' ' ' ARG . 5.5 mmt-85 -60.34 -29.93 69.2 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.201 -0.937 . . . . 3.64 109.803 -179.557 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' D' D ' 338' ' ' PHE . . . . . . . . . . . . . 25.7 t80 -55.82 -57.52 11.72 Favored 'General case' 0 N--CA 1.489 1.492 0 O-C-N 121.242 -0.911 . . . . 0.4 108.909 179.745 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' D' D ' 339' ' ' GLU . . . . . . . . . . . . . 31.0 mt-10 -50.48 -30.93 13.93 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.25 -0.906 . . . . 1.99 109.665 -179.961 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' D' D ' 340' ' ' MET . . . . . . . . . . . . . 41.8 ttp -63.26 -50.96 68.13 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.2 -0.937 . . . . 1.13 109.696 -179.811 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' D' D ' 341' ' ' PHE . . . . . 0.416 ' CZ ' ' HA ' ' B' ' 345' ' ' ASN . 76.8 m-85 -62.35 -46.67 87.63 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.258 -0.901 . . . . 0.21 109.661 -179.887 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' D' D ' 342' ' ' ARG . . . . . 0.427 ' HG3' HH11 ' D' ' 342' ' ' ARG . 0.2 OUTLIER -48.43 -43.63 34.52 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.348 -0.845 . . . . 3.15 109.871 -179.611 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' D' D ' 343' ' ' GLU . . . . . . . . . . . . . 26.2 tt0 -59.24 -44.56 92.34 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.223 -0.923 . . . . 2.35 109.976 -179.595 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' D' D ' 344' ' ' LEU . . . . . 0.519 ' CD2' HD23 ' C' ' 344' ' ' LEU . 42.2 mt -62.41 -36.38 82.16 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.239 -0.913 . . . . 1.06 109.879 -179.654 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' D' D ' 345' ' ' ASN . . . . . . . . . . . . . 62.3 t-20 -57.53 -54.71 43.78 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.221 -0.925 . . . . 1.35 109.923 -179.614 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' D' D ' 346' ' ' GLU . . . . . . . . . . . . . 84.3 tt0 -61.1 -30.33 70.29 Favored 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.127 -0.983 . . . . 1.69 109.815 -179.605 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' D' D ' 347' ' ' ALA . . . . . . . . . . . . . . . -60.6 -56.22 23.93 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.117 -0.989 . . . . 1.03 110.056 -179.652 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' D' D ' 348' ' ' LEU . . . . . 0.469 ' N ' HD23 ' D' ' 348' ' ' LEU . 3.9 mm? -61.54 -48.73 79.69 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.235 -0.915 . . . . 1.04 109.979 -179.491 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' D' D ' 349' ' ' GLU . . . . . . . . . . . . . 80.8 mm-40 -57.2 -30.21 64.36 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.114 -0.991 . . . . 1.95 110.068 -179.317 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' D' D ' 350' ' ' LEU . . . . . 0.537 ' CD1' HD23 ' C' ' 350' ' ' LEU . 4.2 tt -64.09 -48.19 77.14 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.03 -1.044 . . . . 1.16 109.34 179.945 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' D' D ' 351' ' ' LYS . . . . . . . . . . . . . 68.5 tttt -58.95 -48.43 81.53 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.287 -0.883 . . . . 1.97 109.551 -179.899 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' D' D ' 352' ' ' ASP . . . . . . . . . . . . . 3.1 m-20 -55.15 -29.24 57.38 Favored 'General case' 0 N--CA 1.488 1.467 0 O-C-N 121.217 -0.927 . . . . 1.17 109.478 179.963 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' D' D ' 353' ' ' ALA . . . . . . . . . . . . . . . -67.33 -38.23 84.57 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.271 -0.893 . . . . 1.21 109.47 179.968 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' D' D ' 354' ' ' GLN . . . . . 0.477 ' NE2' HD12 ' C' ' 350' ' ' LEU . 25.5 mt-30 . . . . . 0 N--CA 1.49 1.533 0 O-C-N 121.222 -0.924 . . . . 1.68 109.453 179.995 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 326' ' ' GLU . . . . . . . . . . . . . 66.9 mm-40 . . . . . 0 N--CA 1.489 1.489 0 N-CA-C 109.312 -0.625 . . . . 2.13 109.312 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 327' ' ' TYR . . . . . 0.605 ' CE1' ' CG ' ' C' ' 333' ' ' ARG . 43.1 m-85 -148.75 95.27 2.39 Favored 'General case' 0 N--CA 1.488 1.446 0 O-C-N 121.249 -0.907 . . . . 1.0 109.557 -179.898 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 328' ' ' PHE . . . . . 0.4 ' CE2' ' HG3' ' C' ' 335' ' ' ARG . 84.7 m-85 -103.35 -162.48 0.91 Allowed 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.255 -0.903 . . . . 0.34 109.62 -179.991 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 329' ' ' THR . . . . . . . . . . . . . 40.8 p -154.12 166.91 31.6 Favored 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.365 -0.834 . . . . 1.05 109.11 179.855 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 330' ' ' LEU . . . . . . . . . . . . . 18.9 tp -149.96 126.61 10.96 Favored 'General case' 0 N--CA 1.488 1.46 0 O-C-N 121.097 -1.002 . . . . 1.07 110.064 -179.561 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 331' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -88.07 112.62 22.86 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.353 -0.842 . . . . 0.91 108.95 179.399 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 332' ' ' ILE . . . . . . . . . . . . . 50.5 mt -103.49 109.45 27.06 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.595 0 O-C-N 121.216 -0.928 . . . . 1.09 109.792 -179.716 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 333' ' ' ARG . . . . . 0.545 ' HG2' ' CE1' ' C' ' 327' ' ' TYR . 80.8 mtt180 -72.73 149.46 43.71 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.37 -0.831 . . . . 3.41 109.449 179.803 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 334' ' ' GLY . . . . . . . . . . . . . . . 82.03 124.69 0.78 Allowed Glycine 0 N--CA 1.491 2.307 0 N-CA-C 109.398 -1.481 . . . . 0.4 109.398 -179.894 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 335' ' ' ARG . . . . . . . . . . . . . 60.6 ttt180 -75.53 -33.42 60.71 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.318 -1.107 . . . . 3.55 109.542 -179.894 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 336' ' ' GLU . . . . . . . . . . . . . 62.8 tt0 -58.32 -61.84 2.27 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.267 -0.896 . . . . 2.29 109.768 -179.886 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 337' ' ' ARG . . . . . . . . . . . . . 8.2 mmt180 -62.1 -33.18 73.95 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.122 -0.987 . . . . 3.64 109.783 -179.739 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 338' ' ' PHE . . . . . . . . . . . . . 45.7 t80 -54.38 -57.02 12.87 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.123 -0.986 . . . . 0.41 109.753 -179.631 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 339' ' ' GLU . . . . . . . . . . . . . 41.6 mt-10 -51.09 -35.1 33.37 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.234 -0.916 . . . . 1.97 109.989 -179.699 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 340' ' ' MET . . . . . . . . . . . . . 48.5 ttp -63.61 -49.14 74.47 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.262 -0.899 . . . . 1.14 110.092 -179.56 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 341' ' ' PHE . . . . . . . . . . . . . 44.3 m-85 -61.83 -45.97 91.51 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.239 -0.913 . . . . 0.21 109.835 -179.456 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 342' ' ' ARG . . . . . . . . . . . . . 5.7 ttt180 -49.91 -42.26 47.73 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.167 -0.958 . . . . 3.15 110.06 -179.658 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 343' ' ' GLU . . . . . . . . . . . . . 1.2 tp10 -59.04 -49.85 76.33 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.144 -0.972 . . . . 2.35 109.886 -179.613 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 344' ' ' LEU . . . . . 0.421 ' O ' HD21 ' A' ' 348' ' ' LEU . 61.5 mt -59.94 -30.95 69.42 Favored 'General case' 0 N--CA 1.489 1.495 0 O-C-N 121.222 -0.924 . . . . 1.06 109.403 -179.737 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 345' ' ' ASN . . . . . . . . . . . . . 64.4 t-20 -58.41 -59.3 5.56 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.271 -0.893 . . . . 1.36 109.74 -179.98 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 346' ' ' GLU . . . . . 0.465 ' OE1' ' NZ ' ' B' ' 351' ' ' LYS . 1.0 OUTLIER -61.48 -26.29 67.8 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.234 -0.917 . . . . 1.65 109.884 -179.577 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 347' ' ' ALA . . . . . . . . . . . . . . . -60.79 -57.93 10.59 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.173 -0.954 . . . . 1.03 110.018 -179.74 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 348' ' ' LEU . . . . . 0.437 ' N ' ' CD2' ' A' ' 348' ' ' LEU . 4.1 mm? -61.94 -44.5 96.63 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.211 -0.931 . . . . 1.04 110.122 -179.38 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 349' ' ' GLU . . . . . . . . . . . . . 12.0 mm-40 -58.34 -33.34 69.43 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.123 -0.985 . . . . 1.94 109.939 -179.462 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 350' ' ' LEU . . . . . 0.512 HD12 ' NE2' ' B' ' 354' ' ' GLN . 5.1 tt -64.47 -43.51 93.98 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.225 -0.922 . . . . 1.17 109.843 -179.761 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 351' ' ' LYS . . . . . 0.44 ' NZ ' ' OE1' ' B' ' 346' ' ' GLU . 19.8 tttp -59.15 -45.11 91.82 Favored 'General case' 0 N--CA 1.489 1.499 0 O-C-N 121.337 -0.852 . . . . 1.97 109.961 -179.643 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 352' ' ' ASP . . . . . . . . . . . . . 36.1 m-20 -58.66 -49.03 79.04 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.233 -0.917 . . . . 1.16 110.265 -179.584 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 353' ' ' ALA . . . . . . . . . . . . . . . -65.99 -11.05 45.11 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.087 -1.008 . . . . 1.22 109.893 -179.31 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 354' ' ' GLN . . . . . 0.487 ' NE2' HD12 ' B' ' 350' ' ' LEU . 1.7 mt-30 . . . . . 0 N--CA 1.49 1.538 0 O-C-N 121.228 -0.92 . . . . 1.71 109.55 179.765 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 326' ' ' GLU . . . . . . . . . . . . . 67.0 mm-40 . . . . . 0 N--CA 1.489 1.5 0 N-CA-C 109.261 -0.644 . . . . 2.13 109.261 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' B' B ' 327' ' ' TYR . . . . . 0.585 ' CE1' ' HG2' ' D' ' 333' ' ' ARG . 44.1 m-85 -148.63 94.97 2.36 Favored 'General case' 0 N--CA 1.488 1.425 0 O-C-N 121.011 -1.056 . . . . 0.99 109.582 -179.956 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 328' ' ' PHE . . . . . . . . . . . . . 85.5 m-85 -103.19 -162.83 0.94 Allowed 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.265 -0.897 . . . . 0.36 109.534 -179.91 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 329' ' ' THR . . . . . . . . . . . . . 41.1 p -153.96 166.92 31.46 Favored 'General case' 0 N--CA 1.488 1.471 0 O-C-N 121.33 -0.856 . . . . 1.05 109.082 179.943 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 330' ' ' LEU . . . . . 0.41 ' O ' ' HA ' ' D' ' 329' ' ' THR . 18.6 tp -149.97 126.03 10.6 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.011 -1.056 . . . . 1.07 109.954 -179.579 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 331' ' ' GLN . . . . . 0.453 ' OE1' ' O ' ' D' ' 328' ' ' PHE . 0.2 OUTLIER -87.38 112.66 22.35 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.273 -0.892 . . . . 0.91 108.895 179.432 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' B' B ' 332' ' ' ILE . . . . . . . . . . . . . 50.3 mt -103.46 109.6 27.47 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.561 0 O-C-N 121.113 -0.992 . . . . 1.08 109.746 -179.699 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 333' ' ' ARG . . . . . 0.551 ' HG2' ' CE1' ' D' ' 327' ' ' TYR . 81.6 mtt180 -72.84 149.96 43.1 Favored 'General case' 0 N--CA 1.489 1.486 0 O-C-N 121.329 -0.857 . . . . 3.42 109.414 179.748 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 334' ' ' GLY . . . . . . . . . . . . . . . 81.4 124.81 0.7 Allowed Glycine 0 N--CA 1.491 2.36 0 N-CA-C 109.444 -1.463 . . . . 0.4 109.444 -179.893 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 335' ' ' ARG . . . . . . . . . . . . . 58.7 ttt180 -75.42 -33.15 60.92 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.22 -1.165 . . . . 3.55 109.644 -179.874 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 336' ' ' GLU . . . . . . . . . . . . . 61.3 tt0 -58.78 -61.77 2.37 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.241 -0.912 . . . . 2.28 109.704 -179.793 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 337' ' ' ARG . . . . . . . . . . . . . 7.8 mmt180 -61.78 -33.1 73.48 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.161 -0.962 . . . . 3.64 109.743 -179.762 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 338' ' ' PHE . . . . . . . . . . . . . 46.4 t80 -54.26 -57.54 10.79 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.171 -0.956 . . . . 0.39 109.794 -179.805 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 339' ' ' GLU . . . . . . . . . . . . . 41.3 mt-10 -51.02 -34.82 31.02 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.177 -0.952 . . . . 1.98 110.071 -179.686 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 340' ' ' MET . . . . . . . . . . . . . 47.8 ttp -63.91 -48.99 74.4 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.146 -0.971 . . . . 1.14 110.094 -179.505 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 341' ' ' PHE . . . . . . . . . . . . . 44.5 m-85 -61.96 -46.17 90.47 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.151 -0.968 . . . . 0.22 109.885 -179.56 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 342' ' ' ARG . . . . . . . . . . . . . 6.0 ttt180 -49.69 -42.36 45.52 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.213 -0.929 . . . . 3.15 110.051 -179.631 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 343' ' ' GLU . . . . . . . . . . . . . 1.1 tp10 -58.92 -49.62 77.11 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.077 -1.014 . . . . 2.35 109.882 -179.604 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 344' ' ' LEU . . . . . 0.414 ' O ' HD21 ' B' ' 348' ' ' LEU . 60.0 mt -60.29 -30.84 69.74 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.208 -0.932 . . . . 1.05 109.432 -179.677 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 345' ' ' ASN . . . . . 0.419 ' HA ' ' CZ ' ' D' ' 341' ' ' PHE . 64.4 t-20 -58.56 -59.05 5.99 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.354 -0.841 . . . . 1.35 109.735 179.978 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 346' ' ' GLU . . . . . 0.44 ' OE1' ' NZ ' ' A' ' 351' ' ' LYS . 1.1 tm-20 -61.64 -26.38 67.96 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.237 -0.914 . . . . 1.66 109.943 -179.642 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 347' ' ' ALA . . . . . . . . . . . . . . . -60.67 -57.7 11.6 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.187 -0.946 . . . . 1.02 110.116 -179.817 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 348' ' ' LEU . . . . . 0.47 HD11 ' NH2' ' D' ' 337' ' ' ARG . 4.1 mm? -62.06 -44.7 96.12 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.188 -0.945 . . . . 1.05 110.192 -179.448 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 349' ' ' GLU . . . . . . . . . . . . . 11.3 mm-40 -58.35 -33.09 69.16 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.222 -0.924 . . . . 1.95 109.979 -179.422 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 350' ' ' LEU . . . . . 0.501 HD23 HD23 ' A' ' 350' ' ' LEU . 5.2 tt -64.59 -43.34 94.12 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.258 -0.901 . . . . 1.18 109.858 -179.797 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 351' ' ' LYS . . . . . 0.465 ' NZ ' ' OE1' ' A' ' 346' ' ' GLU . 19.1 tttp -59.5 -44.57 93.07 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.365 -0.834 . . . . 1.96 109.917 -179.588 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 352' ' ' ASP . . . . . . . . . . . . . 37.2 m-20 -58.68 -49.24 78.27 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.242 -0.911 . . . . 1.16 110.178 -179.676 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 353' ' ' ALA . . . . . . . . . . . . . . . -65.8 -11.22 44.37 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.044 -1.035 . . . . 1.21 109.839 -179.438 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 354' ' ' GLN . . . . . 0.512 ' NE2' HD12 ' A' ' 350' ' ' LEU . 1.6 mt-30 . . . . . 0 N--CA 1.49 1.54 0 O-C-N 121.189 -0.945 . . . . 1.69 109.464 179.962 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' C' C ' 326' ' ' GLU . . . . . . . . . . . . . 1.8 mm-40 . . . . . 0 N--CA 1.491 1.592 0 N-CA-C 109.527 -0.545 . . . . 2.17 109.527 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' C' C ' 327' ' ' TYR . . . . . 0.545 ' CE1' ' HG2' ' A' ' 333' ' ' ARG . 41.2 m-85 -149.94 105.79 3.44 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.245 -0.909 . . . . 1.03 109.76 179.847 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' C' C ' 328' ' ' PHE . . . . . . . . . . . . . 91.6 m-85 -111.7 -164.21 0.9 Allowed 'General case' 0 C--N 1.303 -1.436 0 O-C-N 121.42 -0.8 . . . . 0.37 109.185 179.757 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' C' C ' 329' ' ' THR . . . . . . . . . . . . . 11.3 p -153.94 160.46 42.11 Favored 'General case' 0 C--N 1.302 -1.478 0 O-C-N 121.397 -0.815 . . . . 1.04 109.064 179.776 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' C' C ' 330' ' ' LEU . . . . . . . . . . . . . 16.7 tp -148.96 125.64 11.09 Favored 'General case' 0 N--CA 1.488 1.471 0 O-C-N 121.252 -0.905 . . . . 1.09 109.644 -179.788 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' C' C ' 331' ' ' GLN . . . . . . . . . . . . . 1.5 tp60 -86.93 116.65 25.14 Favored 'General case' 0 N--CA 1.489 1.5 0 O-C-N 121.282 -0.887 . . . . 1.48 109.021 179.61 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' C' C ' 332' ' ' ILE . . . . . 0.5 HD12 ' CD2' ' C' ' 341' ' ' PHE . 59.6 mt -103.3 110.02 28.62 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.452 0 O-C-N 121.128 -0.983 . . . . 1.08 109.654 -179.796 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' C' C ' 333' ' ' ARG . . . . . 0.605 ' CG ' ' CE1' ' A' ' 327' ' ' TYR . 2.1 mpt_? -71.61 149.75 45.32 Favored 'General case' 0 C--N 1.304 -1.381 0 O-C-N 121.334 -0.854 . . . . 3.36 109.07 179.634 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' C' C ' 334' ' ' GLY . . . . . . . . . . . . . . . 80.98 130.09 0.99 Allowed Glycine 0 N--CA 1.489 2.189 0 N-CA-C 109.567 -1.413 . . . . 0.35 109.567 -179.942 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' C' C ' 335' ' ' ARG . . . . . 0.4 ' HG3' ' CE2' ' A' ' 328' ' ' PHE . 57.1 ttt180 -77.92 -36.88 48.91 Favored 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.401 -1.058 . . . . 3.23 109.52 -179.89 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' C' C ' 336' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -57.5 -58.28 8.98 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.371 -0.831 . . . . 2.62 110.169 -179.471 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' C' C ' 337' ' ' ARG . . . . . 0.54 ' HG3' ' NH1' ' C' ' 337' ' ' ARG . 0.1 OUTLIER -59.87 -31.92 70.23 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.173 -0.954 . . . . 3.61 109.797 -179.638 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' C' C ' 338' ' ' PHE . . . . . . . . . . . . . 79.7 t80 -54.07 -55.21 29.69 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.294 -0.879 . . . . 0.43 109.745 -179.72 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' C' C ' 339' ' ' GLU . . . . . . . . . . . . . 34.0 mt-10 -52.01 -35.71 47.66 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.299 -0.876 . . . . 2.05 109.977 -179.795 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' C' C ' 340' ' ' MET . . . . . . . . . . . . . 31.5 ttp -64.38 -51.2 64.47 Favored 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.307 -0.87 . . . . 1.1 110.304 -179.454 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' C' C ' 341' ' ' PHE . . . . . 0.5 ' CD2' HD12 ' C' ' 332' ' ' ILE . 33.1 m-85 -62.06 -40.06 94.5 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.056 -1.028 . . . . 0.21 110.365 -179.338 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' C' C ' 342' ' ' ARG . . . . . 0.513 ' NH1' ' HG3' ' C' ' 342' ' ' ARG . 0.0 OUTLIER -51.7 -48.61 63.46 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.022 -1.049 . . . . 3.42 110.091 -179.516 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' C' C ' 343' ' ' GLU . . . . . . . . . . . . . 1.6 tp10 -59.74 -43.81 94.06 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.274 -0.891 . . . . 2.14 110.247 -179.419 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' C' C ' 344' ' ' LEU . . . . . . . . . . . . . 53.6 mt -61.5 -34.53 75.66 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.157 -0.964 . . . . 1.09 109.839 -179.529 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' C' C ' 345' ' ' ASN . . . . . 0.4 ' O ' ' HG2' ' C' ' 349' ' ' GLU . 39.0 t-20 -58.82 -57.77 11.57 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.242 -0.911 . . . . 1.38 109.71 -179.997 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' C' C ' 346' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -60.61 -24.87 65.84 Favored 'General case' 0 N--CA 1.489 1.486 0 O-C-N 121.205 -0.934 . . . . 2.21 109.926 -179.603 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' C' C ' 347' ' ' ALA . . . . . . . . . . . . . . . -62.07 -59.62 4.81 Favored 'General case' 0 N--CA 1.489 1.501 0 O-C-N 121.095 -1.003 . . . . 1.03 109.65 -179.979 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' C' C ' 348' ' ' LEU . . . . . 0.514 HD23 ' N ' ' C' ' 348' ' ' LEU . 3.8 mm? -64.43 -48.35 75.66 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.271 -0.893 . . . . 1.06 110.328 -179.583 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' C' C ' 349' ' ' GLU . . . . . 0.4 ' HG2' ' O ' ' C' ' 345' ' ' ASN . 3.8 mm-40 -55.33 -34.11 63.92 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.119 -0.988 . . . . 2.19 109.482 -179.393 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' C' C ' 350' ' ' LEU . . . . . 0.528 HD23 ' CD1' ' D' ' 350' ' ' LEU . 5.0 tt -64.87 -36.98 86.11 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.301 -0.874 . . . . 1.2 109.073 179.695 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' C' C ' 351' ' ' LYS . . . . . . . . . . . . . 19.4 tttt -60.33 -47.57 85.47 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.494 -0.754 . . . . 1.92 109.306 179.913 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' C' C ' 352' ' ' ASP . . . . . . . . . . . . . 15.0 m-20 -55.88 -52.96 62.26 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.385 -0.822 . . . . 1.19 109.514 -179.988 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' C' C ' 353' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 1.624 0 O-C-N 121.188 -0.945 . . . . 1.15 109.59 -179.818 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' D' D ' 326' ' ' GLU . . . . . . . . . . . . . 66.1 mm-40 . . . . . 0 N--CA 1.488 1.436 0 N-CA-C 109.222 -0.659 . . . . 2.13 109.222 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' D' D ' 327' ' ' TYR . . . . . 0.551 ' CE1' ' HG2' ' B' ' 333' ' ' ARG . 43.8 m-85 -148.44 94.81 2.35 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.21 -0.931 . . . . 1.0 109.453 -179.875 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' D' D ' 328' ' ' PHE . . . . . 0.453 ' O ' ' OE1' ' B' ' 331' ' ' GLN . 85.6 m-85 -103.03 -162.54 0.92 Allowed 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.191 -0.943 . . . . 0.34 109.574 179.93 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' D' D ' 329' ' ' THR . . . . . 0.41 ' HA ' ' O ' ' B' ' 330' ' ' LEU . 40.3 p -154.24 166.79 32.05 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.316 -0.865 . . . . 1.05 108.951 179.895 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' D' D ' 330' ' ' LEU . . . . . . . . . . . . . 18.7 tp -149.78 125.96 10.69 Favored 'General case' 0 N--CA 1.488 1.443 0 O-C-N 121.029 -1.044 . . . . 1.07 109.824 -179.502 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' D' D ' 331' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -87.48 112.48 22.24 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.203 -0.936 . . . . 0.93 108.876 179.491 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' D' D ' 332' ' ' ILE . . . . . . . . . . . . . 47.2 mt -103.34 109.64 27.54 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.543 0 O-C-N 121.257 -0.902 . . . . 1.07 109.858 -179.68 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' D' D ' 333' ' ' ARG . . . . . 0.585 ' HG2' ' CE1' ' B' ' 327' ' ' TYR . 82.0 mtt180 -72.84 150.74 42.44 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.445 -0.784 . . . . 3.42 109.358 179.838 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' D' D ' 334' ' ' GLY . . . . . . . . . . . . . . . 80.75 125.18 0.63 Allowed Glycine 0 N--CA 1.491 2.308 0 N-CA-C 109.373 -1.491 . . . . 0.41 109.373 -179.833 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' D' D ' 335' ' ' ARG . . . . . . . . . . . . . 57.0 ttt180 -75.7 -33.65 60.35 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.366 -1.079 . . . . 3.58 109.535 -179.978 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' D' D ' 336' ' ' GLU . . . . . . . . . . . . . 60.8 tt0 -58.29 -62.2 2.01 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.255 -0.903 . . . . 2.26 109.77 -179.854 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' D' D ' 337' ' ' ARG . . . . . 0.47 ' NH2' HD11 ' B' ' 348' ' ' LEU . 7.4 mmt180 -61.23 -32.85 72.64 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.247 -0.908 . . . . 3.64 109.74 -179.771 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' D' D ' 338' ' ' PHE . . . . . . . . . . . . . 46.5 t80 -54.44 -57.64 10.54 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.289 -0.882 . . . . 0.4 109.72 -179.732 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' D' D ' 339' ' ' GLU . . . . . . . . . . . . . 41.2 mt-10 -50.99 -34.88 30.97 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.166 -0.959 . . . . 1.99 109.978 -179.666 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' D' D ' 340' ' ' MET . . . . . . . . . . . . . 46.7 ttp -63.84 -49.74 71.61 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.086 -1.009 . . . . 1.13 110.019 -179.496 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' D' D ' 341' ' ' PHE . . . . . 0.419 ' CZ ' ' HA ' ' B' ' 345' ' ' ASN . 44.7 m-85 -61.31 -46.6 89.61 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.126 -0.984 . . . . 0.21 110.007 -179.674 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' D' D ' 342' ' ' ARG . . . . . . . . . . . . . 6.0 ttt180 -49.39 -42.58 42.76 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.168 -0.958 . . . . 3.15 110.02 -179.625 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' D' D ' 343' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -58.65 -49.93 75.72 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.133 -0.979 . . . . 2.35 109.844 -179.518 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' D' D ' 344' ' ' LEU . . . . . 0.429 ' O ' HD21 ' D' ' 348' ' ' LEU . 60.2 mt -59.93 -30.89 69.36 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.175 -0.953 . . . . 1.06 109.504 -179.786 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' D' D ' 345' ' ' ASN . . . . . . . . . . . . . 64.3 t-20 -58.61 -59.29 5.63 Favored 'General case' 0 N--CA 1.488 1.455 0 O-C-N 121.204 -0.935 . . . . 1.35 109.82 179.955 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' D' D ' 346' ' ' GLU . . . . . . . . . . . . . 1.2 tm-20 -61.31 -26.71 67.98 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.29 -0.881 . . . . 1.69 109.981 -179.687 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' D' D ' 347' ' ' ALA . . . . . . . . . . . . . . . -60.29 -57.72 11.6 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.1 -1.0 . . . . 1.03 110.111 -179.723 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' D' D ' 348' ' ' LEU . . . . . 0.444 ' CD2' ' N ' ' D' ' 348' ' ' LEU . 4.1 mm? -62.12 -44.68 96.1 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.152 -0.968 . . . . 1.04 110.092 -179.348 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' D' D ' 349' ' ' GLU . . . . . . . . . . . . . 10.2 mm-40 -58.22 -33.31 69.17 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.209 -0.932 . . . . 1.95 110.018 -179.436 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' D' D ' 350' ' ' LEU . . . . . 0.528 ' CD1' HD23 ' C' ' 350' ' ' LEU . 5.3 tt -64.44 -43.89 92.86 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.147 -0.971 . . . . 1.16 109.716 -179.819 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' D' D ' 351' ' ' LYS . . . . . 0.432 ' O ' ' HB2' ' D' ' 354' ' ' GLN . 18.7 tttp -58.96 -44.72 91.54 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.371 -0.831 . . . . 1.97 110.015 -179.601 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' D' D ' 352' ' ' ASP . . . . . . . . . . . . . 35.2 m-20 -58.46 -48.9 79.24 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.297 -0.877 . . . . 1.17 110.307 -179.576 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' D' D ' 353' ' ' ALA . . . . . . . . . . . . . . . -66.43 -11.15 50.3 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.259 -0.901 . . . . 1.21 109.784 -179.351 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' D' D ' 354' ' ' GLN . . . . . 0.472 ' HG3' HD22 ' D' ' 350' ' ' LEU . 1.5 mt-30 . . . . . 0 N--CA 1.491 1.592 0 O-C-N 121.211 -0.93 . . . . 1.68 109.484 179.829 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 326' ' ' GLU . . . . . . . . . . . . . 2.9 mm-40 . . . . . 0 N--CA 1.489 1.489 0 N-CA-C 109.016 -0.735 . . . . 2.13 109.016 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 327' ' ' TYR . . . . . 0.558 ' CE1' ' HG2' ' C' ' 333' ' ' ARG . 48.1 m-85 -148.98 102.42 3.26 Favored 'General case' 0 N--CA 1.488 1.444 0 O-C-N 121.168 -0.958 . . . . 1.0 109.395 179.985 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 328' ' ' PHE . . . . . . . . . . . . . 37.8 m-85 -106.87 -168.24 1.38 Allowed 'General case' 0 N--CA 1.489 1.479 0 O-C-N 121.406 -0.809 . . . . 0.34 109.282 -179.962 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 329' ' ' THR . . . . . . . . . . . . . 6.3 p -152.41 166.92 30.4 Favored 'General case' 0 N--CA 1.488 1.428 0 O-C-N 121.284 -0.885 . . . . 1.05 109.007 179.96 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 330' ' ' LEU . . . . . . . . . . . . . 16.9 tp -148.97 130.37 14.74 Favored 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.173 -0.954 . . . . 1.07 109.767 -179.605 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 331' ' ' GLN . . . . . . . . . . . . . 19.1 tp60 -88.42 111.78 22.17 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.326 -0.859 . . . . 0.91 109.53 179.785 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 332' ' ' ILE . . . . . . . . . . . . . 75.7 mt -103.96 111.41 33.51 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.702 0 O-C-N 121.121 -0.987 . . . . 1.09 109.603 179.836 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 333' ' ' ARG . . . . . 0.529 ' HG2' ' CE1' ' C' ' 327' ' ' TYR . 67.5 mtt180 -73.94 151.27 40.41 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.289 -0.882 . . . . 3.41 109.714 -179.983 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 334' ' ' GLY . . . . . . . . . . . . . . . 75.79 130.36 0.31 Allowed Glycine 0 N--CA 1.49 2.299 0 N-CA-C 109.545 -1.422 . . . . 0.4 109.545 179.914 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 335' ' ' ARG . . . . . 0.46 ' HB2' ' CZ ' ' C' ' 328' ' ' PHE . 33.1 ttt180 -78.21 -31.65 49.51 Favored 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.216 -1.167 . . . . 3.55 109.675 -179.819 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 336' ' ' GLU . . . . . . . . . . . . . 2.2 mt-10 -57.78 -62.01 2.11 Favored 'General case' 0 N--CA 1.493 1.675 0 O-C-N 121.19 -0.944 . . . . 2.29 109.776 -179.816 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 337' ' ' ARG . . . . . . . . . . . . . 1.9 mmt-85 -59.92 -32.05 70.42 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.238 -0.914 . . . . 3.64 109.529 -179.922 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 338' ' ' PHE . . . . . . . . . . . . . 64.5 t80 -56.44 -57.65 11.4 Favored 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.262 -0.899 . . . . 0.41 109.818 -179.991 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 339' ' ' GLU . . . . . . . . . . . . . 48.2 mt-10 -51.77 -31.92 28.86 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.231 -0.918 . . . . 1.97 109.947 -179.841 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 340' ' ' MET . . . . . . . . . . . . . 37.9 ttp -63.9 -50.66 67.88 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.239 -0.913 . . . . 1.14 109.729 -179.601 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 341' ' ' PHE . . . . . . . . . . . . . 39.2 m-85 -62.66 -41.86 99.3 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.297 -0.877 . . . . 0.21 109.949 -179.62 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 342' ' ' ARG . . . . . 0.531 ' HG2' ' NH1' ' A' ' 342' ' ' ARG . 0.1 OUTLIER -50.4 -42.43 53.63 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.093 -1.004 . . . . 3.15 109.771 -179.818 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 343' ' ' GLU . . . . . . . . . . . . . 2.3 tp10 -57.65 -45.72 85.11 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.211 -0.931 . . . . 2.35 109.705 -179.708 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 344' ' ' LEU . . . . . 0.419 ' O ' HD21 ' A' ' 348' ' ' LEU . 32.3 mt -62.36 -33.4 74.66 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.108 -0.995 . . . . 1.06 109.452 -179.973 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 345' ' ' ASN . . . . . . . . . . . . . 8.8 t-20 -56.72 -58.35 8.45 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.249 -0.907 . . . . 1.36 109.848 -179.797 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 346' ' ' GLU . . . . . . . . . . . . . 3.2 tt0 -60.42 -28.75 68.51 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.212 -0.93 . . . . 1.65 109.88 -179.539 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 347' ' ' ALA . . . . . . . . . . . . . . . -61.07 -59.84 4.72 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.122 -0.986 . . . . 1.03 110.132 -179.996 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 348' ' ' LEU . . . . . 0.419 HD21 ' O ' ' A' ' 344' ' ' LEU . 4.0 mm? -61.8 -43.74 98.26 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.27 -0.894 . . . . 1.04 110.058 -179.48 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 349' ' ' GLU . . . . . 0.42 ' OE2' ' NH1' ' C' ' 333' ' ' ARG . 1.8 mm-40 -56.7 -36.74 70.01 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.214 -0.929 . . . . 1.94 109.753 -179.393 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 350' ' ' LEU . . . . . 0.491 HD23 HD23 ' B' ' 350' ' ' LEU . 5.0 tt -63.2 -42.96 99.39 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.17 -0.956 . . . . 1.17 109.504 -179.738 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 351' ' ' LYS . . . . . . . . . . . . . 29.9 tttp -58.2 -35.55 71.8 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.142 -0.974 . . . . 1.97 109.132 179.89 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 352' ' ' ASP . . . . . . . . . . . . . 98.4 m-20 -57.07 -40.62 77.24 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.35 -0.844 . . . . 1.16 109.367 179.764 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 353' ' ' ALA . . . . . . . . . . . . . . . -67.74 -24.45 65.36 Favored 'General case' 0 N--CA 1.489 1.491 0 O-C-N 121.317 -0.865 . . . . 1.22 109.865 -179.838 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 354' ' ' GLN . . . . . . . . . . . . . 4.0 tt0 . . . . . 0 N--CA 1.493 1.685 0 O-C-N 121.085 -1.009 . . . . 1.71 109.671 179.945 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' B' B ' 326' ' ' GLU . . . . . . . . . . . . . 3.1 mm-40 . . . . . 0 N--CA 1.488 1.452 0 N-CA-C 109.125 -0.694 . . . . 2.13 109.125 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' B' B ' 327' ' ' TYR . . . . . 0.549 ' CE1' ' HG2' ' D' ' 333' ' ' ARG . 48.8 m-85 -148.84 103.51 3.37 Favored 'General case' 0 N--CA 1.488 1.463 0 O-C-N 121.28 -0.887 . . . . 0.99 109.247 179.782 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 328' ' ' PHE . . . . . . . . . . . . . 38.4 m-85 -108.27 -168.79 1.41 Allowed 'General case' 0 N--CA 1.488 1.473 0 O-C-N 121.249 -0.907 . . . . 0.36 109.149 -179.998 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 329' ' ' THR . . . . . . . . . . . . . 6.7 p -151.8 167.13 29.24 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.213 -0.929 . . . . 1.05 109.27 179.985 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 330' ' ' LEU . . . . . . . . . . . . . 16.9 tp -149.08 130.65 14.89 Favored 'General case' 0 N--CA 1.488 1.437 0 O-C-N 121.15 -0.969 . . . . 1.07 109.74 -179.648 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 331' ' ' GLN . . . . . . . . . . . . . 19.6 tp60 -88.88 111.71 22.39 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.45 -0.781 . . . . 0.91 109.409 179.951 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 332' ' ' ILE . . . . . . . . . . . . . 75.5 mt -103.93 111.19 32.61 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.603 0 O-C-N 121.151 -0.968 . . . . 1.08 109.637 179.91 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 333' ' ' ARG . . . . . 0.542 ' HG2' ' CE1' ' D' ' 327' ' ' TYR . 67.5 mtt180 -73.71 151.47 40.7 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.187 -0.946 . . . . 3.42 109.648 -179.984 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 334' ' ' GLY . . . . . . . . . . . . . . . 75.79 130.17 0.3 Allowed Glycine 0 N--CA 1.491 2.316 0 N-CA-C 109.772 -1.331 . . . . 0.4 109.772 179.827 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 335' ' ' ARG . . . . . . . . . . . . . 34.8 ttt180 -78.12 -31.32 49.85 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.291 -1.123 . . . . 3.55 109.808 -179.924 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 336' ' ' GLU . . . . . . . . . . . . . 2.1 mt-10 -58.28 -61.71 2.37 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.058 -1.026 . . . . 2.28 109.789 -179.736 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 337' ' ' ARG . . . . . . . . . . . . . 1.6 mmt-85 -60.2 -31.69 70.39 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.174 -0.953 . . . . 3.64 109.601 -179.864 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 338' ' ' PHE . . . . . . . . . . . . . 64.9 t80 -56.32 -58.5 7.74 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.147 -0.97 . . . . 0.39 109.712 179.837 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 339' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -51.04 -32.07 20.55 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.172 -0.955 . . . . 1.98 109.893 -179.867 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 340' ' ' MET . . . . . . . . . . . . . 39.4 ttp -63.41 -50.95 67.83 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.095 -1.003 . . . . 1.14 109.795 -179.743 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 341' ' ' PHE . . . . . . . . . . . . . 40.1 m-85 -62.5 -41.84 99.09 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.253 -0.904 . . . . 0.22 109.99 -179.589 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 342' ' ' ARG . . . . . 0.541 ' NH1' ' HG2' ' B' ' 342' ' ' ARG . 0.1 OUTLIER -50.63 -41.86 55.56 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.153 -0.967 . . . . 3.15 109.902 -179.662 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' B' B ' 343' ' ' GLU . . . . . . . . . . . . . 2.3 tp10 -58.38 -46.22 86.79 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.162 -0.961 . . . . 2.35 109.565 -179.707 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 344' ' ' LEU . . . . . 0.428 ' O ' HD21 ' B' ' 348' ' ' LEU . 34.5 mt -61.51 -33.79 74.4 Favored 'General case' 0 N--CA 1.489 1.477 0 O-C-N 121.277 -0.889 . . . . 1.05 109.421 179.937 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 345' ' ' ASN . . . . . . . . . . . . . 9.0 t-20 -56.86 -57.5 12.23 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.235 -0.915 . . . . 1.35 110.066 -179.669 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 346' ' ' GLU . . . . . . . . . . . . . 3.2 tt0 -61.12 -28.41 69.08 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.263 -0.898 . . . . 1.66 109.697 -179.569 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 347' ' ' ALA . . . . . . . . . . . . . . . -61.28 -59.94 4.52 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.189 -0.945 . . . . 1.02 110.047 -179.785 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 348' ' ' LEU . . . . . 0.428 ' CD2' ' N ' ' B' ' 348' ' ' LEU . 4.0 mm? -61.71 -43.74 98.28 Favored 'General case' 0 N--CA 1.494 1.743 0 O-C-N 121.356 -0.84 . . . . 1.05 109.994 -179.49 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 349' ' ' GLU . . . . . . . . . . . . . 1.8 mm-40 -56.75 -36.61 69.96 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.24 -0.912 . . . . 1.95 109.958 -179.419 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 350' ' ' LEU . . . . . 0.491 HD23 HD23 ' A' ' 350' ' ' LEU . 5.0 tt -63.42 -42.88 98.72 Favored 'General case' 0 N--CA 1.489 1.484 0 O-C-N 121.108 -0.995 . . . . 1.18 109.428 -179.777 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 351' ' ' LYS . . . . . . . . . . . . . 30.4 tttp -57.96 -35.92 71.83 Favored 'General case' 0 N--CA 1.489 1.481 0 O-C-N 121.07 -1.019 . . . . 1.96 109.135 179.832 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 352' ' ' ASP . . . . . . . . . . . . . 98.4 m-20 -57.05 -40.49 76.89 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.351 -0.843 . . . . 1.16 109.403 179.8 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 353' ' ' ALA . . . . . . . . . . . . . . . -67.71 -24.54 65.4 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.308 -0.87 . . . . 1.21 109.71 -179.763 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 354' ' ' GLN . . . . . . . . . . . . . 3.8 tt0 . . . . . 0 N--CA 1.492 1.663 0 O-C-N 121.222 -0.924 . . . . 1.69 109.704 -179.875 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' C' C ' 326' ' ' GLU . . . . . . . . . . . . . 6.8 mm-40 . . . . . 0 N--CA 1.491 1.577 0 CA-C-O 121.347 0.594 . . . . 2.17 109.561 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' C' C ' 327' ' ' TYR . . . . . 0.529 ' CE1' ' HG2' ' A' ' 333' ' ' ARG . 46.1 m-85 -148.61 107.79 3.91 Favored 'General case' 0 N--CA 1.488 1.443 0 O-C-N 121.327 -0.858 . . . . 1.03 109.267 -179.982 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' C' C ' 328' ' ' PHE . . . . . 0.46 ' CZ ' ' HB2' ' A' ' 335' ' ' ARG . 14.4 m-85 -113.66 -167.84 1.26 Allowed 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.345 -0.847 . . . . 0.37 109.433 179.914 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' C' C ' 329' ' ' THR . . . . . . . . . . . . . 29.5 p -151.46 169.54 21.78 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.341 -0.849 . . . . 1.04 109.282 -180.0 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' C' C ' 330' ' ' LEU . . . . . . . . . . . . . 28.3 tp -150.62 123.32 8.59 Favored 'General case' 0 C--N 1.304 -1.398 0 O-C-N 121.264 -0.898 . . . . 1.09 109.509 -179.787 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' C' C ' 331' ' ' GLN . . . . . . . . . . . . . 1.2 tt0 -86.71 115.56 24.23 Favored 'General case' 0 N--CA 1.489 1.48 0 O-C-N 121.317 -0.865 . . . . 1.48 108.974 179.599 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' C' C ' 332' ' ' ILE . . . . . . . . . . . . . 84.2 mt -103.2 111.78 34.24 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.511 0 O-C-N 121.178 -0.951 . . . . 1.08 109.62 -179.552 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' C' C ' 333' ' ' ARG . . . . . 0.558 ' HG2' ' CE1' ' A' ' 327' ' ' TYR . 5.6 mtp180 -73.35 144.38 46.51 Favored 'General case' 0 N--CA 1.487 1.422 0 O-C-N 121.274 -0.891 . . . . 3.36 109.443 179.8 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' C' C ' 334' ' ' GLY . . . . . . . . . . . . . . . 75.99 123.76 0.17 Allowed Glycine 0 N--CA 1.49 2.293 0 N-CA-C 109.572 -1.411 . . . . 0.35 109.572 179.864 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' C' C ' 335' ' ' ARG . . . . . 0.525 ' HG2' ' NH1' ' C' ' 335' ' ' ARG . 0.7 OUTLIER -70.59 -24.89 62.84 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.296 -1.12 . . . . 3.23 109.858 -179.728 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' C' C ' 336' ' ' GLU . . . . . . . . . . . . . 18.4 mt-10 -56.25 -67.8 0.27 Allowed 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.169 -0.957 . . . . 2.62 109.737 -179.553 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' C' C ' 337' ' ' ARG . . . . . 0.466 ' HD2' ' N ' ' C' ' 337' ' ' ARG . 11.4 mpt_? -60.11 -30.22 69.12 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.245 -0.91 . . . . 3.61 109.774 -179.823 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' C' C ' 338' ' ' PHE . . . . . . . . . . . . . 57.8 t80 -54.67 -59.75 4.29 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.325 -0.859 . . . . 0.43 109.984 -179.634 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' C' C ' 339' ' ' GLU . . . . . . . . . . . . . 14.8 mt-10 -51.14 -34.47 31.24 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.256 -0.903 . . . . 2.05 110.306 -179.567 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' C' C ' 340' ' ' MET . . . . . . . . . . . . . 53.8 ttp -63.62 -50.45 69.32 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.089 -1.007 . . . . 1.1 109.956 -179.611 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' C' C ' 341' ' ' PHE . . . . . . . . . . . . . 65.2 m-85 -61.56 -45.41 94.26 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.243 -0.911 . . . . 0.21 109.948 -179.593 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' C' C ' 342' ' ' ARG . . . . . . . . . . . . . 1.9 tmt_? -48.98 -42.69 38.61 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.282 -0.886 . . . . 3.42 110.025 -179.59 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' C' C ' 343' ' ' GLU . . . . . . . . . . . . . 28.8 tt0 -59.61 -47.04 87.13 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.153 -0.967 . . . . 2.14 110.24 -179.373 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' C' C ' 344' ' ' LEU . . . . . . . . . . . . . 73.4 mt -61.78 -34.58 76.14 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.142 -0.974 . . . . 1.09 110.218 -179.44 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' C' C ' 345' ' ' ASN . . . . . . . . . . . . . 39.1 t30 -57.64 -55.66 31.91 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.094 -1.004 . . . . 1.38 109.944 -179.526 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' C' C ' 346' ' ' GLU . . . . . 0.47 ' O ' ' HB2' ' C' ' 350' ' ' LEU . 3.5 tt0 -59.94 -27.34 66.69 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.164 -0.96 . . . . 2.21 109.638 -179.635 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' C' C ' 347' ' ' ALA . . . . . . . . . . . . . . . -62.76 -58.06 8.77 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.169 -0.957 . . . . 1.03 110.076 -179.917 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' C' C ' 348' ' ' LEU . . . . . 0.506 HD23 ' N ' ' C' ' 348' ' ' LEU . 4.2 mm? -62.52 -50.25 72.13 Favored 'General case' 0 N--CA 1.494 1.739 0 O-C-N 121.276 -0.89 . . . . 1.06 110.42 -179.289 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' C' C ' 349' ' ' GLU . . . . . . . . . . . . . 67.5 mm-40 -57.18 -33.42 67.44 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.124 -0.985 . . . . 2.19 109.831 -179.242 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' C' C ' 350' ' ' LEU . . . . . 0.523 HD23 ' CD2' ' D' ' 350' ' ' LEU . 5.4 tt -62.81 -40.22 96.71 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.236 -0.915 . . . . 1.2 109.383 -179.902 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' C' C ' 351' ' ' LYS . . . . . . . . . . . . . 1.5 tttm -62.13 -47.77 83.08 Favored 'General case' 0 N--CA 1.488 1.455 0 O-C-N 121.207 -0.933 . . . . 1.92 110.169 -179.801 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' C' C ' 352' ' ' ASP . . . . . . . . . . . . . 77.5 m-20 -51.35 -27.18 9.06 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.199 -0.938 . . . . 1.19 109.247 -179.6 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' C' C ' 353' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.488 1.469 0 O-C-N 121.323 -0.861 . . . . 1.15 109.312 179.742 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' D' D ' 326' ' ' GLU . . . . . . . . . . . . . 3.2 mm-40 . . . . . 0 N--CA 1.488 1.473 0 N-CA-C 109.028 -0.731 . . . . 2.13 109.028 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' D' D ' 327' ' ' TYR . . . . . 0.542 ' CE1' ' HG2' ' B' ' 333' ' ' ARG . 47.2 m-85 -149.03 103.05 3.31 Favored 'General case' 0 N--CA 1.488 1.442 0 O-C-N 121.219 -0.926 . . . . 1.0 109.357 179.815 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' D' D ' 328' ' ' PHE . . . . . . . . . . . . . 39.5 m-85 -107.61 -168.5 1.39 Allowed 'General case' 0 N--CA 1.489 1.477 0 O-C-N 121.286 -0.884 . . . . 0.34 109.248 -179.953 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' D' D ' 329' ' ' THR . . . . . . . . . . . . . 7.1 p -152.04 166.97 29.95 Favored 'General case' 0 N--CA 1.488 1.457 0 O-C-N 121.259 -0.9 . . . . 1.05 109.144 179.942 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' D' D ' 330' ' ' LEU . . . . . . . . . . . . . 18.0 tp -148.9 130.75 15.16 Favored 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.184 -0.948 . . . . 1.07 109.778 -179.605 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' D' D ' 331' ' ' GLN . . . . . . . . . . . . . 19.3 tp60 -89.06 111.18 21.86 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.509 -0.744 . . . . 0.93 109.545 179.814 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' D' D ' 332' ' ' ILE . . . . . . . . . . . . . 74.0 mt -103.49 111.77 34.45 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.568 0 O-C-N 121.073 -1.017 . . . . 1.07 109.579 179.921 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' D' D ' 333' ' ' ARG . . . . . 0.549 ' HG2' ' CE1' ' B' ' 327' ' ' TYR . 68.2 mtt180 -74.07 151.56 40.14 Favored 'General case' 0 N--CA 1.488 1.451 0 O-C-N 121.221 -0.924 . . . . 3.42 109.7 179.901 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' D' D ' 334' ' ' GLY . . . . . . . . . . . . . . . 76.03 130.8 0.35 Allowed Glycine 0 N--CA 1.491 2.338 0 N-CA-C 109.663 -1.375 . . . . 0.41 109.663 179.798 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' D' D ' 335' ' ' ARG . . . . . . . . . . . . . 35.9 ttt180 -78.61 -31.99 47.31 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.309 -1.113 . . . . 3.58 109.715 -179.934 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' D' D ' 336' ' ' GLU . . . . . . . . . . . . . 2.1 mt-10 -57.44 -61.86 2.19 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.173 -0.954 . . . . 2.26 109.832 -179.732 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' D' D ' 337' ' ' ARG . . . . . . . . . . . . . 1.5 mmt-85 -60.3 -31.74 70.55 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.172 -0.955 . . . . 3.64 109.593 -179.831 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' D' D ' 338' ' ' PHE . . . . . . . . . . . . . 63.6 t80 -56.24 -58.19 9.01 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.347 -0.845 . . . . 0.4 109.739 179.898 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' D' D ' 339' ' ' GLU . . . . . . . . . . . . . 43.1 mt-10 -51.59 -31.67 25.72 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.257 -0.902 . . . . 1.99 109.901 -179.767 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' D' D ' 340' ' ' MET . . . . . . . . . . . . . 39.8 ttp -63.8 -50.68 68.02 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.244 -0.91 . . . . 1.13 109.768 -179.695 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' D' D ' 341' ' ' PHE . . . . . . . . . . . . . 40.3 m-85 -62.55 -41.92 99.2 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.234 -0.916 . . . . 0.21 110.086 -179.725 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' D' D ' 342' ' ' ARG . . . . . 0.553 ' NH1' ' HG2' ' D' ' 342' ' ' ARG . 0.2 OUTLIER -50.33 -42.56 53.03 Favored 'General case' 0 N--CA 1.492 1.675 0 O-C-N 121.125 -0.984 . . . . 3.15 109.843 -179.598 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' D' D ' 343' ' ' GLU . . . . . . . . . . . . . 2.2 tp10 -57.92 -45.65 86.2 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.239 -0.913 . . . . 2.35 109.652 -179.686 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' D' D ' 344' ' ' LEU . . . . . 0.421 ' O ' HD21 ' D' ' 348' ' ' LEU . 36.0 mt -62.04 -34.13 75.66 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.223 -0.923 . . . . 1.06 109.398 -179.956 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' D' D ' 345' ' ' ASN . . . . . . . . . . . . . 9.2 t-20 -56.54 -58.13 9.35 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.277 -0.889 . . . . 1.35 109.95 -179.876 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' D' D ' 346' ' ' GLU . . . . . . . . . . . . . 3.1 tt0 -60.19 -28.95 68.38 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.269 -0.894 . . . . 1.69 109.704 -179.484 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' D' D ' 347' ' ' ALA . . . . . . . . . . . . . . . -61.1 -59.77 4.82 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.228 -0.92 . . . . 1.03 110.108 -179.766 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' D' D ' 348' ' ' LEU . . . . . 0.425 ' CD2' ' N ' ' D' ' 348' ' ' LEU . 4.0 mm? -61.71 -44.28 97.24 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.138 -0.976 . . . . 1.04 109.959 -179.39 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' D' D ' 349' ' ' GLU . . . . . . . . . . . . . 1.8 mm-40 -56.14 -36.69 68.55 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.175 -0.953 . . . . 1.95 109.892 -179.381 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' D' D ' 350' ' ' LEU . . . . . 0.523 ' CD2' HD23 ' C' ' 350' ' ' LEU . 5.1 tt -63.34 -42.48 98.94 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.169 -0.957 . . . . 1.16 109.467 -179.716 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' D' D ' 351' ' ' LYS . . . . . . . . . . . . . 30.9 tttp -58.63 -35.79 73.05 Favored 'General case' 0 N--CA 1.489 1.486 0 O-C-N 121.135 -0.978 . . . . 1.97 109.076 179.884 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' D' D ' 352' ' ' ASP . . . . . . . . . . . . . 98.6 m-20 -56.82 -40.45 76.03 Favored 'General case' 0 N--CA 1.488 1.47 0 O-C-N 121.345 -0.847 . . . . 1.17 109.479 179.729 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' D' D ' 353' ' ' ALA . . . . . . . . . . . . . . . -68.03 -24.54 65.11 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.334 -0.854 . . . . 1.21 109.737 -179.756 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' D' D ' 354' ' ' GLN . . . . . . . . . . . . . 3.9 tt0 . . . . . 0 N--CA 1.492 1.673 0 O-C-N 121.205 -0.934 . . . . 1.68 109.544 -179.914 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 326' ' ' GLU . . . . . . . . . . . . . 1.8 mm-40 . . . . . 0 N--CA 1.49 1.549 0 N-CA-C 109.241 -0.651 . . . . 2.13 109.241 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 327' ' ' TYR . . . . . 0.588 ' CE1' ' HG2' ' C' ' 333' ' ' ARG . 46.6 m-85 -149.14 105.31 3.5 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.129 -0.982 . . . . 1.0 109.767 -179.769 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 328' ' ' PHE . . . . . 0.565 ' CZ ' ' HD3' ' C' ' 335' ' ' ARG . 97.3 m-85 -112.28 -163.71 0.87 Allowed 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.388 -0.82 . . . . 0.34 109.407 179.801 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 329' ' ' THR . . . . . 0.44 ' HA ' ' O ' ' C' ' 330' ' ' LEU . 74.4 p -154.58 166.34 33.65 Favored 'General case' 0 N--CA 1.489 1.487 0 O-C-N 121.278 -0.889 . . . . 1.05 109.032 179.812 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 330' ' ' LEU . . . . . 0.411 ' O ' ' HA ' ' C' ' 329' ' ' THR . 32.9 tp -151.06 131.96 14.18 Favored 'General case' 0 N--CA 1.488 1.449 0 O-C-N 121.119 -0.988 . . . . 1.07 109.886 -179.775 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 331' ' ' GLN . . . . . . . . . . . . . 19.4 tp60 -86.87 114.84 23.85 Favored 'General case' 0 N--CA 1.488 1.449 0 O-C-N 121.318 -0.864 . . . . 0.91 109.121 179.688 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 332' ' ' ILE . . . . . 0.405 HG23 ' HA ' ' A' ' 338' ' ' PHE . 52.1 mt -103.26 107.22 21.66 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.572 0 O-C-N 121.215 -0.928 . . . . 1.09 109.659 -179.797 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 333' ' ' ARG . . . . . 0.523 ' HG2' ' CE1' ' C' ' 327' ' ' TYR . 9.9 mtp180 -72.49 140.04 48.0 Favored 'General case' 0 N--CA 1.488 1.447 0 O-C-N 121.252 -0.905 . . . . 3.41 109.45 179.897 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 334' ' ' GLY . . . . . . . . . . . . . . . 88.88 127.53 2.98 Favored Glycine 0 N--CA 1.49 2.297 0 N-CA-C 109.723 -1.351 . . . . 0.4 109.723 -179.991 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 335' ' ' ARG . . . . . 0.467 ' O ' ' HB3' ' A' ' 338' ' ' PHE . 8.0 ttt180 -78.33 -34.62 48.48 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.265 -1.138 . . . . 3.55 109.636 179.956 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 336' ' ' GLU . . . . . . . . . . . . . 9.3 tt0 -57.89 -62.33 1.89 Allowed 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.166 -0.959 . . . . 2.29 109.714 -179.862 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 337' ' ' ARG . . . . . 0.526 ' NH1' ' HG2' ' A' ' 337' ' ' ARG . 0.0 OUTLIER -60.97 -27.39 68.23 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.202 -0.936 . . . . 3.64 109.717 -179.746 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 338' ' ' PHE . . . . . 0.467 ' HB3' ' O ' ' A' ' 335' ' ' ARG . 52.0 t80 -54.08 -64.73 0.73 Allowed 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.239 -0.913 . . . . 0.41 109.651 -179.727 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 339' ' ' GLU . . . . . . . . . . . . . 43.2 mt-10 -50.62 -29.04 9.99 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.245 -0.909 . . . . 1.97 109.681 -179.739 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 340' ' ' MET . . . . . 0.433 ' HB3' ' O ' ' A' ' 337' ' ' ARG . 6.9 ttp -64.43 -52.29 58.81 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.17 -0.956 . . . . 1.14 109.851 -179.853 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 341' ' ' PHE . . . . . . . . . . . . . 40.4 m-85 -62.54 -44.61 95.93 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.313 -0.867 . . . . 0.21 110.068 -179.687 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 342' ' ' ARG . . . . . . . . . . . . . 1.8 ttp180 -49.82 -41.87 45.85 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.102 -0.999 . . . . 3.15 109.867 -179.598 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 343' ' ' GLU . . . . . . . . . . . . . 38.4 tt0 -59.06 -47.19 86.15 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.194 -0.941 . . . . 2.35 109.882 -179.697 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 344' ' ' LEU . . . . . . . . . . . . . 78.6 mt -62.71 -32.56 73.68 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.213 -0.929 . . . . 1.06 109.925 -179.65 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 345' ' ' ASN . . . . . 0.503 ' HA ' ' CZ ' ' C' ' 341' ' ' PHE . 53.8 t-20 -57.03 -56.09 26.26 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.203 -0.936 . . . . 1.36 110.064 -179.641 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 346' ' ' GLU . . . . . . . . . . . . . 3.9 tp10 -61.48 -26.79 68.13 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.145 -0.972 . . . . 1.65 110.089 -179.397 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 347' ' ' ALA . . . . . . . . . . . . . . . -61.41 -58.31 8.72 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.081 -1.012 . . . . 1.03 110.182 -179.618 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 348' ' ' LEU . . . . . 0.465 ' N ' HD23 ' A' ' 348' ' ' LEU . 4.0 mm? -62.1 -50.72 70.8 Favored 'General case' 0 N--CA 1.494 1.773 0 O-C-N 121.183 -0.948 . . . . 1.04 110.323 -179.287 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 349' ' ' GLU . . . . . . . . . . . . . 66.6 mt-10 -57.15 -30.87 64.81 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.184 -0.948 . . . . 1.94 110.055 -179.149 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 350' ' ' LEU . . . . . 0.501 HD23 HD23 ' B' ' 350' ' ' LEU . 8.9 tt -65.06 -45.59 84.68 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.147 -0.971 . . . . 1.17 109.579 -179.876 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 351' ' ' LYS . . . . . . . . . . . . . 41.1 tttm -57.35 -43.19 83.23 Favored 'General case' 0 N--CA 1.488 1.45 0 O-C-N 121.337 -0.852 . . . . 1.97 109.541 -179.441 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 352' ' ' ASP . . . . . . . . . . . . . 14.3 m-20 -55.85 -54.86 39.43 Favored 'General case' 0 N--CA 1.488 1.46 0 O-C-N 121.214 -0.929 . . . . 1.16 109.583 179.976 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 353' ' ' ALA . . . . . . . . . . . . . . . -68.47 -11.48 59.84 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.227 -0.921 . . . . 1.22 109.8 -179.832 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 354' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.49 1.566 0 O-C-N 121.167 -0.958 . . . . 1.71 109.723 -179.771 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 326' ' ' GLU . . . . . . . . . . . . . 1.8 mm-40 . . . . . 0 N--CA 1.49 1.572 0 N-CA-C 109.204 -0.665 . . . . 2.13 109.204 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' B' B ' 327' ' ' TYR . . . . . 0.572 ' CE1' ' HG2' ' D' ' 333' ' ' ARG . 46.2 m-85 -149.18 105.26 3.49 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.096 -1.003 . . . . 0.99 109.812 -179.79 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 328' ' ' PHE . . . . . . . . . . . . . 97.2 m-85 -112.16 -163.69 0.87 Allowed 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.375 -0.828 . . . . 0.36 109.471 179.783 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 329' ' ' THR . . . . . . . . . . . . . 73.8 p -154.59 166.33 33.7 Favored 'General case' 0 N--CA 1.489 1.488 0 O-C-N 121.283 -0.886 . . . . 1.05 108.986 179.788 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 330' ' ' LEU . . . . . . . . . . . . . 32.5 tp -151.07 131.93 14.15 Favored 'General case' 0 N--CA 1.489 1.481 0 O-C-N 121.102 -0.999 . . . . 1.07 109.857 -179.809 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 331' ' ' GLN . . . . . . . . . . . . . 19.5 tp60 -86.89 114.97 23.97 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.358 -0.839 . . . . 0.91 109.081 179.688 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 332' ' ' ILE . . . . . 0.412 HG23 ' HA ' ' B' ' 338' ' ' PHE . 52.2 mt -103.38 106.9 20.99 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.58 0 O-C-N 121.248 -0.908 . . . . 1.08 109.677 -179.769 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 333' ' ' ARG . . . . . 0.482 ' HG2' ' CE1' ' D' ' 327' ' ' TYR . 9.8 mtp180 -72.22 140.05 48.49 Favored 'General case' 0 N--CA 1.489 1.497 0 O-C-N 121.259 -0.901 . . . . 3.42 109.414 179.756 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 334' ' ' GLY . . . . . . . . . . . . . . . 88.95 127.45 2.98 Favored Glycine 0 N--CA 1.491 2.361 0 N-CA-C 109.72 -1.352 . . . . 0.4 109.72 179.851 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 335' ' ' ARG . . . . . 0.465 ' O ' ' HB3' ' B' ' 338' ' ' PHE . 8.2 ttt180 -78.14 -34.77 49.65 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.303 -1.116 . . . . 3.55 109.576 179.991 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 336' ' ' GLU . . . . . . . . . . . . . 9.2 tt0 -57.79 -62.36 1.86 Allowed 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.265 -0.897 . . . . 2.28 109.771 -179.787 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 337' ' ' ARG . . . . . 0.532 ' HG2' ' NH1' ' B' ' 337' ' ' ARG . 0.0 OUTLIER -60.85 -27.55 68.19 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.258 -0.901 . . . . 3.64 109.827 -179.801 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' B' B ' 338' ' ' PHE . . . . . 0.465 ' HB3' ' O ' ' B' ' 335' ' ' ARG . 52.2 t80 -53.92 -64.87 0.69 Allowed 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.284 -0.885 . . . . 0.39 109.669 -179.772 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 339' ' ' GLU . . . . . . . . . . . . . 42.7 mt-10 -50.5 -28.94 9.36 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.256 -0.902 . . . . 1.98 109.77 -179.775 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 340' ' ' MET . . . . . 0.434 ' HB3' ' O ' ' B' ' 337' ' ' ARG . 6.9 ttp -64.54 -52.2 58.91 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.182 -0.949 . . . . 1.14 109.79 -179.8 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 341' ' ' PHE . . . . . 0.534 ' CZ ' ' HA ' ' D' ' 345' ' ' ASN . 39.9 m-85 -62.66 -44.53 96.03 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.243 -0.911 . . . . 0.22 110.019 -179.624 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 342' ' ' ARG . . . . . . . . . . . . . 1.8 ttp180 -49.93 -41.79 47.04 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.156 -0.965 . . . . 3.15 109.918 -179.618 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 343' ' ' GLU . . . . . . . . . . . . . 37.4 tt0 -59.24 -47.15 86.42 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.181 -0.949 . . . . 2.35 109.793 -179.645 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 344' ' ' LEU . . . . . . . . . . . . . 79.3 mt -62.71 -32.46 73.57 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.129 -0.982 . . . . 1.05 109.825 -179.645 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 345' ' ' ASN . . . . . 0.449 ' HA ' ' CZ ' ' D' ' 341' ' ' PHE . 54.1 t-20 -57.22 -56.04 27.0 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.22 -0.925 . . . . 1.35 110.014 -179.585 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 346' ' ' GLU . . . . . . . . . . . . . 3.9 tp10 -61.49 -26.66 68.06 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.259 -0.9 . . . . 1.66 110.011 -179.443 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 347' ' ' ALA . . . . . . . . . . . . . . . -61.53 -58.34 8.53 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.124 -0.985 . . . . 1.02 110.17 -179.623 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 348' ' ' LEU . . . . . 0.459 ' N ' HD23 ' B' ' 348' ' ' LEU . 4.0 mm? -62.11 -50.75 70.65 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.192 -0.943 . . . . 1.05 110.327 -179.267 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 349' ' ' GLU . . . . . . . . . . . . . 66.7 mt-10 -57.09 -30.93 64.75 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.185 -0.947 . . . . 1.95 110.084 -179.15 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 350' ' ' LEU . . . . . 0.501 HD23 HD23 ' A' ' 350' ' ' LEU . 8.9 tt -65.01 -45.54 85.1 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.151 -0.968 . . . . 1.18 109.601 -179.923 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 351' ' ' LYS . . . . . . . . . . . . . 40.8 tttm -57.33 -43.17 83.13 Favored 'General case' 0 N--CA 1.489 1.497 0 O-C-N 121.268 -0.895 . . . . 1.96 109.618 -179.45 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 352' ' ' ASP . . . . . . . . . . . . . 14.4 m-20 -55.91 -54.88 39.32 Favored 'General case' 0 N--CA 1.489 1.478 0 O-C-N 121.208 -0.932 . . . . 1.16 109.56 179.902 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 353' ' ' ALA . . . . . . . . . . . . . . . -68.44 -11.61 59.98 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.215 -0.928 . . . . 1.21 109.802 -179.78 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 354' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.492 1.64 0 O-C-N 121.167 -0.958 . . . . 1.69 109.727 -179.779 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' C' C ' 326' ' ' GLU . . . . . 0.462 ' OE1' ' HB2' ' A' ' 335' ' ' ARG . 2.3 mt-10 . . . . . 0 N--CA 1.488 1.463 0 CA-C-O 121.35 0.595 . . . . 2.17 109.415 . . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' C' C ' 327' ' ' TYR . . . . . 0.523 ' CE1' ' HG2' ' A' ' 333' ' ' ARG . 42.6 m-85 -148.98 103.41 3.35 Favored 'General case' 0 N--CA 1.489 1.493 0 O-C-N 121.269 -0.894 . . . . 1.03 109.175 179.941 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' C' C ' 328' ' ' PHE . . . . . . . . . . . . . 52.9 m-85 -107.13 -167.41 1.27 Allowed 'General case' 0 N--CA 1.488 1.469 0 O-C-N 121.292 -0.88 . . . . 0.37 109.378 -179.944 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' C' C ' 329' ' ' THR . . . . . 0.411 ' HA ' ' O ' ' A' ' 330' ' ' LEU . 4.5 p -152.07 167.85 27.16 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.26 -0.9 . . . . 1.04 109.043 179.907 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' C' C ' 330' ' ' LEU . . . . . 0.44 ' O ' ' HA ' ' A' ' 329' ' ' THR . 27.0 tp -151.15 129.5 12.04 Favored 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.127 -0.983 . . . . 1.09 109.946 -179.525 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' C' C ' 331' ' ' GLN . . . . . 0.498 ' NE2' ' HB3' ' A' ' 327' ' ' TYR . 0.8 OUTLIER -89.41 114.91 26.43 Favored 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.3 -0.875 . . . . 1.48 109.438 179.724 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' C' C ' 332' ' ' ILE . . . . . 0.404 HG23 ' HA ' ' C' ' 338' ' ' PHE . 60.2 mt -103.76 113.29 40.23 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.622 0 O-C-N 121.11 -0.994 . . . . 1.08 109.648 179.964 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' C' C ' 333' ' ' ARG . . . . . 0.588 ' HG2' ' CE1' ' A' ' 327' ' ' TYR . 34.7 mtt180 -73.44 139.91 46.15 Favored 'General case' 0 N--CA 1.489 1.478 0 O-C-N 121.171 -0.956 . . . . 3.36 109.443 179.772 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' C' C ' 334' ' ' GLY . . . . . . . . . . . . . . . 81.43 125.64 0.75 Allowed Glycine 0 N--CA 1.491 2.325 0 N-CA-C 109.597 -1.401 . . . . 0.35 109.597 179.946 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' C' C ' 335' ' ' ARG . . . . . 0.565 ' HD3' ' CZ ' ' A' ' 328' ' ' PHE . 0.0 OUTLIER -76.57 -25.57 54.16 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.194 -1.18 . . . . 3.23 109.696 -179.986 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' C' C ' 336' ' ' GLU . . . . . . . . . . . . . 1.9 tt0 -55.85 -69.49 0.14 Allowed 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.135 -0.978 . . . . 2.62 109.72 -179.716 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' C' C ' 337' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -60.72 -23.83 65.21 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.164 -0.96 . . . . 3.61 109.566 -179.862 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' C' C ' 338' ' ' PHE . . . . . 0.436 ' HB3' ' O ' ' C' ' 335' ' ' ARG . 61.2 t80 -54.67 -59.4 4.76 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.215 -0.928 . . . . 0.43 109.491 -179.971 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' C' C ' 339' ' ' GLU . . . . . . . . . . . . . 2.1 mt-10 -52.1 -33.37 39.22 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.231 -0.918 . . . . 2.05 109.945 -179.794 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' C' C ' 340' ' ' MET . . . . . 0.464 ' HE3' ' HG ' ' A' ' 348' ' ' LEU . 41.5 ttp -63.21 -50.73 69.12 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.067 -1.021 . . . . 1.1 109.896 -179.618 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' C' C ' 341' ' ' PHE . . . . . 0.503 ' CZ ' ' HA ' ' A' ' 345' ' ' ASN . 46.9 m-85 -62.16 -50.34 72.23 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.142 -0.974 . . . . 0.21 109.785 -179.796 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' C' C ' 342' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -48.19 -42.2 29.2 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.224 -0.923 . . . . 3.42 110.068 -179.61 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' C' C ' 343' ' ' GLU . . . . . . . . . . . . . 10.2 tp10 -57.9 -48.1 80.85 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.251 -0.905 . . . . 2.14 109.618 -179.673 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' C' C ' 344' ' ' LEU . . . . . . . . . . . . . 79.6 mt -62.33 -26.51 68.47 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.292 -0.88 . . . . 1.09 109.603 -179.95 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' C' C ' 345' ' ' ASN . . . . . . . . . . . . . 56.9 t-20 -58.5 -57.63 12.11 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.288 -0.883 . . . . 1.38 110.019 -179.786 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' C' C ' 346' ' ' GLU . . . . . 0.462 ' O ' ' HG2' ' C' ' 346' ' ' GLU . 25.4 tt0 -60.96 -27.81 68.53 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.185 -0.947 . . . . 2.21 110.043 -179.415 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' C' C ' 347' ' ' ALA . . . . . . . . . . . . . . . -61.93 -58.4 8.07 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.037 -1.039 . . . . 1.03 110.276 -179.498 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' C' C ' 348' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -62.09 -48.94 77.96 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.206 -0.934 . . . . 1.06 110.538 -179.065 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' C' C ' 349' ' ' GLU . . . . . . . . . . . . . 16.5 mm-40 -57.49 -34.99 69.64 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.091 -1.005 . . . . 2.19 110.267 -179.135 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' C' C ' 350' ' ' LEU . . . . . 0.486 HD21 ' CD2' ' D' ' 350' ' ' LEU . 8.5 tt -64.48 -40.46 95.73 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.056 -1.028 . . . . 1.2 109.563 -179.794 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' C' C ' 351' ' ' LYS . . . . . . . . . . . . . 7.0 ttmt -59.33 -48.97 79.62 Favored 'General case' 0 N--CA 1.489 1.477 0 O-C-N 121.293 -0.879 . . . . 1.92 109.612 -179.837 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' C' C ' 352' ' ' ASP . . . . . . . . . . . . . 62.1 m-20 -56.94 -54.57 45.15 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.338 -0.851 . . . . 1.19 110.232 -179.732 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' C' C ' 353' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 1.56 0 O-C-N 121.141 -0.975 . . . . 1.15 110.063 -179.327 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' D' D ' 326' ' ' GLU . . . . . . . . . . . . . 1.8 mm-40 . . . . . 0 N--CA 1.49 1.533 0 N-CA-C 109.243 -0.651 . . . . 2.13 109.243 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' D' D ' 327' ' ' TYR . . . . . 0.482 ' CE1' ' HG2' ' B' ' 333' ' ' ARG . 46.7 m-85 -149.36 105.38 3.47 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.066 -1.021 . . . . 1.0 109.924 -179.834 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' D' D ' 328' ' ' PHE . . . . . . . . . . . . . 97.1 m-85 -112.29 -163.57 0.86 Allowed 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.307 -0.871 . . . . 0.34 109.451 179.838 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' D' D ' 329' ' ' THR . . . . . . . . . . . . . 72.5 p -154.71 166.38 33.62 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.309 -0.869 . . . . 1.05 108.924 179.817 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' D' D ' 330' ' ' LEU . . . . . . . . . . . . . 32.5 tp -151.07 132.09 14.29 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.056 -1.028 . . . . 1.07 109.823 -179.782 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' D' D ' 331' ' ' GLN . . . . . . . . . . . . . 19.4 tp60 -86.96 114.98 24.04 Favored 'General case' 0 N--CA 1.489 1.488 0 O-C-N 121.37 -0.832 . . . . 0.93 109.021 179.672 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' D' D ' 332' ' ' ILE . . . . . 0.41 HG23 ' HA ' ' D' ' 338' ' ' PHE . 52.5 mt -103.43 106.87 20.96 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.542 0 O-C-N 121.209 -0.932 . . . . 1.07 109.662 -179.8 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' D' D ' 333' ' ' ARG . . . . . 0.572 ' HG2' ' CE1' ' B' ' 327' ' ' TYR . 9.9 mtp180 -72.19 140.14 48.58 Favored 'General case' 0 N--CA 1.488 1.441 0 O-C-N 121.273 -0.892 . . . . 3.42 109.393 179.824 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' D' D ' 334' ' ' GLY . . . . . . . . . . . . . . . 88.96 127.23 2.93 Favored Glycine 0 N--CA 1.492 2.414 0 N-CA-C 109.689 -1.365 . . . . 0.41 109.689 179.93 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' D' D ' 335' ' ' ARG . . . . . 0.468 ' O ' ' HB3' ' D' ' 338' ' ' PHE . 7.9 ttt180 -78.2 -34.52 49.39 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.258 -1.142 . . . . 3.58 109.63 179.947 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' D' D ' 336' ' ' GLU . . . . . . . . . . . . . 9.2 tt0 -58.05 -62.19 2.0 Allowed 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.276 -0.89 . . . . 2.26 109.659 -179.819 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' D' D ' 337' ' ' ARG . . . . . 0.528 ' NH1' ' HG2' ' D' ' 337' ' ' ARG . 0.0 OUTLIER -60.99 -27.58 68.4 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.317 -0.864 . . . . 3.64 109.706 -179.774 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' D' D ' 338' ' ' PHE . . . . . 0.468 ' HB3' ' O ' ' D' ' 335' ' ' ARG . 52.9 t80 -53.84 -64.66 0.76 Allowed 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.248 -0.907 . . . . 0.4 109.777 -179.792 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' D' D ' 339' ' ' GLU . . . . . . . . . . . . . 42.8 mt-10 -50.6 -29.17 10.24 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.25 -0.906 . . . . 1.99 109.687 -179.765 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' D' D ' 340' ' ' MET . . . . . 0.425 ' HB3' ' O ' ' D' ' 337' ' ' ARG . 7.0 ttp -64.39 -52.26 59.12 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.236 -0.915 . . . . 1.13 109.793 -179.763 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' D' D ' 341' ' ' PHE . . . . . 0.449 ' CZ ' ' HA ' ' B' ' 345' ' ' ASN . 39.8 m-85 -62.71 -44.53 95.98 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.303 -0.873 . . . . 0.21 109.991 -179.594 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' D' D ' 342' ' ' ARG . . . . . . . . . . . . . 1.9 ttp180 -49.86 -41.93 46.42 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.158 -0.964 . . . . 3.15 109.921 -179.656 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' D' D ' 343' ' ' GLU . . . . . . . . . . . . . 38.1 tt0 -59.08 -47.19 86.16 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.133 -0.98 . . . . 2.35 109.885 -179.701 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' D' D ' 344' ' ' LEU . . . . . . . . . . . . . 79.3 mt -62.66 -32.55 73.63 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.191 -0.943 . . . . 1.06 109.909 -179.717 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' D' D ' 345' ' ' ASN . . . . . 0.534 ' HA ' ' CZ ' ' B' ' 341' ' ' PHE . 53.7 t-20 -57.11 -56.12 25.94 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.283 -0.886 . . . . 1.35 110.04 -179.613 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' D' D ' 346' ' ' GLU . . . . . . . . . . . . . 4.0 tp10 -61.45 -26.51 67.93 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.152 -0.968 . . . . 1.69 110.144 -179.498 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' D' D ' 347' ' ' ALA . . . . . . . . . . . . . . . -61.57 -58.34 8.5 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.169 -0.957 . . . . 1.03 110.172 -179.566 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' D' D ' 348' ' ' LEU . . . . . 0.459 ' N ' HD23 ' D' ' 348' ' ' LEU . 4.0 mm? -62.05 -50.63 71.22 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.212 -0.93 . . . . 1.04 110.294 -179.29 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' D' D ' 349' ' ' GLU . . . . . . . . . . . . . 66.9 mt-10 -57.19 -30.99 64.98 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.135 -0.978 . . . . 1.95 110.134 -179.226 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' D' D ' 350' ' ' LEU . . . . . 0.486 ' CD2' HD21 ' C' ' 350' ' ' LEU . 8.9 tt -65.08 -45.13 86.51 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.09 -1.006 . . . . 1.16 109.675 -179.884 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' D' D ' 351' ' ' LYS . . . . . . . . . . . . . 40.9 tttm -57.74 -43.3 85.29 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.302 -0.874 . . . . 1.97 109.593 -179.643 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' D' D ' 352' ' ' ASP . . . . . . . . . . . . . 14.3 m-20 -55.81 -54.92 38.59 Favored 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.253 -0.905 . . . . 1.17 109.561 179.926 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' D' D ' 353' ' ' ALA . . . . . . . . . . . . . . . -68.45 -11.43 59.73 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.247 -0.908 . . . . 1.21 109.779 -179.872 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' D' D ' 354' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.489 1.517 0 O-C-N 121.149 -0.969 . . . . 1.68 109.798 -179.826 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 326' ' ' GLU . . . . . . . . . . . . . 3.6 mt-10 . . . . . 0 N--CA 1.488 1.47 0 CA-C-O 121.364 0.602 . . . . 2.13 109.545 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 327' ' ' TYR . . . . . 0.448 ' CE1' ' HG2' ' C' ' 333' ' ' ARG . 47.2 m-85 -149.85 112.76 4.83 Favored 'General case' 0 N--CA 1.489 1.491 0 O-C-N 121.377 -0.827 . . . . 1.0 109.43 -179.9 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 328' ' ' PHE . . . . . 0.481 ' O ' ' OE1' ' C' ' 331' ' ' GLN . 77.4 m-85 -113.46 -170.18 1.64 Allowed 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.257 -0.902 . . . . 0.34 109.385 -179.934 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 329' ' ' THR . . . . . 0.415 ' HA ' ' O ' ' C' ' 330' ' ' LEU . 52.4 p -154.58 169.26 24.25 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.082 -1.012 . . . . 1.05 109.438 -179.775 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 330' ' ' LEU . . . . . . . . . . . . . 33.6 tp -152.12 129.09 11.01 Favored 'General case' 0 N--CA 1.488 1.474 0 O-C-N 121.081 -1.012 . . . . 1.07 110.144 -179.927 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 331' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -87.83 109.62 19.89 Favored 'General case' 0 N--CA 1.487 1.404 0 O-C-N 121.302 -0.874 . . . . 0.91 108.841 179.271 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 332' ' ' ILE . . . . . . . . . . . . . 18.3 mt -103.03 104.91 17.32 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.523 0 O-C-N 121.14 -0.975 . . . . 1.09 109.682 -179.586 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 333' ' ' ARG . . . . . 0.629 ' CG ' ' CE1' ' C' ' 327' ' ' TYR . 0.0 OUTLIER -72.01 152.92 42.1 Favored 'General case' 0 C--N 1.303 -1.455 0 O-C-N 121.564 -0.71 . . . . 3.41 109.25 179.714 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 334' ' ' GLY . . . . . . . . . . . . . . . 76.45 129.69 0.34 Allowed Glycine 0 N--CA 1.489 2.202 0 N-CA-C 109.545 -1.422 . . . . 0.4 109.545 179.997 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 335' ' ' ARG . . . . . . . . . . . . . 9.2 ttm180 -79.15 -26.0 42.82 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.317 -1.107 . . . . 3.55 109.785 -179.939 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 336' ' ' GLU . . . . . . . . . . . . . 16.3 mt-10 -57.42 -68.89 0.19 Allowed 'General case' 0 N--CA 1.495 1.786 0 O-C-N 121.225 -0.922 . . . . 2.29 109.83 -179.728 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 337' ' ' ARG . . . . . . . . . . . . . 6.1 mpt_? -59.41 -29.39 67.71 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.226 -0.921 . . . . 3.64 109.586 -179.738 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 338' ' ' PHE . . . . . . . . . . . . . 72.4 t80 -53.99 -59.6 4.43 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.431 -0.793 . . . . 0.41 109.645 -179.829 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 339' ' ' GLU . . . . . . . . . . . . . 58.9 mt-10 -50.54 -34.89 27.15 Favored 'General case' 0 N--CA 1.488 1.473 0 O-C-N 121.197 -0.939 . . . . 1.97 110.181 -179.456 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 340' ' ' MET . . . . . . . . . . . . . 52.9 ttp -64.2 -50.08 69.5 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.193 -0.942 . . . . 1.14 110.408 -179.288 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 341' ' ' PHE . . . . . . . . . . . . . 55.6 m-85 -62.08 -39.95 94.17 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.238 -0.914 . . . . 0.21 109.996 -179.344 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 342' ' ' ARG . . . . . . . . . . . . . 31.8 ttt180 -51.41 -47.59 62.91 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.182 -0.949 . . . . 3.15 110.175 -179.5 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 343' ' ' GLU . . . . . . . . . . . . . 9.4 tp10 -60.13 -43.02 96.0 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 120.992 -1.067 . . . . 2.35 110.201 -179.379 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 344' ' ' LEU . . . . . . . . . . . . . 52.7 mt -61.28 -37.04 81.72 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.085 -1.01 . . . . 1.06 110.03 -179.416 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 345' ' ' ASN . . . . . . . . . . . . . 46.4 t-20 -58.24 -53.27 60.16 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.166 -0.959 . . . . 1.36 109.8 -179.786 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 346' ' ' GLU . . . . . . . . . . . . . 1.2 tt0 -61.29 -30.95 70.79 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.208 -0.932 . . . . 1.65 109.768 -179.674 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 347' ' ' ALA . . . . . . . . . . . . . . . -61.59 -57.59 11.47 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.236 -0.915 . . . . 1.03 110.245 -179.501 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 348' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -61.56 -44.78 96.4 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.147 -0.97 . . . . 1.04 110.04 -179.324 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 349' ' ' GLU . . . . . . . . . . . . . 76.0 mt-10 -57.99 -35.21 70.9 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.228 -0.92 . . . . 1.94 109.95 -179.496 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 350' ' ' LEU . . . . . 0.529 HD21 ' CD1' ' B' ' 350' ' ' LEU . 6.8 tt -63.89 -48.39 76.82 Favored 'General case' 0 C--N 1.302 -1.474 0 O-C-N 121.098 -1.001 . . . . 1.17 109.593 -179.623 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 351' ' ' LYS . . . . . . . . . . . . . 43.4 tttm -59.11 -42.03 89.59 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.307 -0.87 . . . . 1.97 109.664 -179.794 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 352' ' ' ASP . . . . . 0.515 ' OD2' ' CZ ' ' C' ' 337' ' ' ARG . 1.0 OUTLIER -58.51 -38.96 78.81 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.084 -1.01 . . . . 1.16 109.742 -179.896 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 353' ' ' ALA . . . . . . . . . . . . . . . -67.19 -21.72 65.76 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.289 -0.882 . . . . 1.22 109.94 -179.483 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 354' ' ' GLN . . . . . . . . . . . . . 9.3 mt-30 . . . . . 0 N--CA 1.489 1.489 0 O-C-N 121.174 -0.953 . . . . 1.71 109.361 179.903 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' B' B ' 326' ' ' GLU . . . . . . . . . . . . . 3.8 mt-10 . . . . . 0 N--CA 1.491 1.581 0 CA-C-O 121.342 0.591 . . . . 2.13 109.619 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' B' B ' 327' ' ' TYR . . . . . 0.583 ' CE1' ' CG ' ' D' ' 333' ' ' ARG . 44.7 m-85 -149.55 112.11 4.75 Favored 'General case' 0 N--CA 1.488 1.443 0 O-C-N 121.105 -0.997 . . . . 0.99 109.651 -179.907 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 328' ' ' PHE . . . . . . . . . . . . . 80.4 m-85 -113.02 -170.88 1.76 Allowed 'General case' 0 C--N 1.303 -1.444 0 O-C-N 121.27 -0.894 . . . . 0.36 109.462 -179.67 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 329' ' ' THR . . . . . 0.406 ' HA ' ' O ' ' D' ' 330' ' ' LEU . 43.6 p -153.61 169.83 22.3 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.25 -0.906 . . . . 1.05 109.381 -179.689 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 330' ' ' LEU . . . . . . . . . . . . . 32.8 tp -152.7 128.83 10.43 Favored 'General case' 0 N--CA 1.489 1.479 0 O-C-N 121.021 -1.049 . . . . 1.07 110.198 -179.991 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 331' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -87.58 109.89 19.97 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.404 -0.81 . . . . 0.91 108.863 179.131 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 332' ' ' ILE . . . . . 0.415 HG23 ' HA ' ' B' ' 338' ' ' PHE . 20.4 mt -103.24 105.23 17.9 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.488 0 O-C-N 121.157 -0.964 . . . . 1.08 109.876 -179.63 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 333' ' ' ARG . . . . . 0.577 ' CG ' ' CE1' ' D' ' 327' ' ' TYR . 0.0 OUTLIER -72.46 151.86 42.29 Favored 'General case' 0 N--CA 1.489 1.486 0 O-C-N 121.324 -0.86 . . . . 3.42 109.241 179.735 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' B' B ' 334' ' ' GLY . . . . . . . . . . . . . . . 77.57 128.86 0.42 Allowed Glycine 0 N--CA 1.489 2.175 0 N-CA-C 109.837 -1.305 . . . . 0.4 109.837 179.935 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 335' ' ' ARG . . . . . . . . . . . . . 9.3 ttm180 -78.89 -27.05 43.91 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.473 -1.016 . . . . 3.55 109.739 -179.917 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 336' ' ' GLU . . . . . . . . . . . . . 18.1 mt-10 -57.48 -68.21 0.26 Allowed 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.205 -0.935 . . . . 2.28 109.805 -179.632 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 337' ' ' ARG . . . . . . . . . . . . . 5.7 mpt_? -60.13 -29.42 68.62 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.251 -0.906 . . . . 3.64 109.584 -179.844 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 338' ' ' PHE . . . . . 0.415 ' HA ' HG23 ' B' ' 332' ' ' ILE . 69.1 t80 -54.03 -58.25 8.02 Favored 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.317 -0.864 . . . . 0.39 109.608 -179.774 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 339' ' ' GLU . . . . . . . . . . . . . 58.0 mt-10 -51.44 -34.43 35.12 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.381 -0.824 . . . . 1.98 110.2 -179.594 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 340' ' ' MET . . . . . . . . . . . . . 52.0 ttp -65.05 -49.74 68.9 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.204 -0.935 . . . . 1.14 110.485 -179.258 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 341' ' ' PHE . . . . . . . . . . . . . 56.4 m-85 -62.1 -40.43 95.85 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.144 -0.972 . . . . 0.22 109.942 -179.343 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 342' ' ' ARG . . . . . . . . . . . . . 23.8 ttt180 -50.66 -47.51 58.62 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.217 -0.927 . . . . 3.15 110.18 -179.596 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 343' ' ' GLU . . . . . . . . . . . . . 11.8 tp10 -59.96 -42.42 94.07 Favored 'General case' 0 N--CA 1.494 1.759 0 O-C-N 121.218 -0.927 . . . . 2.35 110.142 -179.304 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 344' ' ' LEU . . . . . . . . . . . . . 45.2 mt -62.21 -37.1 84.06 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.106 -0.996 . . . . 1.05 110.039 -179.5 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 345' ' ' ASN . . . . . . . . . . . . . 50.8 t-20 -58.17 -53.58 56.61 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.155 -0.965 . . . . 1.35 110.008 -179.618 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 346' ' ' GLU . . . . . . . . . . . . . 1.2 tt0 -61.27 -31.2 71.02 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.249 -0.907 . . . . 1.66 109.789 -179.611 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 347' ' ' ALA . . . . . . . . . . . . . . . -61.14 -57.67 11.54 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.216 -0.928 . . . . 1.02 110.308 -179.525 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 348' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -60.96 -45.16 95.84 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.257 -0.902 . . . . 1.05 110.127 -179.412 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 349' ' ' GLU . . . . . . . . . . . . . 77.9 mt-10 -57.99 -35.36 71.1 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.11 -0.994 . . . . 1.95 110.056 -179.482 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 350' ' ' LEU . . . . . 0.529 ' CD1' HD21 ' A' ' 350' ' ' LEU . 6.9 tt -63.28 -48.29 78.74 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.145 -0.972 . . . . 1.18 109.451 -179.828 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 351' ' ' LYS . . . . . . . . . . . . . 45.9 tttm -59.24 -42.34 90.87 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.275 -0.89 . . . . 1.96 109.835 -179.734 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 352' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -58.63 -37.88 76.87 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.167 -0.958 . . . . 1.16 109.668 -179.982 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 353' ' ' ALA . . . . . . . . . . . . . . . -67.84 -22.17 65.15 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.362 -0.836 . . . . 1.21 109.728 -179.386 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 354' ' ' GLN . . . . . . . . . . . . . 8.5 mt-30 . . . . . 0 N--CA 1.49 1.571 0 O-C-N 121.148 -0.97 . . . . 1.69 109.471 -179.844 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' C' C ' 326' ' ' GLU . . . . . . . . . . . . . 16.7 mt-10 . . . . . 0 N--CA 1.489 1.475 0 N-CA-C 108.884 -0.784 . . . . 2.17 108.884 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' C' C ' 327' ' ' TYR . . . . . 0.629 ' CE1' ' CG ' ' A' ' 333' ' ' ARG . 43.8 m-85 -149.72 113.63 5.1 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.025 -1.047 . . . . 1.03 109.827 -179.824 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' C' C ' 328' ' ' PHE . . . . . . . . . . . . . 97.6 m-85 -113.03 -166.53 1.09 Allowed 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.162 -0.961 . . . . 0.37 109.726 179.718 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' C' C ' 329' ' ' THR . . . . . . . . . . . . . 27.2 p -153.32 167.14 30.37 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.212 -0.93 . . . . 1.04 109.564 -179.721 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' C' C ' 330' ' ' LEU . . . . . 0.415 ' O ' ' HA ' ' A' ' 329' ' ' THR . 18.4 tp -150.26 124.93 9.72 Favored 'General case' 0 N--CA 1.488 1.43 0 O-C-N 121.194 -0.941 . . . . 1.09 109.707 -179.727 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' C' C ' 331' ' ' GLN . . . . . 0.481 ' OE1' ' O ' ' A' ' 328' ' ' PHE . 7.2 tp-100 -89.23 109.01 19.94 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.245 -0.91 . . . . 1.48 109.14 179.794 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' C' C ' 332' ' ' ILE . . . . . . . . . . . . . 93.9 mt -102.78 113.75 40.35 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.647 0 O-C-N 121.081 -1.012 . . . . 1.08 109.737 -179.722 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' C' C ' 333' ' ' ARG . . . . . 0.448 ' HG2' ' CE1' ' A' ' 327' ' ' TYR . 0.6 OUTLIER -73.53 148.75 42.77 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.295 -0.878 . . . . 3.36 109.6 179.81 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' C' C ' 334' ' ' GLY . . . . . . . . . . . . . . . 70.89 134.57 0.11 Allowed Glycine 0 N--CA 1.492 2.385 0 N-CA-C 109.677 -1.369 . . . . 0.35 109.677 179.958 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' C' C ' 335' ' ' ARG . . . . . 0.551 ' HG2' ' NH1' ' C' ' 335' ' ' ARG . 0.0 OUTLIER -75.34 -26.33 58.51 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.329 -1.1 . . . . 3.23 109.622 -179.985 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' C' C ' 336' ' ' GLU . . . . . . . . . . . . . 9.2 tt0 -54.2 -65.06 0.64 Allowed 'General case' 0 C--N 1.301 -1.535 0 O-C-N 121.192 -0.943 . . . . 2.62 109.561 -179.509 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' C' C ' 337' ' ' ARG . . . . . 0.515 ' CZ ' ' OD2' ' A' ' 352' ' ' ASP . 2.0 mpt_? -59.58 -28.45 67.16 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.259 -0.9 . . . . 3.61 109.206 179.874 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' C' C ' 338' ' ' PHE . . . . . 0.468 ' HB3' ' O ' ' C' ' 335' ' ' ARG . 84.5 t80 -56.53 -64.54 0.83 Allowed 'General case' 0 N--CA 1.489 1.5 0 O-C-N 121.451 -0.781 . . . . 0.43 110.026 -179.813 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' C' C ' 339' ' ' GLU . . . . . 0.442 ' OE2' ' HG2' ' C' ' 335' ' ' ARG . 10.6 mt-10 -48.66 -37.0 17.24 Favored 'General case' 0 N--CA 1.495 1.802 0 O-C-N 121.132 -0.98 . . . . 2.05 110.398 -179.45 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' C' C ' 340' ' ' MET . . . . . . . . . . . . . 30.9 ttp -61.46 -49.63 76.04 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.054 -1.029 . . . . 1.1 109.727 -179.542 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' C' C ' 341' ' ' PHE . . . . . . . . . . . . . 44.2 m-85 -64.16 -41.1 97.29 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.207 -0.933 . . . . 0.21 110.161 -179.79 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' C' C ' 342' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -52.47 -48.02 66.15 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.258 -0.901 . . . . 3.42 110.032 -179.63 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' C' C ' 343' ' ' GLU . . . . . . . . . . . . . 14.4 tt0 -57.76 -45.93 85.23 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.345 -0.847 . . . . 2.14 110.063 -179.593 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' C' C ' 344' ' ' LEU . . . . . 0.466 ' O ' HD21 ' C' ' 348' ' ' LEU . 94.6 mt -63.06 -33.69 75.98 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.09 -1.006 . . . . 1.09 109.693 -179.729 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' C' C ' 345' ' ' ASN . . . . . . . . . . . . . 50.5 t-20 -59.48 -56.82 17.11 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.126 -0.984 . . . . 1.38 109.498 -179.995 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' C' C ' 346' ' ' GLU . . . . . . . . . . . . . 5.9 tp10 -61.97 -26.71 68.37 Favored 'General case' 0 C--N 1.302 -1.475 0 O-C-N 121.202 -0.936 . . . . 2.21 109.515 179.942 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' C' C ' 347' ' ' ALA . . . . . 0.434 ' HB3' ' HB2' ' D' ' 347' ' ' ALA . . . -64.07 -61.27 2.37 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.214 -0.929 . . . . 1.03 110.041 -179.799 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' C' C ' 348' ' ' LEU . . . . . 0.527 HD23 ' N ' ' C' ' 348' ' ' LEU . 3.9 mm? -60.5 -50.53 73.18 Favored 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.319 -0.863 . . . . 1.06 110.241 -179.051 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' C' C ' 349' ' ' GLU . . . . . . . . . . . . . 16.0 mm-40 -58.87 -34.52 71.71 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.233 -0.917 . . . . 2.19 109.998 -179.406 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' C' C ' 350' ' ' LEU . . . . . 0.529 ' CD2' HD21 ' D' ' 350' ' ' LEU . 3.5 tt -64.66 -37.97 89.39 Favored 'General case' 0 C--N 1.302 -1.493 0 O-C-N 121.049 -1.032 . . . . 1.2 109.378 -179.942 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' C' C ' 351' ' ' LYS . . . . . 0.435 ' HE2' ' OE2' ' D' ' 343' ' ' GLU . 11.3 tttp -58.55 -40.2 82.37 Favored 'General case' 0 N--CA 1.488 1.455 0 O-C-N 121.254 -0.904 . . . . 1.92 108.884 179.752 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' C' C ' 352' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 -56.63 -43.75 80.57 Favored 'General case' 0 C--N 1.304 -1.403 0 O-C-N 121.432 -0.792 . . . . 1.19 109.423 179.612 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' C' C ' 353' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 1.652 0 O-C-N 121.379 -0.825 . . . . 1.15 110.047 -179.764 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' D' D ' 326' ' ' GLU . . . . . . . . . . . . . 3.4 mt-10 . . . . . 0 N--CA 1.489 1.513 0 CA-C-O 121.356 0.598 . . . . 2.13 109.765 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' D' D ' 327' ' ' TYR . . . . . 0.577 ' CE1' ' CG ' ' B' ' 333' ' ' ARG . 44.6 m-85 -149.03 112.26 4.94 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.446 -0.784 . . . . 1.0 109.476 -179.937 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' D' D ' 328' ' ' PHE . . . . . . . . . . . . . 83.0 m-85 -113.49 -170.85 1.77 Allowed 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.317 -0.864 . . . . 0.34 109.426 -179.841 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' D' D ' 329' ' ' THR . . . . . . . . . . . . . 38.6 p -153.4 169.37 23.3 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.241 -0.912 . . . . 1.05 109.598 -179.864 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' D' D ' 330' ' ' LEU . . . . . 0.406 ' O ' ' HA ' ' B' ' 329' ' ' THR . 33.5 tp -152.56 128.89 10.56 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.228 -0.92 . . . . 1.07 110.267 179.968 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' D' D ' 331' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -88.27 109.21 19.77 Favored 'General case' 0 N--CA 1.491 1.602 0 N-CA-C 108.806 -0.813 . . . . 0.93 108.806 179.125 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' D' D ' 332' ' ' ILE . . . . . 0.444 HG23 ' HA ' ' D' ' 338' ' ' PHE . 20.2 mt -102.18 104.98 17.24 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.495 0 O-C-N 121.146 -0.971 . . . . 1.07 109.817 -179.646 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' D' D ' 333' ' ' ARG . . . . . 0.583 ' CG ' ' CE1' ' B' ' 327' ' ' TYR . 0.0 OUTLIER -72.23 151.87 42.58 Favored 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.323 -0.861 . . . . 3.42 109.141 179.553 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' D' D ' 334' ' ' GLY . . . . . . . . . . . . . . . 78.23 128.57 0.48 Allowed Glycine 0 N--CA 1.49 2.258 0 N-CA-C 109.689 -1.365 . . . . 0.41 109.689 179.963 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' D' D ' 335' ' ' ARG . . . . . . . . . . . . . 8.8 ttm180 -78.99 -28.25 43.45 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.414 -1.05 . . . . 3.58 109.858 -179.903 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' D' D ' 336' ' ' GLU . . . . . . . . . . . . . 12.8 mt-10 -57.08 -68.05 0.26 Allowed 'General case' 0 N--CA 1.495 1.786 0 O-C-N 121.301 -0.874 . . . . 2.26 109.772 -179.551 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' D' D ' 337' ' ' ARG . . . . . . . . . . . . . 5.8 mpt_? -59.87 -29.98 68.69 Favored 'General case' 0 N--CA 1.488 1.446 0 O-C-N 121.271 -0.893 . . . . 3.64 109.665 -179.81 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' D' D ' 338' ' ' PHE . . . . . 0.444 ' HA ' HG23 ' D' ' 332' ' ' ILE . 70.5 t80 -54.09 -58.59 6.76 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.256 -0.902 . . . . 0.4 109.566 -179.88 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' D' D ' 339' ' ' GLU . . . . . . . . . . . . . 55.3 mt-10 -51.05 -34.81 31.39 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.333 -0.854 . . . . 1.99 110.059 -179.721 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' D' D ' 340' ' ' MET . . . . . . . . . . . . . 51.9 ttp -64.64 -49.42 71.11 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.156 -0.965 . . . . 1.13 110.26 -179.116 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' D' D ' 341' ' ' PHE . . . . . . . . . . . . . 55.8 m-85 -62.25 -42.82 99.66 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.073 -1.017 . . . . 0.21 110.125 -179.403 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' D' D ' 342' ' ' ARG . . . . . . . . . . . . . 23.2 ttt180 -48.8 -47.03 42.43 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.183 -0.948 . . . . 3.15 110.166 -179.705 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' D' D ' 343' ' ' GLU . . . . . 0.435 ' OE2' ' HE2' ' C' ' 351' ' ' LYS . 13.9 tp10 -60.05 -42.8 95.26 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.04 -1.038 . . . . 2.35 110.012 -179.447 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' D' D ' 344' ' ' LEU . . . . . . . . . . . . . 38.0 mt -61.68 -37.38 83.9 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.128 -0.982 . . . . 1.06 109.956 -179.476 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' D' D ' 345' ' ' ASN . . . . . . . . . . . . . 51.5 t-20 -58.17 -52.6 64.89 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.071 -1.018 . . . . 1.35 109.935 -179.539 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' D' D ' 346' ' ' GLU . . . . . . . . . . . . . 1.3 tt0 -61.44 -32.11 72.07 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.21 -0.931 . . . . 1.69 109.862 -179.65 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' D' D ' 347' ' ' ALA . . . . . 0.434 ' HB2' ' HB3' ' C' ' 347' ' ' ALA . . . -60.87 -57.73 11.43 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.219 -0.926 . . . . 1.03 110.249 -179.7 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' D' D ' 348' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -60.99 -44.24 97.69 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.077 -1.014 . . . . 1.04 110.038 -179.301 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' D' D ' 349' ' ' GLU . . . . . . . . . . . . . 71.8 mt-10 -58.51 -35.01 71.59 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.043 -1.036 . . . . 1.95 110.075 -179.32 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' D' D ' 350' ' ' LEU . . . . . 0.529 HD21 ' CD2' ' C' ' 350' ' ' LEU . 6.6 tt -63.75 -48.01 78.71 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.011 -1.056 . . . . 1.16 109.594 -179.796 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' D' D ' 351' ' ' LYS . . . . . . . . . . . . . 48.4 tttm -58.55 -42.91 88.94 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.32 -0.862 . . . . 1.97 109.715 -179.835 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' D' D ' 352' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -58.58 -37.03 74.91 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.093 -1.004 . . . . 1.17 109.698 -179.977 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' D' D ' 353' ' ' ALA . . . . . . . . . . . . . . . -68.1 -22.65 64.89 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.204 -0.935 . . . . 1.21 110.003 -179.5 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' D' D ' 354' ' ' GLN . . . . . . . . . . . . . 9.5 mt-30 . . . . . 0 N--CA 1.49 1.562 0 O-C-N 121.107 -0.996 . . . . 1.68 109.677 -179.707 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 326' ' ' GLU . . . . . . . . . . . . . 2.1 mm-40 . . . . . 0 N--CA 1.489 1.511 0 N-CA-C 109.14 -0.689 . . . . 2.13 109.14 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 327' ' ' TYR . . . . . 0.576 ' CE1' ' HG3' ' C' ' 333' ' ' ARG . 51.0 m-85 -148.5 108.9 4.14 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.408 -0.808 . . . . 1.0 109.411 -179.829 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 328' ' ' PHE . . . . . . . . . . . . . 83.4 m-85 -113.42 -165.97 1.05 Allowed 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.414 -0.804 . . . . 0.34 109.592 179.98 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 329' ' ' THR . . . . . . . . . . . . . 22.2 p -154.75 167.68 29.38 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.295 -0.878 . . . . 1.05 109.432 -179.839 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 330' ' ' LEU . . . . . 0.418 HD22 HG12 ' A' ' 332' ' ' ILE . 25.0 tp -150.49 127.05 10.83 Favored 'General case' 0 C--N 1.302 -1.5 0 O-C-N 121.248 -0.907 . . . . 1.07 109.917 -179.787 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 331' ' ' GLN . . . . . . . . . . . . . 1.2 tp60 -86.32 108.4 18.41 Favored 'General case' 0 C--N 1.303 -1.451 0 O-C-N 121.257 -0.902 . . . . 0.91 108.854 179.144 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 332' ' ' ILE . . . . . 0.44 HG22 ' CD2' ' A' ' 341' ' ' PHE . 21.1 mt -102.83 112.94 38.04 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.516 0 O-C-N 121.311 -0.868 . . . . 1.09 109.509 -179.802 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 333' ' ' ARG . . . . . 0.409 ' HG2' ' CE2' ' C' ' 327' ' ' TYR . 54.9 mtm180 -72.84 154.91 40.41 Favored 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.491 -0.756 . . . . 3.41 109.535 179.845 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 334' ' ' GLY . . . . . . . . . . . . . . . 75.98 129.28 0.29 Allowed Glycine 0 N--CA 1.49 2.254 0 N-CA-C 109.728 -1.349 . . . . 0.4 109.728 179.868 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 335' ' ' ARG . . . . . 0.576 ' HB2' ' CZ ' ' C' ' 328' ' ' PHE . 31.3 ttp180 -78.91 -32.45 45.69 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.107 -1.231 . . . . 3.55 109.305 179.705 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 336' ' ' GLU . . . . . . . . . . . . . 1.9 tt0 -57.48 -62.99 1.39 Allowed 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.34 -0.85 . . . . 2.29 109.634 -179.799 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 337' ' ' ARG . . . . . 0.461 ' NH1' ' CG ' ' A' ' 337' ' ' ARG . 0.0 OUTLIER -59.2 -29.05 67.2 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.257 -0.902 . . . . 3.64 109.446 -179.651 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 338' ' ' PHE . . . . . 0.43 ' HB3' ' O ' ' A' ' 335' ' ' ARG . 75.5 t80 -54.76 -57.19 12.51 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.37 -0.831 . . . . 0.41 109.833 -179.872 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 339' ' ' GLU . . . . . . . . . . . . . 3.2 mt-10 -52.27 -33.47 42.08 Favored 'General case' 0 N--CA 1.493 1.692 0 O-C-N 121.205 -0.934 . . . . 1.97 109.678 -179.757 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 340' ' ' MET . . . . . . . . . . . . . 31.0 ttp -63.27 -50.2 71.08 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.482 -0.761 . . . . 1.14 109.947 -179.753 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 341' ' ' PHE . . . . . 0.44 ' CD2' HG22 ' A' ' 332' ' ' ILE . 52.4 m-85 -62.46 -44.24 96.88 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.147 -0.97 . . . . 0.21 109.792 -179.733 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 342' ' ' ARG . . . . . 0.429 ' CG ' HH11 ' A' ' 342' ' ' ARG . 0.1 OUTLIER -51.82 -43.16 63.01 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.319 -0.863 . . . . 3.15 109.866 -179.885 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 343' ' ' GLU . . . . . . . . . . . . . 1.8 tt0 -59.14 -48.37 81.86 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.254 -0.904 . . . . 2.35 110.281 -179.597 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 344' ' ' LEU . . . . . . . . . . . . . 74.4 mt -62.07 -32.85 73.43 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.121 -0.987 . . . . 1.06 109.244 -179.75 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 345' ' ' ASN . . . . . . . . . . . . . 46.4 t-20 -59.68 -52.35 65.87 Favored 'General case' 0 C--N 1.301 -1.523 0 O-C-N 121.364 -0.835 . . . . 1.36 109.823 -179.908 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 346' ' ' GLU . . . . . . . . . . . . . 41.9 tt0 -62.44 -27.04 68.83 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.138 -0.976 . . . . 1.65 109.568 -179.736 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 347' ' ' ALA . . . . . . . . . . . . . . . -62.44 -59.7 4.6 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.441 -0.787 . . . . 1.03 109.941 -179.808 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 348' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -61.13 -44.03 97.96 Favored 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.144 -0.973 . . . . 1.04 109.849 -179.753 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 349' ' ' GLU . . . . . . . . . . . . . 3.5 mm-40 -56.75 -36.32 69.64 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.056 -1.028 . . . . 1.94 109.683 -179.753 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 350' ' ' LEU . . . . . 0.47 HD21 HD11 ' B' ' 350' ' ' LEU . 5.9 tt -62.9 -45.05 94.33 Favored 'General case' 0 N--CA 1.489 1.488 0 O-C-N 120.942 -1.099 . . . . 1.17 109.354 -179.904 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 351' ' ' LYS . . . . . . . . . . . . . 30.0 tttt -57.88 -48.22 80.48 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.223 -0.923 . . . . 1.97 109.584 -179.843 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 352' ' ' ASP . . . . . . . . . . . . . 62.4 m-20 -59.88 -39.03 83.91 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.254 -0.904 . . . . 1.16 109.818 -179.809 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 353' ' ' ALA . . . . . . . . . . . . . . . -67.48 -18.16 64.96 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.296 -0.878 . . . . 1.22 110.038 -179.372 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 354' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.49 1.565 0 O-C-N 121.268 -0.895 . . . . 1.71 109.531 -179.985 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 326' ' ' GLU . . . . . . . . . . . . . 2.2 mm-40 . . . . . 0 N--CA 1.49 1.553 0 CA-C-O 121.439 0.637 . . . . 2.13 109.659 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' B' B ' 327' ' ' TYR . . . . . 0.401 ' CE1' ' HG2' ' D' ' 333' ' ' ARG . 51.3 m-85 -148.84 109.27 4.17 Favored 'General case' 0 C--N 1.301 -1.531 0 O-C-N 120.998 -1.064 . . . . 0.99 109.388 -179.997 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 328' ' ' PHE . . . . . 0.445 ' CE2' ' HB2' ' D' ' 335' ' ' ARG . 79.3 m-85 -113.62 -167.89 1.27 Allowed 'General case' 0 N--CA 1.488 1.443 0 O-C-N 121.217 -0.927 . . . . 0.36 109.451 179.898 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 329' ' ' THR . . . . . . . . . . . . . 27.4 p -152.57 167.25 29.48 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.505 -0.747 . . . . 1.05 109.41 179.808 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 330' ' ' LEU . . . . . 0.406 ' O ' ' HA ' ' D' ' 329' ' ' THR . 30.7 tp -149.26 126.22 11.25 Favored 'General case' 0 N--CA 1.488 1.434 0 O-C-N 121.202 -0.936 . . . . 1.07 109.817 -179.785 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 331' ' ' GLN . . . . . . . . . . . . . 1.4 tp60 -85.75 107.93 17.83 Favored 'General case' 0 C--N 1.304 -1.41 0 O-C-N 121.211 -0.931 . . . . 0.91 108.773 179.325 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 332' ' ' ILE . . . . . 0.416 HG22 ' CD2' ' B' ' 341' ' ' PHE . 24.7 mt -103.17 113.96 41.43 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.493 0 O-C-N 121.094 -1.004 . . . . 1.08 109.585 -179.417 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 333' ' ' ARG . . . . . . . . . . . . . 54.7 mtm180 -73.62 153.99 39.94 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.388 -0.82 . . . . 3.42 109.648 179.85 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 334' ' ' GLY . . . . . . . . . . . . . . . 77.5 129.47 0.44 Allowed Glycine 0 N--CA 1.488 2.109 0 N-CA-C 109.834 -1.306 . . . . 0.4 109.834 179.577 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 335' ' ' ARG . . . . . 0.401 ' O ' ' HB3' ' B' ' 338' ' ' PHE . 32.3 ttp180 -79.82 -32.78 40.67 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.431 -1.04 . . . . 3.55 109.303 -179.977 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 336' ' ' GLU . . . . . . . . . . . . . 2.4 tt0 -57.92 -62.2 1.98 Allowed 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.518 -0.739 . . . . 2.28 109.795 179.884 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 337' ' ' ARG . . . . . 0.468 ' NH1' ' CG ' ' B' ' 337' ' ' ARG . 0.0 OUTLIER -59.25 -29.0 67.23 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.372 -0.83 . . . . 3.64 109.588 179.953 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' B' B ' 338' ' ' PHE . . . . . 0.401 ' HB3' ' O ' ' B' ' 335' ' ' ARG . 73.5 t80 -55.36 -57.21 12.76 Favored 'General case' 0 N--CA 1.487 1.405 0 O-C-N 121.289 -0.882 . . . . 0.39 109.502 -179.941 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 339' ' ' GLU . . . . . . . . . . . . . 3.1 mt-10 -51.95 -33.7 38.8 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.259 -0.901 . . . . 1.98 109.777 -179.719 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 340' ' ' MET . . . . . . . . . . . . . 31.3 ttp -63.18 -50.79 68.95 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.298 -0.876 . . . . 1.14 110.23 -179.458 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 341' ' ' PHE . . . . . 0.416 ' CD2' HG22 ' B' ' 332' ' ' ILE . 51.8 m-85 -62.49 -43.35 99.02 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.02 -1.05 . . . . 0.22 109.551 -179.484 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 342' ' ' ARG . . . . . 0.437 ' CG ' HH11 ' B' ' 342' ' ' ARG . 0.0 OUTLIER -51.63 -43.82 62.72 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.452 -0.78 . . . . 3.15 109.813 -179.887 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' B' B ' 343' ' ' GLU . . . . . . . . . . . . . 2.1 tt0 -59.05 -47.39 85.39 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.43 -0.794 . . . . 2.35 110.154 -179.426 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 344' ' ' LEU . . . . . . . . . . . . . 76.3 mt -62.37 -33.38 74.63 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.094 -1.004 . . . . 1.05 109.51 -179.913 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 345' ' ' ASN . . . . . . . . . . . . . 45.2 t-20 -59.32 -52.89 63.68 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.253 -0.905 . . . . 1.35 109.87 -179.98 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 346' ' ' GLU . . . . . . . . . . . . . 45.3 tt0 -61.53 -28.3 69.22 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.101 -1.0 . . . . 1.66 109.642 -179.769 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 347' ' ' ALA . . . . . . . . . . . . . . . -61.89 -58.59 7.34 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.354 -0.841 . . . . 1.02 109.973 -179.829 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 348' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -62.38 -43.41 98.89 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.092 -1.005 . . . . 1.05 109.715 -179.65 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 349' ' ' GLU . . . . . . . . . . . . . 3.7 mm-40 -56.78 -35.4 68.63 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.182 -0.949 . . . . 1.95 110.125 -179.424 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 350' ' ' LEU . . . . . 0.47 HD11 HD21 ' A' ' 350' ' ' LEU . 6.2 tt -64.04 -46.15 85.68 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.056 -1.028 . . . . 1.18 109.704 -179.769 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 351' ' ' LYS . . . . . . . . . . . . . 33.6 tttt -56.77 -49.7 74.52 Favored 'General case' 0 N--CA 1.488 1.45 0 O-C-N 121.429 -0.794 . . . . 1.96 109.388 -179.894 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 352' ' ' ASP . . . . . . . . . . . . . 60.6 m-20 -58.45 -39.67 80.52 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.278 -0.889 . . . . 1.16 109.888 -179.895 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 353' ' ' ALA . . . . . . . . . . . . . . . -66.48 -20.48 66.05 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.341 -0.849 . . . . 1.21 109.814 -179.545 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 354' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.49 1.527 0 O-C-N 120.893 -1.129 . . . . 1.69 109.424 -179.925 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' C' C ' 326' ' ' GLU . . . . . . . . . . . . . 3.0 mm-40 . . . . . 0 N--CA 1.488 1.467 0 N-CA-C 109.099 -0.704 . . . . 2.17 109.099 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' C' C ' 327' ' ' TYR . . . . . 0.409 ' CE2' ' HG2' ' A' ' 333' ' ' ARG . 47.4 m-85 -147.27 113.43 5.86 Favored 'General case' 0 C--N 1.3 -1.556 0 O-C-N 121.465 -0.772 . . . . 1.03 109.003 179.822 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' C' C ' 328' ' ' PHE . . . . . 0.576 ' CZ ' ' HB2' ' A' ' 335' ' ' ARG . 86.3 m-85 -111.61 -167.95 1.25 Allowed 'General case' 0 C--N 1.303 -1.435 0 O-C-N 121.068 -1.02 . . . . 0.37 109.578 -179.618 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' C' C ' 329' ' ' THR . . . . . . . . . . . . . 76.4 p -150.37 163.79 37.47 Favored 'General case' 0 N--CA 1.487 1.407 0 O-C-N 121.248 -0.908 . . . . 1.04 109.387 -179.831 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' C' C ' 330' ' ' LEU . . . . . . . . . . . . . 29.6 tp -150.07 130.04 13.44 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.434 -0.791 . . . . 1.09 109.609 -179.623 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' C' C ' 331' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -85.37 115.14 22.94 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.258 -0.901 . . . . 1.48 109.234 179.847 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' C' C ' 332' ' ' ILE . . . . . 0.474 ' CG2' ' HA ' ' C' ' 338' ' ' PHE . 50.8 mt -103.88 99.88 9.31 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.482 0 O-C-N 121.165 -0.959 . . . . 1.08 109.916 -179.768 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' C' C ' 333' ' ' ARG . . . . . 0.576 ' HG3' ' CE1' ' A' ' 327' ' ' TYR . 0.0 OUTLIER -71.48 144.69 49.59 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.132 -0.98 . . . . 3.36 109.527 179.892 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' C' C ' 334' ' ' GLY . . . . . . . . . . . . . . . 86.99 126.75 2.18 Favored Glycine 0 N--CA 1.492 2.394 0 N-CA-C 109.379 -1.488 . . . . 0.35 109.379 -179.991 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' C' C ' 335' ' ' ARG . . . . . 0.404 ' NH1' ' CG ' ' C' ' 335' ' ' ARG . 0.0 OUTLIER -77.86 -32.34 51.98 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.332 -1.099 . . . . 3.23 109.848 -179.865 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' C' C ' 336' ' ' GLU . . . . . . . . . . . . . 1.6 mt-10 -59.84 -62.58 1.77 Allowed 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.02 -1.05 . . . . 2.62 110.062 -179.672 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' C' C ' 337' ' ' ARG . . . . . . . . . . . . . 10.5 mpt_? -62.08 -29.35 70.25 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.269 -0.895 . . . . 3.61 110.263 -179.621 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' C' C ' 338' ' ' PHE . . . . . 0.474 ' HA ' ' CG2' ' C' ' 332' ' ' ILE . 68.1 t80 -52.4 -60.21 3.49 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.137 -0.977 . . . . 0.43 109.621 -179.752 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' C' C ' 339' ' ' GLU . . . . . . . . . . . . . 3.6 mt-10 -51.89 -31.11 26.86 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.382 -0.824 . . . . 2.05 109.882 -179.836 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' C' C ' 340' ' ' MET . . . . . . . . . . . . . 38.5 ttp -63.28 -52.72 60.83 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.232 -0.917 . . . . 1.1 109.471 -179.847 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' C' C ' 341' ' ' PHE . . . . . 0.441 ' CB ' HD12 ' C' ' 332' ' ' ILE . 40.2 m-85 -60.69 -42.21 96.7 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.148 -0.97 . . . . 0.21 109.735 -179.745 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' C' C ' 342' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -52.29 -43.08 64.27 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.215 -0.928 . . . . 3.42 109.683 179.928 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' C' C ' 343' ' ' GLU . . . . . . . . . . . . . 7.5 tp10 -59.77 -45.51 92.03 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 120.912 -1.118 . . . . 2.14 110.32 -179.49 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' C' C ' 344' ' ' LEU . . . . . 0.478 ' O ' HD21 ' C' ' 348' ' ' LEU . 48.9 mt -62.5 -42.81 99.75 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.324 -0.86 . . . . 1.09 110.081 -179.387 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' C' C ' 345' ' ' ASN . . . . . . . . . . . . . 22.5 t-20 -54.12 -50.93 65.76 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.211 -0.931 . . . . 1.38 109.627 -179.379 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' C' C ' 346' ' ' GLU . . . . . . . . . . . . . 1.2 tt0 -61.03 -36.36 79.35 Favored 'General case' 0 C--N 1.301 -1.514 0 O-C-N 121.521 -0.737 . . . . 2.21 109.919 -179.773 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' C' C ' 347' ' ' ALA . . . . . . . . . . . . . . . -58.88 -52.76 64.35 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.075 -1.016 . . . . 1.03 110.1 -179.529 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' C' C ' 348' ' ' LEU . . . . . 0.478 HD21 ' O ' ' C' ' 344' ' ' LEU . 2.7 mm? -62.22 -40.6 96.65 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.327 -0.858 . . . . 1.06 109.721 -179.768 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' C' C ' 349' ' ' GLU . . . . . . . . . . . . . 4.1 mt-10 -59.73 -36.77 77.26 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.138 -0.976 . . . . 2.19 110.653 -179.247 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' C' C ' 350' ' ' LEU . . . . . 0.486 HD21 ' CD2' ' D' ' 350' ' ' LEU . 5.3 tt -62.61 -45.96 90.49 Favored 'General case' 0 N--CA 1.494 1.74 0 O-C-N 121.126 -0.984 . . . . 1.2 109.726 -178.953 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' C' C ' 351' ' ' LYS . . . . . . . . . . . . . 24.2 tttm -59.65 -43.73 93.81 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.111 -0.993 . . . . 1.92 109.903 -179.497 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' C' C ' 352' ' ' ASP . . . . . . . . . . . . . 13.2 m-20 -58.58 -32.16 68.69 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.06 -1.025 . . . . 1.19 109.417 -179.616 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' C' C ' 353' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.301 -1.504 0 O-C-N 121.234 -0.916 . . . . 1.15 110.378 -179.37 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' D' D ' 326' ' ' GLU . . . . . . . . . . . . . 1.6 mm-40 . . . . . 0 N--CA 1.486 1.37 0 N-CA-C 109.162 -0.681 . . . . 2.13 109.162 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' D' D ' 327' ' ' TYR . . . . . . . . . . . . . 54.7 m-85 -148.26 109.42 4.32 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.183 -0.948 . . . . 1.0 109.659 -179.854 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' D' D ' 328' ' ' PHE . . . . . . . . . . . . . 68.8 m-85 -114.37 -168.18 1.33 Allowed 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.504 -0.747 . . . . 0.34 109.732 -179.878 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' D' D ' 329' ' ' THR . . . . . 0.406 ' HA ' ' O ' ' B' ' 330' ' ' LEU . 32.9 p -152.87 166.25 32.9 Favored 'General case' 0 N--CA 1.489 1.49 0 O-C-N 121.179 -0.95 . . . . 1.05 109.298 -179.829 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' D' D ' 330' ' ' LEU . . . . . 0.45 HD22 HG12 ' D' ' 332' ' ' ILE . 24.1 tp -148.32 125.99 11.8 Favored 'General case' 0 N--CA 1.488 1.461 0 O-C-N 121.297 -0.877 . . . . 1.07 109.723 -179.734 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' D' D ' 331' ' ' GLN . . . . . . . . . . . . . 1.4 tp60 -85.36 108.69 17.95 Favored 'General case' 0 C--N 1.302 -1.473 0 O-C-N 121.314 -0.866 . . . . 0.93 108.75 179.591 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' D' D ' 332' ' ' ILE . . . . . 0.45 HG12 HD22 ' D' ' 330' ' ' LEU . 31.9 mt -103.33 114.52 43.16 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.641 0 O-C-N 121.146 -0.971 . . . . 1.07 110.003 -179.498 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' D' D ' 333' ' ' ARG . . . . . 0.401 ' HG2' ' CE1' ' B' ' 327' ' ' TYR . 53.4 mtm180 -73.83 151.78 40.43 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.2 -0.938 . . . . 3.42 109.839 179.932 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' D' D ' 334' ' ' GLY . . . . . . . . . . . . . . . 79.3 128.32 0.6 Allowed Glycine 0 N--CA 1.49 2.273 0 N-CA-C 109.894 -1.282 . . . . 0.41 109.894 179.237 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' D' D ' 335' ' ' ARG . . . . . 0.445 ' HB2' ' CE2' ' B' ' 328' ' ' PHE . 33.2 ttp180 -78.75 -32.09 46.51 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.224 -1.162 . . . . 3.58 109.356 179.904 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' D' D ' 336' ' ' GLU . . . . . . . . . . . . . 2.1 tt0 -58.02 -62.26 1.95 Allowed 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.344 -0.847 . . . . 2.26 109.515 -179.993 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' D' D ' 337' ' ' ARG . . . . . 0.452 ' NH1' ' CG ' ' D' ' 337' ' ' ARG . 0.0 OUTLIER -59.38 -29.62 67.83 Favored 'General case' 0 C--N 1.301 -1.502 0 O-C-N 121.229 -0.919 . . . . 3.64 109.719 -179.608 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' D' D ' 338' ' ' PHE . . . . . 0.405 ' HB3' ' O ' ' D' ' 335' ' ' ARG . 68.0 t80 -54.22 -56.44 18.24 Favored 'General case' 0 C--N 1.3 -1.574 0 O-C-N 121.491 -0.756 . . . . 0.4 109.429 179.953 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' D' D ' 339' ' ' GLU . . . . . . . . . . . . . 3.3 mt-10 -52.49 -34.65 50.36 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.022 -1.049 . . . . 1.99 109.924 -179.893 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' D' D ' 340' ' ' MET . . . . . . . . . . . . . 32.4 ttp -62.83 -50.24 71.75 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.137 -0.977 . . . . 1.13 110.143 -179.308 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' D' D ' 341' ' ' PHE . . . . . 0.421 ' CD2' HG22 ' D' ' 332' ' ' ILE . 46.8 m-85 -62.77 -44.24 96.7 Favored 'General case' 0 C--N 1.301 -1.511 0 O-C-N 120.944 -1.097 . . . . 0.21 109.669 -179.484 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' D' D ' 342' ' ' ARG . . . . . 0.453 ' NH1' ' CG ' ' D' ' 342' ' ' ARG . 0.0 OUTLIER -51.9 -41.65 62.11 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.236 -0.915 . . . . 3.15 109.821 -179.478 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' D' D ' 343' ' ' GLU . . . . . . . . . . . . . 3.6 tt0 -60.4 -46.62 89.32 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.183 -0.948 . . . . 2.35 109.84 -179.346 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' D' D ' 344' ' ' LEU . . . . . . . . . . . . . 71.6 mt -62.44 -34.68 77.28 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.283 -0.886 . . . . 1.06 109.469 -179.844 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' D' D ' 345' ' ' ASN . . . . . . . . . . . . . 43.2 t-20 -58.49 -52.19 66.68 Favored 'General case' 0 C--N 1.302 -1.492 0 O-C-N 121.319 -0.863 . . . . 1.35 109.723 -179.741 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' D' D ' 346' ' ' GLU . . . . . . . . . . . . . 42.7 tt0 -62.27 -29.25 70.29 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.39 -0.819 . . . . 1.69 109.678 -179.68 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' D' D ' 347' ' ' ALA . . . . . . . . . . . . . . . -61.88 -57.23 12.6 Favored 'General case' 0 N--CA 1.493 1.713 0 O-C-N 121.421 -0.799 . . . . 1.03 109.966 -179.614 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' D' D ' 348' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -63.16 -44.06 96.55 Favored 'General case' 0 N--CA 1.488 1.472 0 O-C-N 121.186 -0.946 . . . . 1.04 109.762 -179.804 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' D' D ' 349' ' ' GLU . . . . . . . . . . . . . 3.5 mm-40 -57.22 -34.13 68.24 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.109 -0.995 . . . . 1.95 110.066 -179.232 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' D' D ' 350' ' ' LEU . . . . . 0.486 ' CD2' HD21 ' C' ' 350' ' ' LEU . 6.2 tt -64.08 -46.13 85.64 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.181 -0.95 . . . . 1.16 109.413 179.885 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' D' D ' 351' ' ' LYS . . . . . . . . . . . . . 42.0 tttt -57.6 -48.43 79.42 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.252 -0.905 . . . . 1.97 109.59 -179.939 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' D' D ' 352' ' ' ASP . . . . . . . . . . . . . 72.4 m-20 -58.66 -38.89 79.13 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.401 -0.812 . . . . 1.17 109.462 179.458 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' D' D ' 353' ' ' ALA . . . . . . . . . . . . . . . -67.65 -20.71 65.35 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.485 -0.759 . . . . 1.21 109.958 -179.514 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' D' D ' 354' ' ' GLN . . . . . . . . . . . . . 1.1 mt-30 . . . . . 0 N--CA 1.491 1.611 0 O-C-N 121.365 -0.834 . . . . 1.68 109.675 -179.887 . . . . . . . . 0 0 . 1 . 021 nuclear orig core ' A' A ' 326' ' ' GLU . . . . . . . . . . . . . 7.1 mt-10 . . . . . 0 N--CA 1.49 1.535 0 CA-C-O 121.331 0.586 . . . . 2.13 109.634 . . . . . . . . . 0 0 . 1 . 021 nuclear orig core ' A' A ' 327' ' ' TYR . . . . . 0.579 ' CE1' ' HG2' ' C' ' 333' ' ' ARG . 41.4 m-85 -149.79 115.52 5.59 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.394 -0.816 . . . . 1.0 109.628 179.975 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 328' ' ' PHE . . . . . 0.485 ' CE1' ' HA ' ' C' ' 335' ' ' ARG . 76.6 m-85 -113.51 -170.52 1.71 Allowed 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.36 -0.837 . . . . 0.34 109.385 179.928 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 329' ' ' THR . . . . . . . . . . . . . 27.3 p -154.08 167.47 29.69 Favored 'General case' 0 N--CA 1.489 1.483 0 O-C-N 121.302 -0.874 . . . . 1.05 109.39 -179.849 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 330' ' ' LEU . . . . . . . . . . . . . 14.7 tp -148.51 126.9 12.27 Favored 'General case' 0 N--CA 1.489 1.487 0 O-C-N 121.251 -0.906 . . . . 1.07 109.359 -179.944 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 331' ' ' GLN . . . . . . . . . . . . . 1.1 tp60 -86.95 111.38 20.78 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.236 -0.915 . . . . 0.91 109.473 -179.996 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 332' ' ' ILE . . . . . . . . . . . . . 32.2 mt -103.61 110.26 29.47 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.501 0 O-C-N 121.245 -0.909 . . . . 1.09 109.486 -179.946 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 333' ' ' ARG . . . . . 0.406 ' CG ' ' CE2' ' C' ' 327' ' ' TYR . 2.4 mpt_? -72.36 143.44 48.61 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.287 -0.883 . . . . 3.41 109.241 179.793 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 334' ' ' GLY . . . . . . . . . . . . . . . 83.74 130.24 1.76 Allowed Glycine 0 N--CA 1.491 2.327 0 N-CA-C 109.525 -1.43 . . . . 0.4 109.525 -179.869 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 335' ' ' ARG . . . . . 0.505 ' HB2' ' CZ ' ' C' ' 328' ' ' PHE . 6.1 ttm180 -79.07 -28.48 43.11 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.344 -1.092 . . . . 3.55 109.622 -179.834 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 336' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -56.79 -67.16 0.34 Allowed 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.208 -0.933 . . . . 2.29 109.799 -179.701 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 337' ' ' ARG . . . . . 0.421 HH11 ' HG2' ' A' ' 337' ' ' ARG . 0.8 OUTLIER -60.38 -25.79 66.16 Favored 'General case' 0 N--CA 1.488 1.47 0 O-C-N 121.251 -0.905 . . . . 3.64 109.68 -179.766 . . . . . . . . 3 3 . 1 . 021 nuclear orig core ' A' A ' 338' ' ' PHE . . . . . 0.429 ' HB3' ' O ' ' A' ' 335' ' ' ARG . 67.6 t80 -55.39 -60.59 3.2 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.3 -0.875 . . . . 0.41 109.677 179.982 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 339' ' ' GLU . . . . . . . . . . . . . 79.0 mt-10 -51.36 -31.71 23.16 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.281 -0.887 . . . . 1.97 109.998 -179.738 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 340' ' ' MET . . . . . . . . . . . . . 9.5 ttp -63.27 -52.58 61.49 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.159 -0.963 . . . . 1.14 109.954 -179.575 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 341' ' ' PHE . . . . . . . . . . . . . 48.3 m-85 -61.85 -41.68 98.12 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.226 -0.921 . . . . 0.21 109.74 -179.587 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 342' ' ' ARG . . . . . 0.502 ' HG2' ' NH1' ' A' ' 342' ' ' ARG . 0.0 OUTLIER -50.9 -41.73 58.74 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.17 -0.956 . . . . 3.15 109.888 -179.867 . . . . . . . . 3 3 . 1 . 021 nuclear orig core ' A' A ' 343' ' ' GLU . . . . . . . . . . . . . 28.3 tt0 -59.67 -50.71 72.78 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.235 -0.916 . . . . 2.35 110.195 -179.544 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 344' ' ' LEU . . . . . 0.403 ' CD2' ' CD2' ' B' ' 344' ' ' LEU . 41.0 mt -61.29 -30.04 70.23 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.121 -0.987 . . . . 1.06 109.92 -179.477 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 345' ' ' ASN . . . . . 0.41 ' O ' ' HG3' ' A' ' 349' ' ' GLU . 29.3 t-20 -57.52 -56.96 15.18 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.235 -0.916 . . . . 1.36 109.993 -179.659 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 346' ' ' GLU . . . . . . . . . . . . . 70.9 tt0 -61.47 -29.47 69.99 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.219 -0.926 . . . . 1.65 110.183 -179.452 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 347' ' ' ALA . . . . . . . . . . . . . . . -60.07 -55.89 28.37 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.115 -0.991 . . . . 1.03 110.066 -179.522 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 348' ' ' LEU . . . . . 0.513 ' N ' HD23 ' A' ' 348' ' ' LEU . 4.2 mm? -61.84 -44.62 96.47 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.257 -0.902 . . . . 1.04 110.07 -179.434 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 349' ' ' GLU . . . . . 0.41 ' HG3' ' O ' ' A' ' 345' ' ' ASN . 55.8 mt-10 -57.4 -35.7 70.36 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.077 -1.015 . . . . 1.94 109.945 -179.438 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 350' ' ' LEU . . . . . 0.478 HD21 HD21 ' B' ' 350' ' ' LEU . 6.1 tt -64.45 -40.41 95.68 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.208 -0.933 . . . . 1.17 109.63 -179.765 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 351' ' ' LYS . . . . . . . . . . . . . 2.3 ttmt -57.67 -56.63 19.43 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.285 -0.884 . . . . 1.97 109.895 -179.577 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 352' ' ' ASP . . . . . . . . . . . . . 11.8 m-20 -56.55 -37.54 70.66 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.155 -0.966 . . . . 1.16 109.815 -179.842 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 353' ' ' ALA . . . . . . . . . . . . . . . -67.34 -26.35 66.45 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.228 -0.92 . . . . 1.22 110.183 -179.439 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 354' ' ' GLN . . . . . 0.435 ' NE2' HD12 ' B' ' 350' ' ' LEU . 0.1 OUTLIER . . . . . 0 N--CA 1.49 1.555 0 O-C-N 121.023 -1.048 . . . . 1.71 109.797 -179.751 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' B' B ' 326' ' ' GLU . . . . . . . . . . . . . 7.1 mt-10 . . . . . 0 N--CA 1.491 1.576 0 CA-C-O 121.338 0.59 . . . . 2.13 109.625 . . . . . . . . . 0 0 . 1 . 021 nuclear orig core ' B' B ' 327' ' ' TYR . . . . . 0.534 ' CE1' ' CG ' ' D' ' 333' ' ' ARG . 41.7 m-85 -149.84 115.42 5.55 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.339 -0.851 . . . . 0.99 109.607 179.96 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' B' B ' 328' ' ' PHE . . . . . 0.495 ' CZ ' ' HB2' ' D' ' 335' ' ' ARG . 75.9 m-85 -113.54 -170.72 1.75 Allowed 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.352 -0.843 . . . . 0.36 109.321 179.885 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' B' B ' 329' ' ' THR . . . . . 0.473 ' HA ' ' O ' ' D' ' 330' ' ' LEU . 27.7 p -153.89 167.64 29.02 Favored 'General case' 0 N--CA 1.488 1.471 0 O-C-N 121.311 -0.868 . . . . 1.05 109.383 -179.978 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' B' B ' 330' ' ' LEU . . . . . 0.481 ' O ' ' HA ' ' D' ' 329' ' ' THR . 14.5 tp -148.74 126.06 11.54 Favored 'General case' 0 N--CA 1.488 1.45 0 O-C-N 121.207 -0.933 . . . . 1.07 109.491 -179.859 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' B' B ' 331' ' ' GLN . . . . . . . . . . . . . 1.1 tt0 -86.24 111.32 20.31 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.243 -0.911 . . . . 0.91 109.624 -179.905 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B ' 332' ' ' ILE . . . . . . . . . . . . . 31.9 mt -103.36 110.63 30.39 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.538 0 O-C-N 121.23 -0.919 . . . . 1.08 109.564 179.922 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B ' 333' ' ' ARG . . . . . 0.595 ' CG ' ' CE1' ' D' ' 327' ' ' TYR . 2.4 mpt_? -72.57 143.53 48.23 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.19 -0.944 . . . . 3.42 109.261 179.822 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' B' B ' 334' ' ' GLY . . . . . . . . . . . . . . . 83.55 130.04 1.67 Allowed Glycine 0 N--CA 1.49 2.254 0 N-CA-C 109.521 -1.431 . . . . 0.4 109.521 -179.981 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B ' 335' ' ' ARG . . . . . 0.515 ' HB2' ' CZ ' ' D' ' 328' ' ' PHE . 6.2 ttm180 -78.68 -28.41 45.29 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.289 -1.124 . . . . 3.55 109.737 -179.947 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' B' B ' 336' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -56.7 -67.42 0.31 Allowed 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.236 -0.915 . . . . 2.28 109.796 -179.714 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' B' B ' 337' ' ' ARG . . . . . 0.415 HH11 ' HG2' ' B' ' 337' ' ' ARG . 0.8 OUTLIER -60.3 -25.52 65.81 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.271 -0.893 . . . . 3.64 109.676 -179.798 . . . . . . . . 3 3 . 1 . 021 nuclear orig core ' B' B ' 338' ' ' PHE . . . . . 0.427 ' HB3' ' O ' ' B' ' 335' ' ' ARG . 66.8 t80 -55.67 -60.7 3.07 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.221 -0.924 . . . . 0.39 109.517 -179.96 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' B' B ' 339' ' ' GLU . . . . . . . . . . . . . 79.1 mt-10 -51.32 -31.77 22.89 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.365 -0.834 . . . . 1.98 109.965 -179.673 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B ' 340' ' ' MET . . . . . . . . . . . . . 9.4 ttp -63.32 -52.52 61.54 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.149 -0.969 . . . . 1.14 110.041 -179.597 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B ' 341' ' ' PHE . . . . . . . . . . . . . 48.3 m-85 -61.64 -42.14 98.48 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.167 -0.958 . . . . 0.22 109.761 -179.695 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B ' 342' ' ' ARG . . . . . 0.512 ' NH1' ' HG2' ' B' ' 342' ' ' ARG . 0.0 OUTLIER -50.32 -42.03 52.13 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.334 -0.854 . . . . 3.15 109.857 -179.894 . . . . . . . . 3 3 . 1 . 021 nuclear orig core ' B' B ' 343' ' ' GLU . . . . . . . . . . . . . 27.3 tt0 -59.55 -50.7 72.88 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.255 -0.903 . . . . 2.35 110.258 -179.411 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B ' 344' ' ' LEU . . . . . 0.403 ' CD2' ' CD2' ' A' ' 344' ' ' LEU . 40.0 mt -61.38 -29.82 70.15 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.127 -0.983 . . . . 1.05 109.929 -179.537 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' B' B ' 345' ' ' ASN . . . . . 0.402 ' O ' ' HG3' ' B' ' 349' ' ' GLU . 29.2 t-20 -57.58 -57.0 14.67 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.245 -0.909 . . . . 1.35 110.017 -179.688 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' B' B ' 346' ' ' GLU . . . . . . . . . . . . . 71.0 tt0 -61.5 -29.4 69.96 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.214 -0.928 . . . . 1.66 110.246 -179.395 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B ' 347' ' ' ALA . . . . . . . . . . . . . . . -60.28 -55.78 29.56 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.136 -0.978 . . . . 1.02 110.061 -179.516 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B ' 348' ' ' LEU . . . . . 0.506 ' N ' HD23 ' B' ' 348' ' ' LEU . 4.2 mm? -61.82 -44.59 96.56 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.203 -0.936 . . . . 1.05 110.005 -179.468 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' B' B ' 349' ' ' GLU . . . . . 0.402 ' HG3' ' O ' ' B' ' 345' ' ' ASN . 56.4 mt-10 -57.38 -35.78 70.42 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.172 -0.955 . . . . 1.95 109.946 -179.471 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' B' B ' 350' ' ' LEU . . . . . 0.478 HD21 HD21 ' A' ' 350' ' ' LEU . 6.1 tt -64.4 -40.28 95.48 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.269 -0.894 . . . . 1.18 109.791 -179.826 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' B' B ' 351' ' ' LYS . . . . . . . . . . . . . 2.3 ttmt -57.87 -56.55 20.48 Favored 'General case' 0 N--CA 1.489 1.525 0 O-C-N 121.192 -0.943 . . . . 1.96 109.915 -179.595 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B ' 352' ' ' ASP . . . . . . . . . . . . . 11.5 m-20 -56.69 -37.35 70.75 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.178 -0.951 . . . . 1.16 109.791 -179.882 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B ' 353' ' ' ALA . . . . . . . . . . . . . . . -67.33 -26.28 66.42 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.208 -0.933 . . . . 1.21 110.049 -179.513 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B ' 354' ' ' GLN . . . . . 0.456 ' NE2' HD12 ' A' ' 350' ' ' LEU . 0.1 OUTLIER . . . . . 0 N--CA 1.491 1.594 0 O-C-N 121.05 -1.031 . . . . 1.69 109.936 -179.59 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' C' C ' 326' ' ' GLU . . . . . . . . . . . . . 2.3 mt-10 . . . . . 0 N--CA 1.489 1.51 0 CA-C-O 121.412 0.625 . . . . 2.17 109.555 . . . . . . . . . 0 0 . 1 . 021 nuclear orig core ' C' C ' 327' ' ' TYR . . . . . 0.406 ' CE2' ' CG ' ' A' ' 333' ' ' ARG . 37.2 m-85 -149.11 114.21 5.47 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.446 -0.784 . . . . 1.03 109.463 179.809 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' C' C ' 328' ' ' PHE . . . . . 0.505 ' CZ ' ' HB2' ' A' ' 335' ' ' ARG . 77.0 m-85 -112.56 -170.54 1.68 Allowed 'General case' 0 N--CA 1.487 1.42 0 O-C-N 121.269 -0.895 . . . . 0.37 108.951 179.677 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' C' C ' 329' ' ' THR . . . . . . . . . . . . . 5.0 p -153.42 170.25 21.17 Favored 'General case' 0 C--N 1.301 -1.512 0 O-C-N 121.27 -0.894 . . . . 1.04 109.226 179.957 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' C' C ' 330' ' ' LEU . . . . . . . . . . . . . 49.5 tp -149.12 134.49 18.44 Favored 'General case' 0 C--N 1.303 -1.454 0 O-C-N 121.213 -0.929 . . . . 1.09 109.325 -179.77 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' C' C ' 331' ' ' GLN . . . . . 0.472 ' NE2' ' O ' ' A' ' 328' ' ' PHE . 57.8 tp60 -84.95 107.17 16.96 Favored 'General case' 0 N--CA 1.489 1.475 0 O-C-N 121.337 -0.852 . . . . 1.48 109.187 -179.994 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' C' C ' 332' ' ' ILE . . . . . . . . . . . . . 64.2 mt -103.05 100.39 10.31 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.505 0 O-C-N 121.162 -0.961 . . . . 1.08 109.424 -179.897 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' C' C ' 333' ' ' ARG . . . . . 0.579 ' HG2' ' CE1' ' A' ' 327' ' ' TYR . 89.2 mtt180 -72.57 159.09 34.46 Favored 'General case' 0 N--CA 1.488 1.456 0 O-C-N 121.311 -0.868 . . . . 3.36 109.289 179.725 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' C' C ' 334' ' ' GLY . . . . . . . . . . . . . . . 72.58 129.13 0.11 Allowed Glycine 0 N--CA 1.491 2.36 0 N-CA-C 109.39 -1.484 . . . . 0.35 109.39 -179.788 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' C' C ' 335' ' ' ARG . . . . . 0.485 ' HA ' ' CE1' ' A' ' 328' ' ' PHE . 10.1 ttm180 -78.08 -30.89 49.86 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.245 -1.15 . . . . 3.23 109.889 -179.769 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' C' C ' 336' ' ' GLU . . . . . . . . . . . . . 1.5 tt0 -58.95 -63.82 1.16 Allowed 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.227 -0.921 . . . . 2.62 110.087 -179.591 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' C' C ' 337' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -59.09 -26.11 64.37 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.155 -0.965 . . . . 3.61 109.802 -179.43 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' C' C ' 338' ' ' PHE . . . . . 0.431 ' HB3' ' O ' ' C' ' 335' ' ' ARG . 81.3 t80 -54.78 -61.12 2.52 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.152 -0.968 . . . . 0.43 109.662 -179.944 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' C' C ' 339' ' ' GLU . . . . . . . . . . . . . 22.9 mt-10 -50.97 -31.59 18.38 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.301 -0.874 . . . . 2.05 109.995 -179.669 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' C' C ' 340' ' ' MET . . . . . . . . . . . . . 34.6 ttp -63.47 -52.85 59.6 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.173 -0.954 . . . . 1.1 109.916 -179.564 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' C' C ' 341' ' ' PHE . . . . . . . . . . . . . 48.9 m-85 -62.08 -42.26 99.02 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.153 -0.967 . . . . 0.21 109.848 -179.58 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' C' C ' 342' ' ' ARG . . . . . 0.441 ' NH1' ' CG ' ' C' ' 342' ' ' ARG . 0.2 OUTLIER -49.94 -45.39 51.19 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.358 -0.839 . . . . 3.42 110.177 -179.574 . . . . . . . . 3 3 . 1 . 021 nuclear orig core ' C' C ' 343' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -57.82 -48.71 78.97 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.137 -0.977 . . . . 2.14 110.025 -179.332 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' C' C ' 344' ' ' LEU . . . . . . . . . . . . . 32.3 mt -62.69 -31.94 72.93 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.2 -0.938 . . . . 1.09 110.132 -179.549 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' C' C ' 345' ' ' ASN . . . . . . . . . . . . . 20.4 t-20 -57.63 -58.62 7.5 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.213 -0.929 . . . . 1.38 109.57 -179.665 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' C' C ' 346' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -61.36 -26.08 67.59 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.317 -0.865 . . . . 2.21 109.669 -179.875 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' C' C ' 347' ' ' ALA . . . . . . . . . . . . . . . -60.42 -58.63 7.7 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.173 -0.954 . . . . 1.03 109.772 -179.984 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' C' C ' 348' ' ' LEU . . . . . 0.46 ' N ' ' CD2' ' C' ' 348' ' ' LEU . 4.3 mm? -62.23 -40.54 96.47 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.237 -0.915 . . . . 1.06 109.86 -179.658 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' C' C ' 349' ' ' GLU . . . . . . . . . . . . . 68.0 mm-40 -57.46 -37.09 72.31 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.186 -0.946 . . . . 2.19 109.726 -179.63 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' C' C ' 350' ' ' LEU . . . . . 0.523 ' CD1' HD21 ' D' ' 350' ' ' LEU . 5.3 tt -63.02 -38.79 92.62 Favored 'General case' 0 N--CA 1.489 1.481 0 O-C-N 121.109 -0.994 . . . . 1.2 109.065 179.929 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' C' C ' 351' ' ' LYS . . . . . . . . . . . . . 20.3 tttt -60.15 -37.12 79.15 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.351 -0.843 . . . . 1.92 109.164 179.765 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' C' C ' 352' ' ' ASP . . . . . . . . . . . . . 8.5 m-20 -56.93 -41.91 79.07 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.31 -0.869 . . . . 1.19 109.539 179.926 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' C' C ' 353' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 1.54 0 O-C-N 121.272 -0.892 . . . . 1.15 109.575 -179.897 . . . . . . . . 0 0 . 1 . 021 nuclear orig core ' D' D ' 326' ' ' GLU . . . . . . . . . . . . . 7.3 mt-10 . . . . . 0 N--CA 1.488 1.47 0 CA-C-O 121.324 0.583 . . . . 2.13 109.655 . . . . . . . . . 0 0 . 1 . 021 nuclear orig core ' D' D ' 327' ' ' TYR . . . . . 0.595 ' CE1' ' CG ' ' B' ' 333' ' ' ARG . 41.2 m-85 -149.96 115.52 5.53 Favored 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.354 -0.841 . . . . 1.0 109.422 -179.973 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' D' D ' 328' ' ' PHE . . . . . 0.515 ' CZ ' ' HB2' ' B' ' 335' ' ' ARG . 76.4 m-85 -113.49 -170.71 1.74 Allowed 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.317 -0.864 . . . . 0.34 109.313 179.934 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' D' D ' 329' ' ' THR . . . . . 0.481 ' HA ' ' O ' ' B' ' 330' ' ' LEU . 26.9 p -153.74 167.79 28.44 Favored 'General case' 0 N--CA 1.489 1.499 0 O-C-N 121.221 -0.924 . . . . 1.05 109.428 179.986 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' D' D ' 330' ' ' LEU . . . . . 0.473 ' O ' ' HA ' ' B' ' 329' ' ' THR . 14.7 tp -148.95 126.12 11.41 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.193 -0.942 . . . . 1.07 109.478 -179.946 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' D' D ' 331' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -86.28 111.52 20.52 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.218 -0.926 . . . . 0.93 109.55 -179.976 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' D' D ' 332' ' ' ILE . . . . . . . . . . . . . 31.8 mt -103.6 110.54 30.29 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.532 0 O-C-N 121.176 -0.953 . . . . 1.07 109.573 179.827 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' D' D ' 333' ' ' ARG . . . . . 0.534 ' CG ' ' CE1' ' B' ' 327' ' ' TYR . 2.4 mpt_? -72.69 143.22 48.16 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.313 -0.867 . . . . 3.42 109.239 179.847 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' D' D ' 334' ' ' GLY . . . . . . . . . . . . . . . 84.21 129.91 1.86 Allowed Glycine 0 N--CA 1.49 2.274 0 N-CA-C 109.539 -1.425 . . . . 0.41 109.539 -179.856 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' D' D ' 335' ' ' ARG . . . . . 0.495 ' HB2' ' CZ ' ' B' ' 328' ' ' PHE . 6.1 ttm180 -78.79 -28.65 44.63 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.193 -1.18 . . . . 3.58 109.6 -179.949 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' D' D ' 336' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -56.53 -67.17 0.33 Allowed 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.201 -0.937 . . . . 2.26 109.881 -179.779 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' D' D ' 337' ' ' ARG . . . . . 0.421 HH11 ' HG2' ' D' ' 337' ' ' ARG . 0.8 OUTLIER -60.53 -25.79 66.39 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.216 -0.927 . . . . 3.64 109.651 -179.669 . . . . . . . . 3 3 . 1 . 021 nuclear orig core ' D' D ' 338' ' ' PHE . . . . . 0.423 ' HB3' ' O ' ' D' ' 335' ' ' ARG . 67.8 t80 -55.47 -60.53 3.29 Favored 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.124 -0.985 . . . . 0.4 109.628 -179.968 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' D' D ' 339' ' ' GLU . . . . . . . . . . . . . 77.2 mt-10 -51.35 -31.84 23.51 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.305 -0.872 . . . . 1.99 109.998 -179.725 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' D' D ' 340' ' ' MET . . . . . . . . . . . . . 9.4 ttp -63.25 -52.65 61.24 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.132 -0.98 . . . . 1.13 109.959 -179.604 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' D' D ' 341' ' ' PHE . . . . . . . . . . . . . 48.6 m-85 -61.57 -41.86 98.01 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.183 -0.948 . . . . 0.21 109.786 -179.633 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' D' D ' 342' ' ' ARG . . . . . 0.498 ' NH1' ' HG2' ' D' ' 342' ' ' ARG . 0.0 OUTLIER -50.72 -41.96 56.76 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.241 -0.912 . . . . 3.15 109.845 -179.809 . . . . . . . . 3 3 . 1 . 021 nuclear orig core ' D' D ' 343' ' ' GLU . . . . . . . . . . . . . 28.3 tt0 -59.54 -50.56 73.44 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.258 -0.901 . . . . 2.35 110.251 -179.478 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' D' D ' 344' ' ' LEU . . . . . . . . . . . . . 40.3 mt -61.47 -29.85 70.22 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.143 -0.973 . . . . 1.06 109.834 -179.463 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' D' D ' 345' ' ' ASN . . . . . 0.41 ' O ' ' HG3' ' D' ' 349' ' ' GLU . 29.3 t-20 -57.59 -57.02 14.53 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.173 -0.954 . . . . 1.35 110.002 -179.659 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' D' D ' 346' ' ' GLU . . . . . . . . . . . . . 70.6 tt0 -61.47 -29.56 70.04 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.182 -0.949 . . . . 1.69 110.203 -179.427 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' D' D ' 347' ' ' ALA . . . . . . . . . . . . . . . -60.07 -55.69 30.89 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.059 -1.026 . . . . 1.03 110.096 -179.562 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' D' D ' 348' ' ' LEU . . . . . 0.509 ' N ' HD23 ' D' ' 348' ' ' LEU . 4.2 mm? -62.07 -44.43 96.69 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.234 -0.916 . . . . 1.04 110.074 -179.409 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' D' D ' 349' ' ' GLU . . . . . 0.41 ' HG3' ' O ' ' D' ' 345' ' ' ASN . 56.9 mt-10 -57.64 -35.65 70.79 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.209 -0.932 . . . . 1.95 109.953 -179.479 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' D' D ' 350' ' ' LEU . . . . . 0.523 HD21 ' CD1' ' C' ' 350' ' ' LEU . 6.1 tt -64.49 -40.07 94.98 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.211 -0.93 . . . . 1.16 109.736 -179.847 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' D' D ' 351' ' ' LYS . . . . . . . . . . . . . 2.3 ttmt -58.02 -56.35 23.2 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.282 -0.886 . . . . 1.97 109.829 -179.633 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' D' D ' 352' ' ' ASP . . . . . . . . . . . . . 11.9 m-20 -56.97 -37.33 71.42 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.145 -0.972 . . . . 1.17 109.773 -179.769 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' D' D ' 353' ' ' ALA . . . . . . . . . . . . . . . -67.4 -26.26 66.35 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.226 -0.921 . . . . 1.21 110.065 -179.493 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' D' D ' 354' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.491 1.619 0 O-C-N 121.042 -1.036 . . . . 1.68 109.915 -179.723 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 326' ' ' GLU . . . . . . . . . . . . . 7.1 mt-10 . . . . . 0 N--CA 1.49 1.537 0 N-CA-C 109.404 -0.591 . . . . 2.13 109.404 . . . . . . . . . 0 0 . 1 . 022 nuclear orig core ' A' A ' 327' ' ' TYR . . . . . 0.592 ' CE1' ' HG2' ' C' ' 333' ' ' ARG . 45.4 m-85 -149.85 112.28 4.71 Favored 'General case' 0 N--CA 1.489 1.491 0 O-C-N 121.249 -0.907 . . . . 1.0 109.838 -179.997 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 328' ' ' PHE . . . . . . . . . . . . . 75.5 m-85 -113.71 -173.85 2.35 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.341 -0.85 . . . . 0.34 109.171 179.709 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 329' ' ' THR . . . . . . . . . . . . . 73.2 p -153.38 164.21 38.56 Favored 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.184 -0.948 . . . . 1.05 109.268 -179.891 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 330' ' ' LEU . . . . . . . . . . . . . 15.4 tp -149.74 125.93 10.7 Favored 'General case' 0 N--CA 1.488 1.46 0 O-C-N 121.207 -0.933 . . . . 1.07 109.666 -179.853 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 331' ' ' GLN . . . . . . . . . . . . . 1.6 tt0 -87.4 114.44 24.01 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.302 -0.874 . . . . 0.91 109.321 179.817 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 332' ' ' ILE . . . . . . . . . . . . . 57.9 mt -103.37 104.42 16.62 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.592 0 O-C-N 121.261 -0.9 . . . . 1.09 109.739 -179.867 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 333' ' ' ARG . . . . . . . . . . . . . 9.9 mtm180 -72.05 139.17 48.36 Favored 'General case' 0 N--CA 1.488 1.456 0 O-C-N 121.322 -0.861 . . . . 3.41 109.246 179.64 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 334' ' ' GLY . . . . . . . . . . . . . . . 92.89 131.53 5.77 Favored Glycine 0 N--CA 1.49 2.298 0 N-CA-C 109.407 -1.477 . . . . 0.4 109.407 -179.789 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 335' ' ' ARG . . . . . . . . . . . . . 2.0 ttt180 -78.21 -32.92 50.19 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.303 -1.116 . . . . 3.55 109.488 -179.855 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 336' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -58.17 -61.5 2.52 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.133 -0.979 . . . . 2.29 109.696 -179.895 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 337' ' ' ARG . . . . . . . . . . . . . 5.3 mtt180 -60.45 -34.56 74.18 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.173 -0.955 . . . . 3.64 109.705 -179.889 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 338' ' ' PHE . . . . . . . . . . . . . 78.8 t80 -54.05 -60.45 3.32 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.222 -0.924 . . . . 0.41 109.631 -179.704 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 339' ' ' GLU . . . . . . . . . . . . . 95.7 mt-10 -50.89 -33.88 25.94 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.216 -0.928 . . . . 1.97 109.999 -179.615 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 340' ' ' MET . . . . . . . . . . . . . 32.2 ttp -64.01 -50.98 66.36 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.068 -1.02 . . . . 1.14 110.063 -179.635 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 341' ' ' PHE . . . . . . . . . . . . . 37.1 m-85 -61.57 -47.56 84.94 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.128 -0.983 . . . . 0.21 109.78 -179.497 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 342' ' ' ARG . . . . . . . . . . . . . 1.4 ttt180 -49.46 -39.4 33.3 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.173 -0.954 . . . . 3.15 109.598 -179.913 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 343' ' ' GLU . . . . . . . . . . . . . 2.7 tt0 -58.51 -49.47 77.28 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.14 -0.975 . . . . 2.35 109.437 -179.95 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 344' ' ' LEU . . . . . 0.444 ' CD2' HD21 ' B' ' 344' ' ' LEU . 73.9 mt -62.3 -29.7 70.62 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.278 -0.889 . . . . 1.06 109.334 179.824 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 345' ' ' ASN . . . . . . . . . . . . . 11.2 t-20 -57.77 -54.17 49.92 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.323 -0.861 . . . . 1.36 109.581 179.907 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 346' ' ' GLU . . . . . . . . . . . . . 1.2 tp10 -62.13 -28.68 69.81 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.279 -0.888 . . . . 1.65 109.785 -179.768 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 347' ' ' ALA . . . . . . . . . . . . . . . -61.76 -62.2 1.97 Allowed 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.116 -0.99 . . . . 1.03 110.032 -179.632 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 348' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -61.36 -44.61 96.87 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.259 -0.901 . . . . 1.04 110.112 -179.369 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 349' ' ' GLU . . . . . . . . . . . . . 3.1 mt-10 -56.9 -35.77 69.36 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.188 -0.945 . . . . 1.94 109.83 -179.388 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 350' ' ' LEU . . . . . 0.551 HD21 ' CD1' ' B' ' 350' ' ' LEU . 5.9 tt -64.93 -45.67 84.84 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.243 -0.91 . . . . 1.17 109.669 -179.962 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 351' ' ' LYS . . . . . . . . . . . . . 22.0 tttt -59.06 -41.21 87.39 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.246 -0.909 . . . . 1.97 109.303 -179.983 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 352' ' ' ASP . . . . . . . . . . . . . 11.9 m-20 -56.39 -50.22 72.22 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.33 -0.856 . . . . 1.16 109.494 179.855 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 353' ' ' ALA . . . . . . . . . . . . . . . -68.63 -15.8 63.64 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.375 -0.828 . . . . 1.22 109.566 179.987 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 354' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.491 1.6 0 O-C-N 121.21 -0.931 . . . . 1.71 109.58 -179.968 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 326' ' ' GLU . . . . . . . . . . . . . 7.2 mt-10 . . . . . 0 N--CA 1.49 1.55 0 CA-C-O 121.317 0.58 . . . . 2.13 109.536 . . . . . . . . . 0 0 . 1 . 022 nuclear orig core ' B' B ' 327' ' ' TYR . . . . . . . . . . . . . 44.2 m-85 -149.76 112.26 4.73 Favored 'General case' 0 N--CA 1.489 1.493 0 O-C-N 121.272 -0.893 . . . . 0.99 109.732 -179.97 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 328' ' ' PHE . . . . . 0.475 ' CB ' ' CD1' ' D' ' 338' ' ' PHE . 75.8 m-85 -113.74 -173.72 2.33 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.323 -0.861 . . . . 0.36 109.146 179.676 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' B' B ' 329' ' ' THR . . . . . . . . . . . . . 71.6 p -153.47 164.51 38.07 Favored 'General case' 0 N--CA 1.488 1.429 0 O-C-N 121.272 -0.892 . . . . 1.05 109.363 179.921 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 330' ' ' LEU . . . . . . . . . . . . . 15.8 tp -149.89 126.47 10.93 Favored 'General case' 0 C--N 1.302 -1.457 0 O-C-N 121.215 -0.928 . . . . 1.07 109.556 -179.842 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 331' ' ' GLN . . . . . . . . . . . . . 1.6 tt0 -87.85 114.6 24.62 Favored 'General case' 0 N--CA 1.489 1.493 0 O-C-N 121.258 -0.901 . . . . 0.91 109.276 179.829 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 332' ' ' ILE . . . . . . . . . . . . . 57.8 mt -103.41 104.59 16.9 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.493 0 O-C-N 121.217 -0.927 . . . . 1.08 109.709 -179.878 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 333' ' ' ARG . . . . . . . . . . . . . 10.3 mtm180 -72.25 139.06 47.9 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.237 -0.914 . . . . 3.42 109.12 179.717 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 334' ' ' GLY . . . . . . . . . . . . . . . 92.94 131.94 5.93 Favored Glycine 0 N--CA 1.491 2.326 0 N-CA-C 109.392 -1.483 . . . . 0.4 109.392 -179.776 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 335' ' ' ARG . . . . . 0.45 ' HA ' ' CE1' ' D' ' 328' ' ' PHE . 2.0 ttt180 -78.53 -32.93 48.21 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.209 -1.171 . . . . 3.55 109.587 -179.855 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' B' B ' 336' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -58.08 -61.75 2.32 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.235 -0.916 . . . . 2.28 109.633 -179.983 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' B' B ' 337' ' ' ARG . . . . . . . . . . . . . 5.0 mtt180 -60.2 -34.79 74.11 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.242 -0.911 . . . . 3.64 109.695 -179.756 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 338' ' ' PHE . . . . . 0.502 ' CD1' ' HB2' ' D' ' 328' ' ' PHE . 79.9 t80 -53.87 -60.55 3.18 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.319 -0.863 . . . . 0.39 109.763 -179.833 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' B' B ' 339' ' ' GLU . . . . . . . . . . . . . 95.0 mt-10 -50.94 -33.76 25.8 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.233 -0.917 . . . . 1.98 110.114 -179.632 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 340' ' ' MET . . . . . . . . . . . . . 32.7 ttp -64.34 -50.44 67.77 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.101 -0.999 . . . . 1.14 109.975 -179.607 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 341' ' ' PHE . . . . . . . . . . . . . 37.4 m-85 -61.87 -47.2 86.06 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.174 -0.954 . . . . 0.22 110.0 -179.69 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 342' ' ' ARG . . . . . . . . . . . . . 1.5 ttt180 -49.84 -39.3 38.53 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.155 -0.966 . . . . 3.15 109.605 179.947 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 343' ' ' GLU . . . . . . . . . . . . . 2.7 tt0 -58.52 -49.68 76.49 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.292 -0.88 . . . . 2.35 109.352 -179.991 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 344' ' ' LEU . . . . . 0.444 HD21 ' CD2' ' A' ' 344' ' ' LEU . 74.6 mt -62.25 -29.59 70.51 Favored 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.298 -0.876 . . . . 1.05 109.295 179.884 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' B' B ' 345' ' ' ASN . . . . . . . . . . . . . 11.4 t-20 -57.96 -54.07 51.04 Favored 'General case' 0 N--CA 1.488 1.472 0 O-C-N 121.283 -0.886 . . . . 1.35 109.462 -179.946 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 346' ' ' GLU . . . . . . . . . . . . . 1.2 tp10 -62.15 -28.93 69.99 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.287 -0.883 . . . . 1.66 109.765 -179.75 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 347' ' ' ALA . . . . . . . . . . . . . . . -61.76 -61.85 2.21 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.191 -0.943 . . . . 1.02 110.209 -179.625 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 348' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -61.66 -44.56 96.73 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.151 -0.968 . . . . 1.05 110.074 -179.445 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 349' ' ' GLU . . . . . . . . . . . . . 3.1 mt-10 -56.7 -35.98 69.13 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.167 -0.958 . . . . 1.95 109.848 -179.444 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 350' ' ' LEU . . . . . 0.551 ' CD1' HD21 ' A' ' 350' ' ' LEU . 6.0 tt -64.72 -45.78 85.08 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.177 -0.952 . . . . 1.18 109.596 -179.946 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' B' B ' 351' ' ' LYS . . . . . . . . . . . . . 22.1 tttt -58.93 -41.21 86.81 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.365 -0.834 . . . . 1.96 109.283 -179.922 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 352' ' ' ASP . . . . . . . . . . . . . 12.1 m-20 -56.28 -50.45 71.34 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.31 -0.869 . . . . 1.16 109.422 179.862 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 353' ' ' ALA . . . . . . . . . . . . . . . -68.68 -15.63 63.58 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.287 -0.883 . . . . 1.21 109.501 -179.909 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 354' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.49 1.571 0 O-C-N 121.193 -0.942 . . . . 1.69 109.561 -179.957 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' C' C ' 326' ' ' GLU . . . . . . . . . . . . . 3.6 mp0 . . . . . 0 N--CA 1.489 1.505 0 N-CA-C 109.355 -0.609 . . . . 2.17 109.355 . . . . . . . . . 0 0 . 1 . 022 nuclear orig core ' C' C ' 327' ' ' TYR . . . . . . . . . . . . . 38.4 m-85 -150.18 105.56 3.38 Favored 'General case' 0 N--CA 1.488 1.451 0 O-C-N 121.234 -0.916 . . . . 1.03 110.085 179.922 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' C' C ' 328' ' ' PHE . . . . . . . . . . . . . 87.8 m-85 -113.97 -174.42 2.47 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.455 -0.778 . . . . 0.37 108.94 179.531 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' C' C ' 329' ' ' THR . . . . . . . . . . . . . 19.8 p -151.55 164.41 36.89 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.108 -0.995 . . . . 1.04 109.466 -179.942 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' C' C ' 330' ' ' LEU . . . . . . . . . . . . . 15.1 tp -150.86 130.52 13.12 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.151 -0.968 . . . . 1.09 109.824 -179.742 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' C' C ' 331' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -88.51 112.48 23.05 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.342 -0.849 . . . . 1.48 109.394 179.691 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' C' C ' 332' ' ' ILE . . . . . 0.47 HD12 ' CD2' ' C' ' 341' ' ' PHE . 64.5 mt -103.68 102.81 14.22 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.653 0 O-C-N 121.138 -0.976 . . . . 1.08 109.994 -179.83 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' C' C ' 333' ' ' ARG . . . . . 0.592 ' HG2' ' CE1' ' A' ' 327' ' ' TYR . 2.4 mtp180 -72.69 156.32 39.07 Favored 'General case' 0 N--CA 1.488 1.47 0 O-C-N 121.262 -0.899 . . . . 3.36 109.201 179.518 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' C' C ' 334' ' ' GLY . . . . . . . . . . . . . . . 80.06 128.92 0.75 Allowed Glycine 0 N--CA 1.491 2.329 0 N-CA-C 109.66 -1.376 . . . . 0.35 109.66 179.856 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' C' C ' 335' ' ' ARG . . . . . . . . . . . . . 20.8 ttt180 -79.28 -33.03 43.76 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.401 -1.058 . . . . 3.23 109.508 -179.999 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' C' C ' 336' ' ' GLU . . . . . 0.457 ' HA ' ' OE1' ' C' ' 339' ' ' GLU . 0.0 OUTLIER -58.08 -62.05 2.1 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.189 -0.944 . . . . 2.62 109.773 -179.781 . . . . . . . . 3 3 . 1 . 022 nuclear orig core ' C' C ' 337' ' ' ARG . . . . . 0.553 ' HG2' ' NH1' ' C' ' 337' ' ' ARG . 0.1 OUTLIER -59.85 -30.88 69.26 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.235 -0.916 . . . . 3.61 109.843 -179.672 . . . . . . . . 3 3 . 1 . 022 nuclear orig core ' C' C ' 338' ' ' PHE . . . . . . . . . . . . . 72.4 t80 -55.53 -54.87 38.59 Favored 'General case' 0 N--CA 1.488 1.457 0 O-C-N 121.158 -0.963 . . . . 0.43 109.681 -179.911 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' C' C ' 339' ' ' GLU . . . . . 0.457 ' OE1' ' HA ' ' C' ' 336' ' ' GLU . 3.0 mt-10 -52.58 -39.24 61.37 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.204 -0.935 . . . . 2.05 110.325 -179.582 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' C' C ' 340' ' ' MET . . . . . . . . . . . . . 36.3 ttp -62.35 -46.25 89.53 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.157 -0.965 . . . . 1.1 110.0 -179.334 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' C' C ' 341' ' ' PHE . . . . . 0.47 ' CD2' HD12 ' C' ' 332' ' ' ILE . 32.7 m-85 -63.14 -43.22 98.95 Favored 'General case' 0 N--CA 1.489 1.5 0 O-C-N 121.174 -0.954 . . . . 0.21 110.021 -179.609 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' C' C ' 342' ' ' ARG . . . . . . . . . . . . . 39.7 ttt180 -51.96 -42.92 63.26 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.216 -0.927 . . . . 3.42 110.028 -179.773 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' C' C ' 343' ' ' GLU . . . . . . . . . . . . . 2.5 tt0 -57.32 -48.27 79.4 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.145 -0.972 . . . . 2.14 109.461 -179.649 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' C' C ' 344' ' ' LEU . . . . . 0.457 HD23 HD23 ' D' ' 344' ' ' LEU . 37.0 mt -62.96 -30.55 71.66 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.205 -0.935 . . . . 1.09 109.357 179.866 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' C' C ' 345' ' ' ASN . . . . . 0.439 ' O ' ' HG3' ' C' ' 349' ' ' GLU . 18.1 t-20 -59.07 -61.35 2.7 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.311 -0.868 . . . . 1.38 109.687 -179.829 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' C' C ' 346' ' ' GLU . . . . . . . . . . . . . 17.0 tp10 -61.22 -25.69 67.23 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.317 -0.864 . . . . 2.21 109.866 -179.608 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' C' C ' 347' ' ' ALA . . . . . . . . . . . . . . . -61.39 -58.34 8.6 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.215 -0.928 . . . . 1.03 109.987 -179.697 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' C' C ' 348' ' ' LEU . . . . . 0.512 HD23 ' N ' ' C' ' 348' ' ' LEU . 3.8 mm? -62.4 -44.39 96.56 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.208 -0.932 . . . . 1.06 110.147 -179.288 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' C' C ' 349' ' ' GLU . . . . . 0.439 ' HG3' ' O ' ' C' ' 345' ' ' ASN . 22.0 mt-10 -56.08 -38.6 70.91 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.141 -0.974 . . . . 2.19 109.887 -179.32 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' C' C ' 350' ' ' LEU . . . . . 0.527 ' CD1' HD21 ' D' ' 350' ' ' LEU . 6.1 tt -62.78 -40.37 97.11 Favored 'General case' 0 N--CA 1.489 1.493 0 O-C-N 121.156 -0.965 . . . . 1.2 109.537 -179.739 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' C' C ' 351' ' ' LYS . . . . . . . . . . . . . 11.3 tttt -60.19 -39.98 88.4 Favored 'General case' 0 N--CA 1.489 1.482 0 O-C-N 121.235 -0.915 . . . . 1.92 109.585 179.999 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' C' C ' 352' ' ' ASP . . . . . 0.456 ' OD1' ' N ' ' C' ' 352' ' ' ASP . 4.6 m-20 -59.25 -42.36 90.95 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.249 -0.907 . . . . 1.19 109.763 -179.99 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' C' C ' 353' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 1.651 0 O-C-N 121.251 -0.906 . . . . 1.15 110.081 -179.358 . . . . . . . . 0 0 . 1 . 022 nuclear orig core ' D' D ' 326' ' ' GLU . . . . . . . . . . . . . 6.9 mt-10 . . . . . 0 N--CA 1.491 1.578 0 N-CA-C 109.485 -0.561 . . . . 2.13 109.485 . . . . . . . . . 0 0 . 1 . 022 nuclear orig core ' D' D ' 327' ' ' TYR . . . . . . . . . . . . . 44.5 m-85 -150.0 112.45 4.71 Favored 'General case' 0 N--CA 1.489 1.485 0 O-C-N 121.23 -0.919 . . . . 1.0 109.737 -179.935 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' D' D ' 328' ' ' PHE . . . . . 0.502 ' HB2' ' CD1' ' B' ' 338' ' ' PHE . 75.3 m-85 -113.78 -173.55 2.3 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.377 -0.827 . . . . 0.34 109.173 179.673 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' D' D ' 329' ' ' THR . . . . . . . . . . . . . 67.3 p -153.41 164.4 38.23 Favored 'General case' 0 N--CA 1.488 1.445 0 O-C-N 121.249 -0.907 . . . . 1.05 109.28 179.987 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' D' D ' 330' ' ' LEU . . . . . . . . . . . . . 15.4 tp -150.04 125.96 10.5 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.218 -0.926 . . . . 1.07 109.551 -179.837 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' D' D ' 331' ' ' GLN . . . . . . . . . . . . . 1.5 tt0 -87.24 114.7 24.08 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.367 -0.833 . . . . 0.93 109.327 179.799 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' D' D ' 332' ' ' ILE . . . . . . . . . . . . . 58.2 mt -103.3 104.55 16.82 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.514 0 O-C-N 121.089 -1.007 . . . . 1.07 109.741 -179.912 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' D' D ' 333' ' ' ARG . . . . . . . . . . . . . 10.4 mtm180 -72.34 138.67 47.46 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.176 -0.953 . . . . 3.42 109.243 179.728 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' D' D ' 334' ' ' GLY . . . . . . . . . . . . . . . 92.93 131.1 5.63 Favored Glycine 0 N--CA 1.49 2.3 0 N-CA-C 109.482 -1.447 . . . . 0.41 109.482 -179.78 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' D' D ' 335' ' ' ARG . . . . . 0.436 ' HA ' ' CE1' ' B' ' 328' ' ' PHE . 2.0 ttt180 -77.33 -33.15 55.55 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.225 -1.162 . . . . 3.58 109.675 -179.858 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' D' D ' 336' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -58.13 -61.13 2.78 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.129 -0.982 . . . . 2.26 109.722 -179.79 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' D' D ' 337' ' ' ARG . . . . . . . . . . . . . 5.4 mtt180 -60.97 -34.11 74.25 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.296 -0.878 . . . . 3.64 109.61 -179.812 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' D' D ' 338' ' ' PHE . . . . . 0.475 ' CD1' ' CB ' ' B' ' 328' ' ' PHE . 80.3 t80 -54.3 -60.41 3.37 Favored 'General case' 0 N--CA 1.488 1.453 0 O-C-N 121.221 -0.925 . . . . 0.4 109.725 -179.777 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' D' D ' 339' ' ' GLU . . . . . . . . . . . . . 94.2 mt-10 -51.15 -33.47 27.06 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.3 -0.875 . . . . 1.99 110.039 -179.673 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' D' D ' 340' ' ' MET . . . . . . . . . . . . . 33.1 ttp -64.45 -50.76 66.26 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.082 -1.011 . . . . 1.13 109.931 -179.587 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' D' D ' 341' ' ' PHE . . . . . . . . . . . . . 36.9 m-85 -61.56 -47.23 86.47 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.168 -0.957 . . . . 0.21 109.868 -179.525 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' D' D ' 342' ' ' ARG . . . . . . . . . . . . . 1.5 ttt180 -49.92 -39.49 40.33 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.157 -0.964 . . . . 3.15 109.558 -179.902 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' D' D ' 343' ' ' GLU . . . . . . . . . . . . . 2.8 tt0 -58.28 -49.8 75.87 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.294 -0.879 . . . . 2.35 109.398 -179.998 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' D' D ' 344' ' ' LEU . . . . . 0.457 HD23 HD23 ' C' ' 344' ' ' LEU . 75.9 mt -62.25 -29.5 70.44 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.184 -0.948 . . . . 1.06 109.293 179.761 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' D' D ' 345' ' ' ASN . . . . . . . . . . . . . 11.3 t-20 -58.0 -54.37 47.72 Favored 'General case' 0 C--N 1.303 -1.414 0 O-C-N 121.398 -0.813 . . . . 1.35 109.45 179.968 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' D' D ' 346' ' ' GLU . . . . . . . . . . . . . 1.2 tt0 -61.81 -29.06 69.9 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.308 -0.87 . . . . 1.69 109.827 -179.857 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' D' D ' 347' ' ' ALA . . . . . . . . . . . . . . . -61.73 -62.01 2.11 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.201 -0.937 . . . . 1.03 110.122 -179.66 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' D' D ' 348' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -61.52 -44.71 96.57 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.159 -0.963 . . . . 1.04 110.119 -179.394 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' D' D ' 349' ' ' GLU . . . . . . . . . . . . . 3.1 mt-10 -56.64 -35.54 68.46 Favored 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.13 -0.982 . . . . 1.95 109.859 -179.507 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' D' D ' 350' ' ' LEU . . . . . 0.527 HD21 ' CD1' ' C' ' 350' ' ' LEU . 6.0 tt -65.02 -45.75 84.17 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.154 -0.966 . . . . 1.16 109.576 -179.865 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' D' D ' 351' ' ' LYS . . . . . . . . . . . . . 21.8 tttt -59.03 -41.09 86.96 Favored 'General case' 0 C--N 1.304 -1.404 0 O-C-N 121.258 -0.901 . . . . 1.97 109.381 -179.877 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' D' D ' 352' ' ' ASP . . . . . . . . . . . . . 11.7 m-20 -56.38 -50.47 71.46 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.328 -0.858 . . . . 1.17 109.484 179.886 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' D' D ' 353' ' ' ALA . . . . . . . . . . . . . . . -68.68 -15.4 63.51 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.232 -0.918 . . . . 1.21 109.543 -179.953 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' D' D ' 354' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.49 1.564 0 O-C-N 121.154 -0.966 . . . . 1.68 109.52 -179.991 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 326' ' ' GLU . . . . . . . . . . . . . 59.2 mm-40 . . . . . 0 N--CA 1.488 1.475 0 N-CA-C 108.945 -0.761 . . . . 2.13 108.945 . . . . . . . . . 0 0 . 1 . 023 nuclear orig core ' A' A ' 327' ' ' TYR . . . . . 0.516 ' CE2' ' HG2' ' C' ' 333' ' ' ARG . 38.4 m-85 -148.64 105.36 3.57 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.169 -0.957 . . . . 1.0 109.634 179.697 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 328' ' ' PHE . . . . . . . . . . . . . 98.2 m-85 -107.33 -166.92 1.2 Allowed 'General case' 0 C--N 1.303 -1.445 0 N-CA-C 108.851 -0.796 . . . . 0.34 108.851 179.68 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 329' ' ' THR . . . . . . . . . . . . . 68.1 p -151.07 164.71 35.82 Favored 'General case' 0 C--N 1.301 -1.517 0 O-C-N 121.139 -0.976 . . . . 1.05 109.27 -179.984 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 330' ' ' LEU . . . . . . . . . . . . . 16.1 tp -148.76 131.77 16.25 Favored 'General case' 0 C--N 1.302 -1.474 0 O-C-N 121.236 -0.915 . . . . 1.07 109.377 -179.635 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 331' ' ' GLN . . . . . . . . . . . . . 1.6 tp60 -85.87 113.97 22.43 Favored 'General case' 0 N--CA 1.488 1.464 0 O-C-N 121.388 -0.82 . . . . 0.91 109.151 179.955 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 332' ' ' ILE . . . . . . . . . . . . . 53.9 mt -102.83 102.23 13.31 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.497 0 O-C-N 121.295 -0.878 . . . . 1.09 109.38 -179.827 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 333' ' ' ARG . . . . . . . . . . . . . 79.9 mtt180 -72.18 154.64 40.93 Favored 'General case' 0 N--CA 1.489 1.479 0 O-C-N 121.343 -0.848 . . . . 3.41 109.37 179.992 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 334' ' ' GLY . . . . . . . . . . . . . . . 80.07 134.24 1.23 Allowed Glycine 0 N--CA 1.491 2.339 0 N-CA-C 109.598 -1.401 . . . . 0.4 109.598 -179.86 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 335' ' ' ARG . . . . . 0.52 ' NH1' ' HG2' ' A' ' 335' ' ' ARG . 1.3 ttt-85 -79.93 -50.58 10.24 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.271 -1.135 . . . . 3.55 109.83 -179.782 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 336' ' ' GLU . . . . . . . . . . . . . 1.4 pt-20 -55.61 -48.29 75.13 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.179 -0.95 . . . . 2.29 109.611 -179.689 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 337' ' ' ARG . . . . . 0.442 ' NH1' ' CG ' ' A' ' 337' ' ' ARG . 0.0 OUTLIER -60.1 -35.08 74.44 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.209 -0.932 . . . . 3.64 109.474 179.97 . . . . . . . . 3 3 . 1 . 023 nuclear orig core ' A' A ' 338' ' ' PHE . . . . . . . . . . . . . 61.9 t80 -55.64 -55.69 29.19 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.321 -0.862 . . . . 0.41 109.531 179.998 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 339' ' ' GLU . . . . . . . . . . . . . 3.6 mm-40 -51.03 -32.68 22.34 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.339 -0.851 . . . . 1.97 110.118 -179.547 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 340' ' ' MET . . . . . . . . . . . . . 19.5 ttp -64.36 -52.92 55.95 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.151 -0.968 . . . . 1.14 110.198 -179.425 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 341' ' ' PHE . . . . . . . . . . . . . 39.8 m-85 -62.46 -46.08 90.14 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.195 -0.941 . . . . 0.21 110.208 -179.274 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 342' ' ' ARG . . . . . . . . . . . . . 10.0 ttp180 -48.51 -41.19 29.24 Favored 'General case' 0 N--CA 1.491 1.625 0 O-C-N 121.061 -1.025 . . . . 3.15 109.813 -179.827 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 343' ' ' GLU . . . . . . . . . . . . . 9.1 tp10 -59.31 -45.46 91.23 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.259 -0.901 . . . . 2.35 109.967 -179.709 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 344' ' ' LEU . . . . . 0.467 ' O ' HD21 ' A' ' 348' ' ' LEU . 53.1 mt -62.77 -44.64 95.66 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.256 -0.903 . . . . 1.06 110.024 -179.704 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 345' ' ' ASN . . . . . . . . . . . . . 54.7 t-20 -55.38 -49.52 72.12 Favored 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.172 -0.955 . . . . 1.36 109.872 -179.823 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 346' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -61.06 -36.16 78.86 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.243 -0.91 . . . . 1.65 109.585 -179.812 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 347' ' ' ALA . . . . . . . . . . . . . . . -60.14 -50.06 75.19 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.235 -0.915 . . . . 1.03 109.962 -179.806 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 348' ' ' LEU . . . . . 0.467 HD21 ' O ' ' A' ' 344' ' ' LEU . 3.6 mm? -62.24 -48.95 77.67 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.124 -0.985 . . . . 1.04 109.87 -179.63 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 349' ' ' GLU . . . . . . . . . . . . . 76.3 mt-10 -55.53 -35.41 65.63 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.162 -0.961 . . . . 1.94 109.7 -179.479 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 350' ' ' LEU . . . . . 0.519 HD21 ' CD1' ' B' ' 350' ' ' LEU . 5.6 tt -62.91 -45.3 93.17 Favored 'General case' 0 N--CA 1.488 1.472 0 O-C-N 121.266 -0.896 . . . . 1.17 109.216 179.843 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 351' ' ' LYS . . . . . . . . . . . . . 19.1 tttm -56.37 -38.66 71.74 Favored 'General case' 0 N--CA 1.488 1.469 0 O-C-N 121.365 -0.834 . . . . 1.97 109.481 179.982 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 352' ' ' ASP . . . . . . . . . . . . . 4.7 m-20 -55.61 -45.97 77.39 Favored 'General case' 0 N--CA 1.489 1.495 0 O-C-N 121.223 -0.923 . . . . 1.16 109.429 179.784 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 353' ' ' ALA . . . . . . . . . . . . . . . -67.98 -28.26 67.28 Favored 'General case' 0 N--CA 1.489 1.494 0 O-C-N 121.309 -0.869 . . . . 1.22 109.172 179.734 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 354' ' ' GLN . . . . . . . . . . . . . 3.2 tt0 . . . . . 0 N--CA 1.49 1.541 0 O-C-N 121.321 -0.862 . . . . 1.71 109.471 179.756 . . . . . . . . 0 0 . 1 . 023 nuclear orig core ' B' B ' 326' ' ' GLU . . . . . . . . . . . . . 60.4 mm-40 . . . . . 0 N--CA 1.487 1.38 0 N-CA-C 108.96 -0.756 . . . . 2.13 108.96 . . . . . . . . . 0 0 . 1 . 023 nuclear orig core ' B' B ' 327' ' ' TYR . . . . . 0.448 ' CE2' ' HG2' ' D' ' 333' ' ' ARG . 39.2 m-85 -148.35 105.4 3.61 Favored 'General case' 0 C--N 1.301 -1.517 0 O-C-N 121.156 -0.965 . . . . 0.99 109.614 179.846 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' B' B ' 328' ' ' PHE . . . . . . . . . . . . . 98.2 m-85 -107.54 -166.91 1.19 Allowed 'General case' 0 N--CA 1.488 1.455 0 N-CA-C 108.772 -0.825 . . . . 0.36 108.772 179.752 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' B' B ' 329' ' ' THR . . . . . . . . . . . . . 69.7 p -151.04 164.89 35.39 Favored 'General case' 0 C--N 1.301 -1.52 0 O-C-N 121.151 -0.968 . . . . 1.05 109.235 -179.988 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' B' B ' 330' ' ' LEU . . . . . . . . . . . . . 15.7 tp -148.95 131.6 15.9 Favored 'General case' 0 C--N 1.303 -1.445 0 O-C-N 121.189 -0.945 . . . . 1.07 109.386 -179.689 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' B' B ' 331' ' ' GLN . . . . . . . . . . . . . 1.6 tp60 -85.62 113.87 22.17 Favored 'General case' 0 C--N 1.303 -1.432 0 O-C-N 121.347 -0.845 . . . . 0.91 109.203 179.943 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' B' B ' 332' ' ' ILE . . . . . . . . . . . . . 52.4 mt -102.68 102.57 13.78 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.484 0 O-C-N 121.172 -0.955 . . . . 1.08 109.44 -179.967 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' B' B ' 333' ' ' ARG . . . . . 0.404 ' HG2' ' CE2' ' D' ' 327' ' ' TYR . 80.2 mtt180 -72.39 154.71 40.76 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.458 -0.776 . . . . 3.42 109.434 -179.911 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' B' B ' 334' ' ' GLY . . . . . . . . . . . . . . . 79.85 134.54 1.21 Allowed Glycine 0 N--CA 1.491 2.316 0 N-CA-C 109.437 -1.465 . . . . 0.4 109.437 -179.899 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' B' B ' 335' ' ' ARG . . . . . 0.525 ' HG2' ' NH1' ' B' ' 335' ' ' ARG . 1.4 ttt-85 -80.15 -50.37 10.38 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.287 -1.125 . . . . 3.55 109.868 -179.866 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' B' B ' 336' ' ' GLU . . . . . . . . . . . . . 1.3 pt-20 -55.54 -48.12 75.23 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.218 -0.926 . . . . 2.28 109.644 -179.715 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' B' B ' 337' ' ' ARG . . . . . 0.441 ' CG ' ' NH1' ' B' ' 337' ' ' ARG . 0.0 OUTLIER -60.27 -35.22 75.03 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.199 -0.938 . . . . 3.64 109.453 179.966 . . . . . . . . 3 3 . 1 . 023 nuclear orig core ' B' B ' 338' ' ' PHE . . . . . . . . . . . . . 62.3 t80 -55.55 -55.95 25.96 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.246 -0.909 . . . . 0.39 109.563 -179.998 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' B' B ' 339' ' ' GLU . . . . . . . . . . . . . 3.5 mm-40 -50.92 -32.37 20.49 Favored 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.233 -0.917 . . . . 1.98 110.113 -179.6 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' B' B ' 340' ' ' MET . . . . . . . . . . . . . 19.4 ttp -64.56 -52.97 54.88 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.146 -0.972 . . . . 1.14 110.155 -179.457 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' B' B ' 341' ' ' PHE . . . . . . . . . . . . . 40.1 m-85 -62.56 -46.07 90.01 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.166 -0.959 . . . . 0.22 110.254 -179.246 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' B' B ' 342' ' ' ARG . . . . . . . . . . . . . 10.1 ttp180 -48.46 -41.13 28.64 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.046 -1.034 . . . . 3.15 109.771 -179.752 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' B' B ' 343' ' ' GLU . . . . . . . . . . . . . 9.2 tp10 -59.35 -45.55 91.09 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.238 -0.914 . . . . 2.35 109.908 -179.668 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' B' B ' 344' ' ' LEU . . . . . 0.461 ' O ' HD21 ' B' ' 348' ' ' LEU . 49.2 mt -62.91 -44.57 95.72 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.288 -0.883 . . . . 1.05 109.968 -179.607 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' B' B ' 345' ' ' ASN . . . . . . . . . . . . . 55.7 t-20 -55.4 -49.68 71.75 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.22 -0.925 . . . . 1.35 109.685 -179.704 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' B' B ' 346' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -60.81 -36.16 78.34 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.215 -0.928 . . . . 1.66 109.599 -179.773 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' B' B ' 347' ' ' ALA . . . . . . . . . . . . . . . -60.34 -49.92 75.68 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.153 -0.967 . . . . 1.02 109.926 -179.816 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' B' B ' 348' ' ' LEU . . . . . 0.461 HD21 ' O ' ' B' ' 344' ' ' LEU . 3.7 mm? -62.25 -49.04 77.28 Favored 'General case' 0 N--CA 1.493 1.692 0 O-C-N 121.182 -0.949 . . . . 1.05 109.834 -179.67 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' B' B ' 349' ' ' GLU . . . . . . . . . . . . . 77.5 mt-10 -55.43 -35.58 65.57 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.251 -0.906 . . . . 1.95 109.642 -179.479 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' B' B ' 350' ' ' LEU . . . . . 0.519 ' CD1' HD21 ' A' ' 350' ' ' LEU . 5.7 tt -62.88 -45.18 93.76 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.255 -0.903 . . . . 1.18 109.247 179.905 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' B' B ' 351' ' ' LYS . . . . . . . . . . . . . 19.2 tttm -56.38 -38.64 71.73 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.309 -0.869 . . . . 1.96 109.412 179.922 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' B' B ' 352' ' ' ASP . . . . . . . . . . . . . 4.9 m-20 -55.6 -46.03 77.36 Favored 'General case' 0 N--CA 1.489 1.482 0 O-C-N 121.211 -0.931 . . . . 1.16 109.38 179.866 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' B' B ' 353' ' ' ALA . . . . . . . . . . . . . . . -67.96 -27.88 66.97 Favored 'General case' 0 N--CA 1.489 1.497 0 O-C-N 121.251 -0.906 . . . . 1.21 109.179 179.684 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' B' B ' 354' ' ' GLN . . . . . . . . . . . . . 3.1 tt0 . . . . . 0 N--CA 1.489 1.518 0 O-C-N 121.343 -0.848 . . . . 1.69 109.466 179.747 . . . . . . . . 0 0 . 1 . 023 nuclear orig core ' C' C ' 326' ' ' GLU . . . . . . . . . . . . . 2.3 mp0 . . . . . 0 N--CA 1.489 1.491 0 N-CA-C 109.057 -0.72 . . . . 2.17 109.057 . . . . . . . . . 0 0 . 1 . 023 nuclear orig core ' C' C ' 327' ' ' TYR . . . . . . . . . . . . . 38.7 m-85 -148.88 108.1 3.92 Favored 'General case' 0 C--N 1.302 -1.467 0 O-C-N 121.121 -0.987 . . . . 1.03 109.865 179.973 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' C' C ' 328' ' ' PHE . . . . . 0.414 ' CE1' ' HA ' ' A' ' 335' ' ' ARG . 88.8 m-85 -112.55 -166.71 1.1 Allowed 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.457 -0.777 . . . . 0.37 108.929 179.743 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' C' C ' 329' ' ' THR . . . . . . . . . . . . . 21.2 p -152.67 165.09 36.36 Favored 'General case' 0 N--CA 1.489 1.48 0 O-C-N 121.089 -1.007 . . . . 1.04 109.608 179.966 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' C' C ' 330' ' ' LEU . . . . . . . . . . . . . 51.5 tp -150.68 126.18 10.16 Favored 'General case' 0 N--CA 1.488 1.453 0 O-C-N 121.258 -0.901 . . . . 1.09 109.448 179.77 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' C' C ' 331' ' ' GLN . . . . . . . . . . . . . 4.4 tp-100 -86.74 117.37 25.45 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.325 -0.859 . . . . 1.48 109.3 179.883 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' C' C ' 332' ' ' ILE . . . . . . . . . . . . . 21.8 mt -103.49 110.12 28.99 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.554 0 O-C-N 121.119 -0.988 . . . . 1.08 109.684 179.949 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' C' C ' 333' ' ' ARG . . . . . 0.516 ' HG2' ' CE2' ' A' ' 327' ' ' TYR . 11.8 mtm180 -73.71 143.44 46.17 Favored 'General case' 0 N--CA 1.488 1.469 0 O-C-N 121.174 -0.954 . . . . 3.36 109.046 179.355 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' C' C ' 334' ' ' GLY . . . . . . . . . . . . . . . 90.16 134.67 5.71 Favored Glycine 0 N--CA 1.489 2.219 0 N-CA-C 109.618 -1.393 . . . . 0.35 109.618 179.931 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' C' C ' 335' ' ' ARG . . . . . 0.486 ' NH1' ' CG ' ' C' ' 335' ' ' ARG . 0.0 OUTLIER -79.49 -46.09 18.09 Favored 'General case' 0 N--CA 1.488 1.466 0 O-C-N 121.374 -1.074 . . . . 3.23 109.752 -179.939 . . . . . . . . 3 3 . 1 . 023 nuclear orig core ' C' C ' 336' ' ' GLU . . . . . . . . . . . . . 3.8 mt-10 -57.34 -48.52 78.79 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.274 -0.891 . . . . 2.62 109.687 -179.747 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' C' C ' 337' ' ' ARG . . . . . . . . . . . . . 1.9 mtp180 -59.31 -34.93 72.91 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.36 -0.837 . . . . 3.61 109.788 -179.712 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' C' C ' 338' ' ' PHE . . . . . . . . . . . . . 51.4 t80 -55.81 -54.06 49.14 Favored 'General case' 0 N--CA 1.489 1.501 0 O-C-N 121.219 -0.926 . . . . 0.43 110.296 -179.65 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' C' C ' 339' ' ' GLU . . . . . . . . . . . . . 7.9 mt-10 -51.27 -34.71 34.04 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.186 -0.946 . . . . 2.05 110.705 -179.161 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' C' C ' 340' ' ' MET . . . . . . . . . . . . . 38.1 ttp -64.78 -55.02 22.28 Favored 'General case' 0 N--CA 1.493 1.722 0 O-C-N 120.962 -1.087 . . . . 1.1 110.626 -179.094 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' C' C ' 341' ' ' PHE . . . . . . . . . . . . . 49.3 m-85 -59.87 -44.8 93.98 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.143 -0.973 . . . . 0.21 110.126 -179.053 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' C' C ' 342' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -50.24 -42.86 52.52 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.164 -0.96 . . . . 3.42 110.27 -179.562 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' C' C ' 343' ' ' GLU . . . . . . . . . . . . . 1.8 tt0 -58.06 -48.93 78.64 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.154 -0.966 . . . . 2.14 110.072 -179.362 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' C' C ' 344' ' ' LEU . . . . . 0.46 HD23 HD23 ' D' ' 344' ' ' LEU . 66.2 mt -61.79 -36.63 81.65 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.125 -0.984 . . . . 1.09 109.763 -179.714 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' C' C ' 345' ' ' ASN . . . . . . . . . . . . . 23.0 t-20 -57.89 -57.19 13.89 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.228 -0.92 . . . . 1.38 109.785 -179.814 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' C' C ' 346' ' ' GLU . . . . . . . . . . . . . 2.0 tm-20 -60.6 -29.3 69.13 Favored 'General case' 0 N--CA 1.489 1.525 0 O-C-N 121.291 -0.881 . . . . 2.21 109.752 -179.651 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' C' C ' 347' ' ' ALA . . . . . . . . . . . . . . . -62.08 -52.93 61.91 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.289 -0.882 . . . . 1.03 109.934 -179.864 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' C' C ' 348' ' ' LEU . . . . . 0.516 HD23 ' N ' ' C' ' 348' ' ' LEU . 3.8 mm? -61.26 -52.33 65.19 Favored 'General case' 0 N--CA 1.492 1.675 0 O-C-N 121.223 -0.923 . . . . 1.06 109.915 -179.487 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' C' C ' 349' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -56.57 -31.64 64.41 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.217 -0.927 . . . . 2.19 109.588 -179.568 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' C' C ' 350' ' ' LEU . . . . . 0.551 ' CD2' ' CD1' ' D' ' 350' ' ' LEU . 10.0 tt -64.92 -44.2 90.33 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.236 -0.915 . . . . 1.2 109.24 179.816 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' C' C ' 351' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -57.53 -40.84 79.67 Favored 'General case' 0 N--CA 1.488 1.47 0 O-C-N 121.466 -0.771 . . . . 1.92 109.128 179.878 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' C' C ' 352' ' ' ASP . . . . . . . . . . . . . 30.0 m-20 -57.56 -34.71 69.47 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.358 -0.839 . . . . 1.19 109.352 179.7 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' C' C ' 353' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 1.605 0 O-C-N 121.334 -0.854 . . . . 1.15 109.53 -179.857 . . . . . . . . 0 0 . 1 . 023 nuclear orig core ' D' D ' 326' ' ' GLU . . . . . . . . . . . . . 61.6 mm-40 . . . . . 0 N--CA 1.486 1.37 0 N-CA-C 108.87 -0.789 . . . . 2.13 108.87 . . . . . . . . . 0 0 . 1 . 023 nuclear orig core ' D' D ' 327' ' ' TYR . . . . . 0.404 ' CE2' ' HG2' ' B' ' 333' ' ' ARG . 38.7 m-85 -148.88 105.4 3.54 Favored 'General case' 0 C--N 1.301 -1.525 0 O-C-N 121.151 -0.968 . . . . 1.0 109.57 179.874 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' D' D ' 328' ' ' PHE . . . . . . . . . . . . . 98.1 m-85 -107.47 -166.92 1.2 Allowed 'General case' 0 C--N 1.302 -1.464 0 N-CA-C 108.953 -0.758 . . . . 0.34 108.953 179.815 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' D' D ' 329' ' ' THR . . . . . . . . . . . . . 66.8 p -151.24 164.54 36.36 Favored 'General case' 0 C--N 1.301 -1.539 0 O-C-N 121.204 -0.935 . . . . 1.05 109.212 -179.965 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' D' D ' 330' ' ' LEU . . . . . . . . . . . . . 15.8 tp -148.68 131.52 16.09 Favored 'General case' 0 C--N 1.302 -1.475 0 O-C-N 121.192 -0.943 . . . . 1.07 109.437 -179.557 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' D' D ' 331' ' ' GLN . . . . . . . . . . . . . 1.6 tp60 -85.43 114.22 22.31 Favored 'General case' 0 C--N 1.303 -1.429 0 O-C-N 121.338 -0.852 . . . . 0.93 109.167 179.868 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' D' D ' 332' ' ' ILE . . . . . . . . . . . . . 53.0 mt -102.98 102.52 13.73 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.513 0 O-C-N 121.272 -0.892 . . . . 1.07 109.38 -179.962 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' D' D ' 333' ' ' ARG . . . . . 0.448 ' HG2' ' CE2' ' B' ' 327' ' ' TYR . 80.5 mtt180 -72.46 154.88 40.63 Favored 'General case' 0 N--CA 1.489 1.477 0 O-C-N 121.256 -0.903 . . . . 3.42 109.517 -179.9 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' D' D ' 334' ' ' GLY . . . . . . . . . . . . . . . 79.6 134.57 1.14 Allowed Glycine 0 N--CA 1.49 2.262 0 N-CA-C 109.512 -1.435 . . . . 0.41 109.512 -179.918 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' D' D ' 335' ' ' ARG . . . . . 0.532 ' HG2' ' NH1' ' D' ' 335' ' ' ARG . 1.4 ttt-85 -80.0 -50.4 10.45 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.208 -1.172 . . . . 3.58 109.79 -179.731 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' D' D ' 336' ' ' GLU . . . . . . . . . . . . . 1.2 pt-20 -55.38 -48.11 74.81 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.178 -0.951 . . . . 2.26 109.631 -179.618 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' D' D ' 337' ' ' ARG . . . . . 0.442 ' NH1' ' CG ' ' D' ' 337' ' ' ARG . 0.0 OUTLIER -60.41 -34.98 74.72 Favored 'General case' 0 N--CA 1.489 1.488 0 O-C-N 121.137 -0.977 . . . . 3.64 109.507 179.914 . . . . . . . . 3 3 . 1 . 023 nuclear orig core ' D' D ' 338' ' ' PHE . . . . . . . . . . . . . 62.5 t80 -55.55 -56.02 25.12 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.298 -0.876 . . . . 0.4 109.656 179.937 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' D' D ' 339' ' ' GLU . . . . . . . . . . . . . 3.4 mm-40 -51.02 -32.22 20.75 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.199 -0.938 . . . . 1.99 110.163 -179.643 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' D' D ' 340' ' ' MET . . . . . . . . . . . . . 19.3 ttp -64.45 -53.36 49.5 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.162 -0.961 . . . . 1.13 110.175 -179.433 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' D' D ' 341' ' ' PHE . . . . . . . . . . . . . 40.2 m-85 -62.47 -46.37 88.81 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.123 -0.986 . . . . 0.21 110.166 -179.188 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' D' D ' 342' ' ' ARG . . . . . . . . . . . . . 10.7 ttp180 -48.15 -41.13 25.9 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.08 -1.013 . . . . 3.15 109.787 -179.765 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' D' D ' 343' ' ' GLU . . . . . . . . . . . . . 9.3 tp10 -59.25 -45.77 90.3 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.292 -0.88 . . . . 2.35 109.933 -179.697 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' D' D ' 344' ' ' LEU . . . . . 0.46 HD23 HD23 ' C' ' 344' ' ' LEU . 46.3 mt -62.76 -44.56 95.88 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.164 -0.96 . . . . 1.06 110.013 -179.639 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' D' D ' 345' ' ' ASN . . . . . . . . . . . . . 56.5 t-20 -55.37 -49.45 72.25 Favored 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.204 -0.935 . . . . 1.35 109.64 -179.643 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' D' D ' 346' ' ' GLU . . . . . . . . . . . . . 1.1 tt0 -61.15 -35.92 78.38 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.236 -0.915 . . . . 1.69 109.652 -179.878 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' D' D ' 347' ' ' ALA . . . . . . . . . . . . . . . -60.25 -50.25 74.38 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.182 -0.949 . . . . 1.03 109.89 -179.892 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' D' D ' 348' ' ' LEU . . . . . 0.458 HD21 ' O ' ' D' ' 344' ' ' LEU . 3.7 mm? -62.04 -48.96 77.94 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.146 -0.971 . . . . 1.04 109.889 -179.685 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' D' D ' 349' ' ' GLU . . . . . . . . . . . . . 77.2 mt-10 -55.64 -35.04 65.49 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.114 -0.991 . . . . 1.95 109.81 -179.538 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' D' D ' 350' ' ' LEU . . . . . 0.551 ' CD1' ' CD2' ' C' ' 350' ' ' LEU . 5.8 tt -63.38 -44.47 94.65 Favored 'General case' 0 N--CA 1.489 1.479 0 O-C-N 121.267 -0.895 . . . . 1.16 109.233 179.943 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' D' D ' 351' ' ' LYS . . . . . . . . . . . . . 19.2 tttm -57.16 -38.28 73.34 Favored 'General case' 0 N--CA 1.489 1.481 0 O-C-N 121.446 -0.784 . . . . 1.97 109.416 179.879 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' D' D ' 352' ' ' ASP . . . . . . . . . . . . . 5.2 m-20 -55.85 -45.9 78.33 Favored 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.242 -0.911 . . . . 1.17 109.355 179.696 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' D' D ' 353' ' ' ALA . . . . . . . . . . . . . . . -68.04 -27.94 66.96 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.201 -0.937 . . . . 1.21 109.179 179.67 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' D' D ' 354' ' ' GLN . . . . . 0.455 ' NE2' ' CD1' ' C' ' 350' ' ' LEU . 3.1 tt0 . . . . . 0 N--CA 1.49 1.564 0 O-C-N 121.392 -0.818 . . . . 1.68 109.49 179.791 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 326' ' ' GLU . . . . . . . . . . . . . 2.2 mm-40 . . . . . 0 N--CA 1.492 1.653 0 CA-C-O 121.31 0.576 . . . . 2.13 109.627 . . . . . . . . . 0 0 . 1 . 024 nuclear orig core ' A' A ' 327' ' ' TYR . . . . . 0.516 ' CE1' ' HG2' ' C' ' 333' ' ' ARG . 43.2 m-85 -149.83 112.18 4.69 Favored 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.297 -0.877 . . . . 1.0 109.737 179.889 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 328' ' ' PHE . . . . . 0.502 ' CE1' ' HA ' ' C' ' 335' ' ' ARG . 71.0 m-85 -113.93 -168.81 1.4 Allowed 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.252 -0.905 . . . . 0.34 109.187 179.69 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 329' ' ' THR . . . . . . . . . . . . . 40.3 p -154.58 167.54 29.77 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.2 -0.938 . . . . 1.05 109.451 -179.992 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 330' ' ' LEU . . . . . . . . . . . . . 24.2 tp -150.37 131.42 14.36 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.254 -0.904 . . . . 1.07 109.477 -179.888 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 331' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -87.13 111.94 21.44 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.3 -0.875 . . . . 0.91 109.436 179.861 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 332' ' ' ILE . . . . . 0.443 HD12 ' HB2' ' A' ' 341' ' ' PHE . 97.0 mt -103.56 104.03 16.07 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.592 0 O-C-N 121.232 -0.918 . . . . 1.09 109.529 -179.986 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 333' ' ' ARG . . . . . 0.584 ' HG2' ' CE2' ' C' ' 327' ' ' TYR . 13.3 mtp180 -72.53 149.99 43.59 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.259 -0.9 . . . . 3.41 109.479 179.868 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 334' ' ' GLY . . . . . . . . . . . . . . . 86.37 131.14 2.86 Favored Glycine 0 N--CA 1.493 2.438 0 N-CA-C 109.84 -1.304 . . . . 0.4 109.84 179.606 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 335' ' ' ARG . . . . . 0.443 ' O ' ' HB3' ' A' ' 338' ' ' PHE . 0.0 OUTLIER -80.26 -39.07 29.66 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.33 -1.1 . . . . 3.55 109.586 179.874 . . . . . . . . 3 3 . 1 . 024 nuclear orig core ' A' A ' 336' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -57.99 -61.74 2.32 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.17 -0.956 . . . . 2.29 110.106 -179.561 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 337' ' ' ARG . . . . . 0.483 ' NH1' ' HG2' ' A' ' 337' ' ' ARG . 0.0 OUTLIER -59.96 -26.37 65.94 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.137 -0.977 . . . . 3.64 109.788 -179.509 . . . . . . . . 3 3 . 1 . 024 nuclear orig core ' A' A ' 338' ' ' PHE . . . . . 0.443 ' HB3' ' O ' ' A' ' 335' ' ' ARG . 50.8 t80 -55.67 -58.6 7.13 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.149 -0.969 . . . . 0.41 109.732 -179.869 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 339' ' ' GLU . . . . . . . . . . . . . 55.9 mt-10 -50.71 -32.94 20.97 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.269 -0.894 . . . . 1.97 109.876 -179.653 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 340' ' ' MET . . . . . . . . . . . . . 23.0 ttp -63.56 -51.19 66.44 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.107 -0.996 . . . . 1.14 110.044 -179.509 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 341' ' ' PHE . . . . . 0.443 ' HB2' HD12 ' A' ' 332' ' ' ILE . 36.7 m-85 -62.0 -45.84 91.85 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.166 -0.959 . . . . 0.21 110.081 -179.557 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 342' ' ' ARG . . . . . 0.466 ' NH1' ' HG3' ' A' ' 342' ' ' ARG . 0.0 OUTLIER -49.58 -42.55 44.78 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.14 -0.975 . . . . 3.15 110.047 -179.499 . . . . . . . . 3 3 . 1 . 024 nuclear orig core ' A' A ' 343' ' ' GLU . . . . . . . . . . . . . 1.6 tt0 -58.61 -47.93 82.69 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.099 -1.0 . . . . 2.35 109.817 -179.57 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 344' ' ' LEU . . . . . 0.586 ' CD2' ' CD2' ' B' ' 344' ' ' LEU . 50.3 mt -61.39 -33.28 73.4 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.163 -0.961 . . . . 1.06 109.536 -179.794 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 345' ' ' ASN . . . . . . . . . . . . . 21.6 t-20 -57.82 -59.25 5.52 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.249 -0.907 . . . . 1.36 109.807 -179.944 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 346' ' ' GLU . . . . . . . . . . . . . 72.4 tt0 -62.16 -28.19 69.48 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.284 -0.885 . . . . 1.65 110.136 -179.592 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 347' ' ' ALA . . . . . . . . . . . . . . . -60.71 -56.91 15.64 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.11 -0.994 . . . . 1.03 110.006 -179.64 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 348' ' ' LEU . . . . . 0.513 ' N ' HD23 ' A' ' 348' ' ' LEU . 4.0 mm? -61.92 -46.49 89.13 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.13 -0.981 . . . . 1.04 110.134 -179.56 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 349' ' ' GLU . . . . . . . . . . . . . 33.3 mm-40 -57.17 -33.22 67.21 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.196 -0.94 . . . . 1.94 109.973 -179.452 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 350' ' ' LEU . . . . . 0.497 HD23 HD23 ' B' ' 350' ' ' LEU . 5.8 tt -64.66 -48.54 74.4 Favored 'General case' 0 N--CA 1.489 1.482 0 O-C-N 121.133 -0.98 . . . . 1.17 109.516 -179.883 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 351' ' ' LYS . . . . . . . . . . . . . 22.1 tttm -58.1 -39.57 78.98 Favored 'General case' 0 N--CA 1.488 1.469 0 O-C-N 121.343 -0.848 . . . . 1.97 109.413 -179.916 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 352' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -57.82 -52.5 65.21 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.295 -0.878 . . . . 1.16 109.856 179.975 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 353' ' ' ALA . . . . . . . . . . . . . . . -66.47 -10.01 40.04 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.26 -0.9 . . . . 1.22 109.823 -179.547 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 354' ' ' GLN . . . . . . . . . . . . . 2.5 tt0 . . . . . 0 N--CA 1.49 1.548 0 O-C-N 121.132 -0.98 . . . . 1.71 109.692 -179.98 . . . . . . . . 0 0 . 1 . 024 nuclear orig core ' B' B ' 326' ' ' GLU . . . . . . . . . . . . . 2.2 mm-40 . . . . . 0 N--CA 1.492 1.628 0 CA-C-O 121.357 0.599 . . . . 2.13 109.696 . . . . . . . . . 0 0 . 1 . 024 nuclear orig core ' B' B ' 327' ' ' TYR . . . . . 0.585 ' CE1' ' HG2' ' D' ' 333' ' ' ARG . 42.5 m-85 -149.93 112.11 4.64 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.298 -0.876 . . . . 0.99 109.755 179.977 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' B' B ' 328' ' ' PHE . . . . . 0.463 ' CE1' ' HA ' ' D' ' 335' ' ' ARG . 71.3 m-85 -113.81 -168.75 1.39 Allowed 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.242 -0.911 . . . . 0.36 109.252 179.754 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' B' B ' 329' ' ' THR . . . . . . . . . . . . . 40.1 p -154.6 167.3 30.59 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.269 -0.894 . . . . 1.05 109.379 179.981 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' B' B ' 330' ' ' LEU . . . . . . . . . . . . . 24.2 tp -150.25 131.29 14.35 Favored 'General case' 0 N--CA 1.489 1.497 0 O-C-N 121.158 -0.964 . . . . 1.07 109.483 -179.867 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' B' B ' 331' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -87.02 111.95 21.37 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.3 -0.875 . . . . 0.91 109.428 179.927 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' B' B ' 332' ' ' ILE . . . . . 0.441 HD12 ' HB2' ' B' ' 341' ' ' PHE . 97.0 mt -103.51 103.88 15.83 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.534 0 O-C-N 121.226 -0.921 . . . . 1.08 109.602 179.937 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' B' B ' 333' ' ' ARG . . . . . 0.532 ' HG2' ' CE1' ' D' ' 327' ' ' TYR . 12.9 mtp180 -72.5 150.32 43.35 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.364 -0.835 . . . . 3.42 109.544 179.835 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' B' B ' 334' ' ' GLY . . . . . . . . . . . . . . . 86.07 131.0 2.71 Favored Glycine 0 N--CA 1.492 2.41 0 N-CA-C 109.812 -1.315 . . . . 0.4 109.812 179.679 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' B' B ' 335' ' ' ARG . . . . . 0.448 ' O ' ' HB3' ' B' ' 338' ' ' PHE . 0.0 OUTLIER -80.31 -38.85 29.87 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.301 -1.117 . . . . 3.55 109.625 179.905 . . . . . . . . 3 3 . 1 . 024 nuclear orig core ' B' B ' 336' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -58.02 -61.83 2.26 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.21 -0.932 . . . . 2.28 110.056 -179.622 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' B' B ' 337' ' ' ARG . . . . . 0.497 ' HG2' ' NH1' ' B' ' 337' ' ' ARG . 0.0 OUTLIER -59.83 -26.55 65.88 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.067 -1.021 . . . . 3.64 109.818 -179.559 . . . . . . . . 3 3 . 1 . 024 nuclear orig core ' B' B ' 338' ' ' PHE . . . . . 0.448 ' HB3' ' O ' ' B' ' 335' ' ' ARG . 50.5 t80 -55.41 -58.85 6.06 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.11 -0.993 . . . . 0.39 109.692 -179.858 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' B' B ' 339' ' ' GLU . . . . . . . . . . . . . 56.8 mt-10 -50.62 -32.7 19.7 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.348 -0.845 . . . . 1.98 110.045 -179.666 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' B' B ' 340' ' ' MET . . . . . . . . . . . . . 23.9 ttp -63.79 -51.12 66.23 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.126 -0.983 . . . . 1.14 110.013 -179.54 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' B' B ' 341' ' ' PHE . . . . . 0.441 ' HB2' HD12 ' B' ' 332' ' ' ILE . 36.4 m-85 -62.09 -45.84 91.72 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.169 -0.957 . . . . 0.22 109.988 -179.569 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' B' B ' 342' ' ' ARG . . . . . 0.452 ' NH1' ' HG3' ' B' ' 342' ' ' ARG . 0.0 OUTLIER -49.59 -42.67 45.17 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.127 -0.983 . . . . 3.15 110.065 -179.578 . . . . . . . . 3 3 . 1 . 024 nuclear orig core ' B' B ' 343' ' ' GLU . . . . . . . . . . . . . 1.6 tt0 -58.61 -47.95 82.64 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.072 -1.017 . . . . 2.35 109.856 -179.575 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' B' B ' 344' ' ' LEU . . . . . 0.586 ' CD2' ' CD2' ' A' ' 344' ' ' LEU . 50.4 mt -61.32 -33.24 73.28 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.155 -0.966 . . . . 1.05 109.544 -179.848 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' B' B ' 345' ' ' ASN . . . . . . . . . . . . . 21.5 t-20 -57.93 -59.28 5.5 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.225 -0.922 . . . . 1.35 109.731 -179.952 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' B' B ' 346' ' ' GLU . . . . . . . . . . . . . 71.8 tt0 -62.05 -28.53 69.66 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.267 -0.896 . . . . 1.66 110.076 -179.605 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' B' B ' 347' ' ' ALA . . . . . . . . . . . . . . . -60.42 -56.94 15.38 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.09 -1.006 . . . . 1.02 109.992 -179.567 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' B' B ' 348' ' ' LEU . . . . . 0.504 ' N ' HD23 ' B' ' 348' ' ' LEU . 4.0 mm? -61.95 -46.64 88.41 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.179 -0.95 . . . . 1.05 110.131 -179.491 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' B' B ' 349' ' ' GLU . . . . . . . . . . . . . 32.7 mm-40 -56.98 -33.26 66.93 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.133 -0.979 . . . . 1.95 110.092 -179.469 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' B' B ' 350' ' ' LEU . . . . . 0.497 HD23 HD23 ' A' ' 350' ' ' LEU . 5.8 tt -64.65 -48.42 74.86 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.17 -0.956 . . . . 1.18 109.48 -179.919 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' B' B ' 351' ' ' LYS . . . . . . . . . . . . . 22.2 tttm -58.27 -39.33 78.97 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.349 -0.844 . . . . 1.96 109.359 -179.907 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' B' B ' 352' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -58.01 -52.47 65.38 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.313 -0.867 . . . . 1.16 109.88 -179.984 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' B' B ' 353' ' ' ALA . . . . . . . . . . . . . . . -66.55 -9.94 40.09 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.298 -0.877 . . . . 1.21 109.847 -179.56 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' B' B ' 354' ' ' GLN . . . . . . . . . . . . . 2.5 tt0 . . . . . 0 N--CA 1.49 1.547 0 O-C-N 121.125 -0.984 . . . . 1.69 109.621 179.955 . . . . . . . . 0 0 . 1 . 024 nuclear orig core ' C' C ' 326' ' ' GLU . . . . . 0.421 ' O ' ' CD1' ' C' ' 327' ' ' TYR . 30.6 mm-40 . . . . . 0 N--CA 1.491 1.589 0 N-CA-C 109.402 -0.592 . . . . 2.17 109.402 . . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' C' C ' 327' ' ' TYR . . . . . 0.584 ' CE2' ' HG2' ' A' ' 333' ' ' ARG . 44.1 m-85 -149.36 114.31 5.41 Favored 'General case' 0 N--CA 1.488 1.437 0 O-C-N 121.254 -0.904 . . . . 1.03 109.819 -179.878 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' C' C ' 328' ' ' PHE . . . . . 0.439 ' CE2' ' HA ' ' A' ' 335' ' ' ARG . 86.5 m-85 -113.27 -173.54 2.28 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.316 -0.865 . . . . 0.37 109.132 179.595 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' C' C ' 329' ' ' THR . . . . . . . . . . . . . 22.6 p -152.38 165.2 35.74 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.12 -0.987 . . . . 1.04 109.664 -179.851 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' C' C ' 330' ' ' LEU . . . . . . . . . . . . . 14.4 tp -151.32 129.23 11.7 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.339 -0.851 . . . . 1.09 109.508 -179.853 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' C' C ' 331' ' ' GLN . . . . . 0.416 ' OE1' ' HB3' ' A' ' 327' ' ' TYR . 0.0 OUTLIER -89.13 116.56 27.48 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.174 -0.954 . . . . 1.48 109.837 -179.971 . . . . . . . . 3 3 . 1 . 024 nuclear orig core ' C' C ' 332' ' ' ILE . . . . . . . . . . . . . 87.6 mt -104.06 112.36 37.3 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.621 0 O-C-N 121.201 -0.937 . . . . 1.08 109.555 179.661 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' C' C ' 333' ' ' ARG . . . . . 0.516 ' HG2' ' CE1' ' A' ' 327' ' ' TYR . 46.2 mtt180 -72.02 144.04 48.94 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.12 -0.988 . . . . 3.36 109.321 179.711 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' C' C ' 334' ' ' GLY . . . . . . . . . . . . . . . 89.15 128.34 3.27 Favored Glycine 0 N--CA 1.492 2.385 0 N-CA-C 109.48 -1.448 . . . . 0.35 109.48 -179.846 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' C' C ' 335' ' ' ARG . . . . . 0.502 ' HA ' ' CE1' ' A' ' 328' ' ' PHE . 37.1 ttp180 -78.98 -35.59 42.75 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.19 -1.183 . . . . 3.23 109.676 -179.88 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' C' C ' 336' ' ' GLU . . . . . . . . . . . . . 2.0 tt0 -57.0 -60.4 3.64 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.247 -0.908 . . . . 2.62 109.678 -179.808 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' C' C ' 337' ' ' ARG . . . . . 0.435 ' CG ' HH11 ' C' ' 337' ' ' ARG . 0.0 OUTLIER -59.51 -28.31 66.94 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.308 -0.87 . . . . 3.61 109.553 -179.811 . . . . . . . . 3 3 . 1 . 024 nuclear orig core ' C' C ' 338' ' ' PHE . . . . . 0.451 ' HB3' ' O ' ' C' ' 335' ' ' ARG . 58.1 t80 -54.07 -55.37 28.14 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.249 -0.907 . . . . 0.43 109.352 -179.962 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' C' C ' 339' ' ' GLU . . . . . . . . . . . . . 41.5 mt-10 -52.42 -32.08 37.46 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.242 -0.911 . . . . 2.05 109.755 -179.997 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' C' C ' 340' ' ' MET . . . . . 0.423 ' HB3' ' O ' ' C' ' 337' ' ' ARG . 3.8 ttp -63.92 -55.03 25.62 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.227 -0.921 . . . . 1.1 110.285 -179.402 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' C' C ' 341' ' ' PHE . . . . . . . . . . . . . 48.5 m-85 -61.0 -46.16 91.9 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.167 -0.958 . . . . 0.21 109.701 -179.448 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' C' C ' 342' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -47.72 -41.47 22.96 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.287 -0.883 . . . . 3.42 109.278 179.761 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' C' C ' 343' ' ' GLU . . . . . . . . . . . . . 43.3 tt0 -61.17 -48.74 80.18 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.245 -0.909 . . . . 2.14 109.951 -179.869 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' C' C ' 344' ' ' LEU . . . . . 0.461 ' O ' HD21 ' C' ' 348' ' ' LEU . 35.4 mt -60.88 -30.14 69.97 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.135 -0.978 . . . . 1.09 109.828 -179.517 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' C' C ' 345' ' ' ASN . . . . . . . . . . . . . 25.8 t-20 -57.77 -58.31 8.91 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.261 -0.9 . . . . 1.38 109.488 179.879 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' C' C ' 346' ' ' GLU . . . . . 0.416 ' O ' ' HB2' ' C' ' 350' ' ' LEU . 20.1 tt0 -61.67 -25.63 67.51 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.301 -0.875 . . . . 2.21 109.922 -179.71 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' C' C ' 347' ' ' ALA . . . . . 0.46 ' O ' ' HB3' ' C' ' 350' ' ' LEU . . . -62.41 -55.62 26.07 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.106 -0.996 . . . . 1.03 109.715 -179.815 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' C' C ' 348' ' ' LEU . . . . . 0.513 ' N ' ' CD2' ' C' ' 348' ' ' LEU . 4.1 mm? -63.19 -55.91 21.11 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.131 -0.981 . . . . 1.06 109.969 -179.557 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' C' C ' 349' ' ' GLU . . . . . 0.412 ' OE2' ' HD3' ' A' ' 333' ' ' ARG . 41.6 mt-10 -56.61 -25.89 54.23 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.103 -0.998 . . . . 2.19 109.24 -179.782 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' C' C ' 350' ' ' LEU . . . . . 0.548 ' CD1' HD11 ' D' ' 350' ' ' LEU . 0.5 OUTLIER -65.62 -49.45 68.66 Favored 'General case' 0 C--N 1.301 -1.516 0 N-CA-C 108.811 -0.811 . . . . 1.2 108.811 179.813 . . . . . . . . 3 3 . 1 . 024 nuclear orig core ' C' C ' 351' ' ' LYS . . . . . 0.546 ' N ' HD11 ' C' ' 350' ' ' LEU . 6.3 tttt -62.27 -41.95 98.92 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.291 -0.881 . . . . 1.92 109.298 179.319 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' C' C ' 352' ' ' ASP . . . . . . . . . . . . . 43.3 m-20 -56.06 -28.19 56.56 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.341 -0.849 . . . . 1.19 109.836 -179.867 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' C' C ' 353' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 1.638 0 O-C-N 121.227 -0.92 . . . . 1.15 109.78 -179.645 . . . . . . . . 0 0 . 1 . 024 nuclear orig core ' D' D ' 326' ' ' GLU . . . . . . . . . . . . . 2.2 mm-40 . . . . . 0 N--CA 1.491 1.601 0 CA-C-O 121.335 0.588 . . . . 2.13 109.551 . . . . . . . . . 0 0 . 1 . 024 nuclear orig core ' D' D ' 327' ' ' TYR . . . . . 0.532 ' CE1' ' HG2' ' B' ' 333' ' ' ARG . 43.0 m-85 -149.71 112.34 4.76 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.367 -0.833 . . . . 1.0 109.74 179.936 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' D' D ' 328' ' ' PHE . . . . . . . . . . . . . 71.8 m-85 -113.94 -168.68 1.39 Allowed 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.277 -0.889 . . . . 0.34 109.201 179.737 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' D' D ' 329' ' ' THR . . . . . . . . . . . . . 39.5 p -154.59 167.34 30.43 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.19 -0.944 . . . . 1.05 109.41 179.987 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' D' D ' 330' ' ' LEU . . . . . . . . . . . . . 24.6 tp -150.24 131.36 14.43 Favored 'General case' 0 N--CA 1.488 1.472 0 O-C-N 121.239 -0.913 . . . . 1.07 109.512 -179.878 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' D' D ' 331' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -87.13 111.85 21.35 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.351 -0.843 . . . . 0.93 109.434 179.971 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' D' D ' 332' ' ' ILE . . . . . 0.451 HD12 ' HB2' ' D' ' 341' ' ' PHE . 97.0 mt -103.46 103.8 15.7 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.533 0 O-C-N 121.145 -0.972 . . . . 1.07 109.708 179.994 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' D' D ' 333' ' ' ARG . . . . . 0.585 ' HG2' ' CE1' ' B' ' 327' ' ' TYR . 13.2 mtp180 -72.57 150.11 43.42 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.256 -0.903 . . . . 3.42 109.458 179.887 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' D' D ' 334' ' ' GLY . . . . . . . . . . . . . . . 86.31 130.94 2.8 Favored Glycine 0 N--CA 1.491 2.333 0 N-CA-C 109.815 -1.314 . . . . 0.41 109.815 179.723 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' D' D ' 335' ' ' ARG . . . . . 0.463 ' HA ' ' CE1' ' B' ' 328' ' ' PHE . 0.0 OUTLIER -80.28 -38.94 29.83 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.308 -1.113 . . . . 3.58 109.575 179.883 . . . . . . . . 3 3 . 1 . 024 nuclear orig core ' D' D ' 336' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -58.08 -61.79 2.29 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.241 -0.912 . . . . 2.26 110.031 -179.597 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' D' D ' 337' ' ' ARG . . . . . 0.492 ' NH1' ' HG2' ' D' ' 337' ' ' ARG . 0.0 OUTLIER -59.86 -26.38 65.79 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.175 -0.953 . . . . 3.64 109.862 -179.579 . . . . . . . . 3 3 . 1 . 024 nuclear orig core ' D' D ' 338' ' ' PHE . . . . . 0.441 ' HB3' ' O ' ' D' ' 335' ' ' ARG . 51.0 t80 -55.58 -58.7 6.71 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.195 -0.941 . . . . 0.4 109.725 -179.869 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' D' D ' 339' ' ' GLU . . . . . . . . . . . . . 55.6 mt-10 -50.63 -32.7 19.72 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.301 -0.874 . . . . 1.99 110.067 -179.711 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' D' D ' 340' ' ' MET . . . . . . . . . . . . . 23.2 ttp -63.78 -51.18 65.99 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.181 -0.95 . . . . 1.13 110.008 -179.62 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' D' D ' 341' ' ' PHE . . . . . 0.451 ' HB2' HD12 ' D' ' 332' ' ' ILE . 36.6 m-85 -62.01 -45.88 91.66 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.224 -0.922 . . . . 0.21 110.064 -179.55 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' D' D ' 342' ' ' ARG . . . . . 0.45 ' NH1' ' HG3' ' D' ' 342' ' ' ARG . 0.0 OUTLIER -49.58 -42.42 44.39 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.086 -1.009 . . . . 3.15 110.094 -179.513 . . . . . . . . 3 3 . 1 . 024 nuclear orig core ' D' D ' 343' ' ' GLU . . . . . . . . . . . . . 1.6 tt0 -58.81 -47.69 83.93 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.018 -1.051 . . . . 2.35 109.886 -179.538 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' D' D ' 344' ' ' LEU . . . . . . . . . . . . . 49.5 mt -61.59 -33.13 73.35 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.106 -0.996 . . . . 1.06 109.435 -179.776 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' D' D ' 345' ' ' ASN . . . . . . . . . . . . . 21.7 t-20 -58.03 -59.14 5.73 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.299 -0.875 . . . . 1.35 109.716 -179.851 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' D' D ' 346' ' ' GLU . . . . . . . . . . . . . 72.1 tt0 -62.11 -28.61 69.75 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.337 -0.852 . . . . 1.69 110.059 -179.641 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' D' D ' 347' ' ' ALA . . . . . . . . . . . . . . . -60.24 -57.05 14.45 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.084 -1.01 . . . . 1.03 110.063 -179.641 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' D' D ' 348' ' ' LEU . . . . . 0.506 ' N ' HD23 ' D' ' 348' ' ' LEU . 4.0 mm? -61.92 -46.59 88.69 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.246 -0.909 . . . . 1.04 110.106 -179.426 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' D' D ' 349' ' ' GLU . . . . . . . . . . . . . 33.6 mm-40 -56.97 -33.41 67.06 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.187 -0.946 . . . . 1.95 109.964 -179.397 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' D' D ' 350' ' ' LEU . . . . . 0.548 HD11 ' CD1' ' C' ' 350' ' ' LEU . 5.8 tt -64.64 -48.19 75.74 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.15 -0.969 . . . . 1.16 109.666 -179.921 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' D' D ' 351' ' ' LYS . . . . . . . . . . . . . 22.3 tttm -58.43 -39.49 79.94 Favored 'General case' 0 N--CA 1.487 1.414 0 O-C-N 121.24 -0.913 . . . . 1.97 109.349 -179.874 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' D' D ' 352' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -57.97 -52.39 65.72 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.28 -0.887 . . . . 1.17 109.829 179.929 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' D' D ' 353' ' ' ALA . . . . . . . . . . . . . . . -66.58 -9.93 40.33 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.21 -0.931 . . . . 1.21 109.783 -179.483 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' D' D ' 354' ' ' GLN . . . . . . . . . . . . . 2.5 tt0 . . . . . 0 N--CA 1.49 1.569 0 O-C-N 121.134 -0.979 . . . . 1.68 109.613 179.996 . . . . . . . . 0 0 . 1 . 025 nuclear orig core ' A' A ' 326' ' ' GLU . . . . . . . . . . . . . 3.0 mm-40 . . . . . 0 N--CA 1.49 1.551 0 N-CA-C 109.371 -0.603 . . . . 2.13 109.371 . . . . . . . . . 0 0 . 1 . 025 nuclear orig core ' A' A ' 327' ' ' TYR . . . . . 0.424 ' CE1' ' HG2' ' C' ' 333' ' ' ARG . 48.4 m-85 -148.92 106.28 3.63 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.163 -0.96 . . . . 1.0 109.629 -179.919 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 328' ' ' PHE . . . . . . . . . . . . . 68.6 m-85 -112.97 -164.08 0.89 Allowed 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.23 -0.919 . . . . 0.34 109.55 179.834 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 329' ' ' THR . . . . . . . . . . . . . 20.9 p -153.83 173.96 15.21 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.228 -0.92 . . . . 1.05 109.227 179.833 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 330' ' ' LEU . . . . . . . . . . . . . 28.8 tp -152.16 131.95 13.25 Favored 'General case' 0 N--CA 1.489 1.476 0 O-C-N 120.94 -1.1 . . . . 1.07 109.833 -179.891 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 331' ' ' GLN . . . . . 0.402 ' NE2' ' O ' ' C' ' 328' ' ' PHE . 45.4 tp60 -88.97 107.34 18.97 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.354 -0.841 . . . . 0.91 109.192 179.533 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 332' ' ' ILE . . . . . . . . . . . . . 36.9 mt -103.3 107.21 21.64 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.624 0 O-C-N 121.112 -0.993 . . . . 1.09 109.778 -179.792 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 333' ' ' ARG . . . . . 0.575 ' HG2' ' CE2' ' C' ' 327' ' ' TYR . 0.0 OUTLIER -73.45 155.88 38.82 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.39 -0.819 . . . . 3.41 109.393 179.702 . . . . . . . . 3 3 . 1 . 025 nuclear orig core ' A' A ' 334' ' ' GLY . . . . . . . . . . . . . . . 77.13 128.23 0.35 Allowed Glycine 0 N--CA 1.492 2.433 0 N-CA-C 109.898 -1.281 . . . . 0.4 109.898 179.584 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 335' ' ' ARG . . . . . 0.562 ' HG3' ' CE2' ' C' ' 328' ' ' PHE . 1.7 ttt-85 -80.0 -36.1 36.44 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.371 -1.076 . . . . 3.55 109.543 179.862 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 336' ' ' GLU . . . . . . . . . . . . . 2.2 tm-20 -56.22 -64.84 0.73 Allowed 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.27 -0.893 . . . . 2.29 109.723 -179.84 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 337' ' ' ARG . . . . . 0.439 ' NH1' ' CG ' ' A' ' 337' ' ' ARG . 0.0 OUTLIER -60.78 -28.9 69.09 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.339 -0.851 . . . . 3.64 109.542 -179.675 . . . . . . . . 3 3 . 1 . 025 nuclear orig core ' A' A ' 338' ' ' PHE . . . . . . . . . . . . . 52.3 t80 -55.52 -60.17 3.8 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.163 -0.96 . . . . 0.41 109.462 -179.925 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 339' ' ' GLU . . . . . . . . . . . . . 65.0 mm-40 -51.24 -30.09 16.45 Favored 'General case' 0 N--CA 1.488 1.456 0 O-C-N 121.357 -0.839 . . . . 1.97 109.757 -179.903 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 340' ' ' MET . . . . . 0.417 ' HB3' ' O ' ' A' ' 337' ' ' ARG . 7.6 ttp -64.19 -50.45 68.03 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.175 -0.953 . . . . 1.14 109.575 -179.95 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 341' ' ' PHE . . . . . . . . . . . . . 45.5 m-85 -63.0 -45.7 91.14 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.33 -0.856 . . . . 0.21 109.981 -179.703 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 342' ' ' ARG . . . . . . . . . . . . . 5.4 ttm180 -49.29 -40.99 36.82 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.122 -0.986 . . . . 3.15 109.915 -179.535 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 343' ' ' GLU . . . . . . . . . . . . . 1.4 tt0 -58.71 -43.78 90.18 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.145 -0.972 . . . . 2.35 109.806 -179.714 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 344' ' ' LEU . . . . . 0.466 ' O ' HD21 ' A' ' 348' ' ' LEU . 42.9 mt -63.28 -46.15 88.17 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.239 -0.913 . . . . 1.06 109.876 -179.749 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 345' ' ' ASN . . . . . . . . . . . . . 42.3 t-20 -55.61 -46.95 77.27 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.115 -0.991 . . . . 1.36 109.923 -179.481 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 346' ' ' GLU . . . . . . . . . . . . . 1.4 tp10 -60.72 -36.39 78.72 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.179 -0.951 . . . . 1.65 109.776 -179.66 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 347' ' ' ALA . . . . . . . . . . . . . . . -59.4 -51.1 71.37 Favored 'General case' 0 N--CA 1.493 1.692 0 O-C-N 121.222 -0.924 . . . . 1.03 109.944 -179.712 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 348' ' ' LEU . . . . . 0.466 HD21 ' O ' ' A' ' 344' ' ' LEU . 4.1 mm? -61.78 -43.86 98.01 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.237 -0.914 . . . . 1.04 109.658 -179.721 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 349' ' ' GLU . . . . . . . . . . . . . 2.2 mm-40 -59.17 -34.16 71.77 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.199 -0.938 . . . . 1.94 110.244 -179.551 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 350' ' ' LEU . . . . . 0.488 ' O ' HD22 ' A' ' 350' ' ' LEU . 6.7 tt -63.12 -43.72 97.63 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.074 -1.016 . . . . 1.17 109.465 -179.773 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 351' ' ' LYS . . . . . . . . . . . . . 25.5 tttm -56.67 -42.73 79.51 Favored 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.22 -0.925 . . . . 1.97 109.861 -179.679 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 352' ' ' ASP . . . . . . . . . . . . . 36.2 m-20 -58.69 -49.92 75.78 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.186 -0.946 . . . . 1.16 109.817 179.974 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 353' ' ' ALA . . . . . . . . . . . . . . . -67.65 -10.27 50.73 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.27 -0.894 . . . . 1.22 109.534 -179.776 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 354' ' ' GLN . . . . . 0.449 ' NE2' ' CD1' ' B' ' 350' ' ' LEU . 2.9 tt0 . . . . . 0 C--N 1.302 -1.473 0 O-C-N 121.25 -0.906 . . . . 1.71 109.767 -179.917 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' B' B ' 326' ' ' GLU . . . . . . . . . . . . . 3.0 mm-40 . . . . . 0 N--CA 1.488 1.452 0 N-CA-C 109.349 -0.611 . . . . 2.13 109.349 . . . . . . . . . 0 0 . 1 . 025 nuclear orig core ' B' B ' 327' ' ' TYR . . . . . 0.568 ' CE1' ' HG2' ' D' ' 333' ' ' ARG . 47.6 m-85 -148.55 106.16 3.67 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.224 -0.923 . . . . 0.99 109.633 -179.841 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' B' B ' 328' ' ' PHE . . . . . 0.427 ' CZ ' ' HG3' ' D' ' 335' ' ' ARG . 66.7 m-85 -113.22 -164.5 0.92 Allowed 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.287 -0.883 . . . . 0.36 109.546 179.797 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' B' B ' 329' ' ' THR . . . . . . . . . . . . . 20.8 p -153.4 174.41 14.39 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.297 -0.877 . . . . 1.05 109.276 -179.956 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' B' B ' 330' ' ' LEU . . . . . . . . . . . . . 28.3 tp -152.75 131.53 12.41 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.062 -1.024 . . . . 1.07 109.917 -179.826 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' B' B ' 331' ' ' GLN . . . . . 0.43 ' NE2' ' O ' ' D' ' 328' ' ' PHE . 45.8 tp60 -88.81 107.91 19.23 Favored 'General case' 0 N--CA 1.489 1.48 0 O-C-N 121.33 -0.857 . . . . 0.91 109.135 179.507 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' B' B ' 332' ' ' ILE . . . . . . . . . . . . . 35.2 mt -103.84 107.15 21.62 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.584 0 O-C-N 121.136 -0.977 . . . . 1.08 109.618 -179.728 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' B' B ' 333' ' ' ARG . . . . . 0.505 ' HG2' ' CE1' ' D' ' 327' ' ' TYR . 0.0 OUTLIER -73.66 155.05 39.42 Favored 'General case' 0 N--CA 1.488 1.46 0 O-C-N 121.293 -0.879 . . . . 3.42 109.347 179.695 . . . . . . . . 3 3 . 1 . 025 nuclear orig core ' B' B ' 334' ' ' GLY . . . . . . . . . . . . . . . 78.05 128.39 0.45 Allowed Glycine 0 N--CA 1.492 2.369 0 N-CA-C 109.965 -1.254 . . . . 0.4 109.965 179.702 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' B' B ' 335' ' ' ARG . . . . . 0.51 ' HG2' ' NH1' ' B' ' 335' ' ' ARG . 1.7 ttt-85 -80.01 -35.8 36.83 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.308 -1.113 . . . . 3.55 109.467 179.845 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' B' B ' 336' ' ' GLU . . . . . . . . . . . . . 2.3 tm-20 -56.49 -65.43 0.61 Allowed 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.333 -0.854 . . . . 2.28 109.725 -179.699 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' B' B ' 337' ' ' ARG . . . . . 0.432 ' CG ' ' NH1' ' B' ' 337' ' ' ARG . 0.0 OUTLIER -60.18 -29.25 68.57 Favored 'General case' 0 N--CA 1.488 1.463 0 O-C-N 121.283 -0.886 . . . . 3.64 109.647 -179.789 . . . . . . . . 3 3 . 1 . 025 nuclear orig core ' B' B ' 338' ' ' PHE . . . . . . . . . . . . . 53.1 t80 -55.03 -59.83 4.2 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.243 -0.911 . . . . 0.39 109.542 -179.949 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' B' B ' 339' ' ' GLU . . . . . . . . . . . . . 62.4 mm-40 -51.6 -30.08 19.8 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.34 -0.85 . . . . 1.98 109.71 -179.963 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' B' B ' 340' ' ' MET . . . . . 0.424 ' HB3' ' O ' ' B' ' 337' ' ' ARG . 7.0 ttp -64.16 -50.91 66.32 Favored 'General case' 0 N--CA 1.489 1.499 0 O-C-N 121.192 -0.942 . . . . 1.14 109.592 -179.732 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' B' B ' 341' ' ' PHE . . . . . . . . . . . . . 47.0 m-85 -62.46 -46.24 89.41 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.231 -0.918 . . . . 0.22 109.939 -179.822 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' B' B ' 342' ' ' ARG . . . . . . . . . . . . . 5.4 ttm180 -48.98 -41.04 32.91 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.182 -0.949 . . . . 3.15 109.9 -179.437 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' B' B ' 343' ' ' GLU . . . . . . . . . . . . . 1.4 tt0 -58.91 -43.92 91.15 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.171 -0.956 . . . . 2.35 109.673 -179.641 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' B' B ' 344' ' ' LEU . . . . . 0.454 ' O ' HD21 ' B' ' 348' ' ' LEU . 41.3 mt -62.95 -46.27 88.54 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.217 -0.927 . . . . 1.05 109.939 -179.8 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' B' B ' 345' ' ' ASN . . . . . . . . . . . . . 41.7 t-20 -55.42 -46.85 76.63 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.253 -0.904 . . . . 1.35 109.823 -179.527 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' B' B ' 346' ' ' GLU . . . . . . . . . . . . . 1.4 tp10 -60.76 -36.66 79.49 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.239 -0.913 . . . . 1.66 109.825 -179.714 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' B' B ' 347' ' ' ALA . . . . . . . . . . . . . . . -59.23 -51.46 69.88 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.177 -0.952 . . . . 1.02 109.886 -179.731 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' B' B ' 348' ' ' LEU . . . . . 0.454 HD21 ' O ' ' B' ' 344' ' ' LEU . 4.1 mm? -61.21 -44.36 97.4 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.234 -0.917 . . . . 1.05 109.723 -179.751 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' B' B ' 349' ' ' GLU . . . . . . . . . . . . . 2.3 mm-40 -58.51 -34.75 71.29 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.257 -0.902 . . . . 1.95 110.214 -179.584 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' B' B ' 350' ' ' LEU . . . . . 0.477 HD22 ' O ' ' B' ' 350' ' ' LEU . 6.4 tt -62.53 -44.14 97.09 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.058 -1.026 . . . . 1.18 109.579 -179.888 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' B' B ' 351' ' ' LYS . . . . . . . . . . . . . 26.3 tttm -56.5 -43.24 79.51 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.312 -0.867 . . . . 1.96 109.797 -179.728 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' B' B ' 352' ' ' ASP . . . . . . . . . . . . . 35.0 m-20 -58.0 -50.41 73.5 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.218 -0.926 . . . . 1.16 109.712 179.972 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' B' B ' 353' ' ' ALA . . . . . . . . . . . . . . . -67.08 -10.96 55.55 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.087 -1.008 . . . . 1.21 109.62 -179.662 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' B' B ' 354' ' ' GLN . . . . . . . . . . . . . 3.0 tt0 . . . . . 0 N--CA 1.489 1.497 0 O-C-N 121.324 -0.86 . . . . 1.69 109.781 -179.774 . . . . . . . . 0 0 . 1 . 025 nuclear orig core ' C' C ' 326' ' ' GLU . . . . . . . . . . . . . 42.1 mm-40 . . . . . 0 N--CA 1.489 1.513 0 CA-C-O 121.415 0.626 . . . . 2.17 109.653 . . . . . . . . . 0 0 . 1 . 025 nuclear orig core ' C' C ' 327' ' ' TYR . . . . . 0.575 ' CE2' ' HG2' ' A' ' 333' ' ' ARG . 47.7 m-85 -149.66 101.88 3.11 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.325 -0.859 . . . . 1.03 109.258 -179.956 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' C' C ' 328' ' ' PHE . . . . . 0.562 ' CE2' ' HG3' ' A' ' 335' ' ' ARG . 71.1 m-85 -110.15 -161.34 0.75 Allowed 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.164 -0.96 . . . . 0.37 110.075 -179.799 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' C' C ' 329' ' ' THR . . . . . . . . . . . . . 33.8 p -154.95 169.76 23.31 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.482 -0.761 . . . . 1.04 109.071 179.834 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' C' C ' 330' ' ' LEU . . . . . . . . . . . . . 16.8 tp -149.89 127.23 11.43 Favored 'General case' 0 N--CA 1.489 1.494 0 O-C-N 121.219 -0.925 . . . . 1.09 109.851 -179.924 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' C' C ' 331' ' ' GLN . . . . . . . . . . . . . 12.5 tp60 -87.76 113.2 23.21 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.401 -0.812 . . . . 1.48 109.162 179.658 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' C' C ' 332' ' ' ILE . . . . . 0.418 HG23 ' HA ' ' C' ' 338' ' ' PHE . 32.1 mt -103.14 110.11 28.79 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.6 0 O-C-N 121.117 -0.99 . . . . 1.08 109.782 -179.789 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' C' C ' 333' ' ' ARG . . . . . 0.424 ' HG2' ' CE1' ' A' ' 327' ' ' TYR . 18.7 mtt180 -73.08 148.13 44.32 Favored 'General case' 0 N--CA 1.488 1.435 0 O-C-N 121.368 -0.833 . . . . 3.36 109.3 179.594 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' C' C ' 334' ' ' GLY . . . . . . . . . . . . . . . 80.07 128.6 0.73 Allowed Glycine 0 N--CA 1.489 2.221 0 N-CA-C 109.749 -1.34 . . . . 0.35 109.749 179.945 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' C' C ' 335' ' ' ARG . . . . . 0.445 ' NH1' ' CG ' ' C' ' 335' ' ' ARG . 0.1 OUTLIER -78.38 -30.25 47.77 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.323 -1.104 . . . . 3.23 109.478 179.919 . . . . . . . . 3 3 . 1 . 025 nuclear orig core ' C' C ' 336' ' ' GLU . . . . . . . . . . . . . 24.6 mt-10 -58.26 -66.02 0.55 Allowed 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.309 -0.869 . . . . 2.62 109.751 -179.924 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' C' C ' 337' ' ' ARG . . . . . . . . . . . . . 1.2 mtp180 -59.26 -26.92 65.33 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.211 -0.931 . . . . 3.61 109.614 -179.805 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' C' C ' 338' ' ' PHE . . . . . 0.418 ' HA ' HG23 ' C' ' 332' ' ' ILE . 74.3 t80 -56.03 -59.1 5.4 Favored 'General case' 0 N--CA 1.489 1.476 0 O-C-N 121.154 -0.966 . . . . 0.43 109.808 -179.88 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' C' C ' 339' ' ' GLU . . . . . . . . . . . . . 4.2 mt-10 -50.5 -33.89 23.1 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.208 -0.932 . . . . 2.05 110.09 -179.512 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' C' C ' 340' ' ' MET . . . . . . . . . . . . . 31.2 ttp -63.72 -51.56 64.43 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.195 -0.941 . . . . 1.1 110.101 -179.498 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' C' C ' 341' ' ' PHE . . . . . . . . . . . . . 47.8 m-85 -61.22 -46.58 89.84 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.114 -0.991 . . . . 0.21 110.012 -179.417 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' C' C ' 342' ' ' ARG . . . . . 0.484 ' NH1' ' HG3' ' C' ' 342' ' ' ARG . 0.0 OUTLIER -48.31 -42.52 31.3 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.246 -0.909 . . . . 3.42 110.252 -179.508 . . . . . . . . 3 3 . 1 . 025 nuclear orig core ' C' C ' 343' ' ' GLU . . . . . . . . . . . . . 44.4 tt0 -58.5 -47.37 84.31 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.165 -0.959 . . . . 2.14 110.095 -179.459 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' C' C ' 344' ' ' LEU . . . . . 0.468 HD21 HD21 ' D' ' 344' ' ' LEU . 92.6 mt -61.14 -44.58 97.1 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.119 -0.988 . . . . 1.09 109.952 -179.58 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' C' C ' 345' ' ' ASN . . . . . . . . . . . . . 64.7 t-20 -56.04 -51.72 66.79 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.218 -0.927 . . . . 1.38 110.045 -179.557 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' C' C ' 346' ' ' GLU . . . . . . . . . . . . . 7.7 tp10 -61.36 -31.95 71.84 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.059 -1.025 . . . . 2.21 109.553 -179.898 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' C' C ' 347' ' ' ALA . . . . . . . . . . . . . . . -59.97 -54.48 45.57 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.16 -0.962 . . . . 1.03 109.96 179.954 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' C' C ' 348' ' ' LEU . . . . . 0.515 ' N ' ' CD2' ' C' ' 348' ' ' LEU . 4.0 mm? -61.11 -40.68 94.68 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.177 -0.952 . . . . 1.06 109.791 -179.839 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' C' C ' 349' ' ' GLU . . . . . . . . . . . . . 11.7 mm-40 -57.74 -38.83 76.01 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.277 -0.89 . . . . 2.19 110.01 -179.469 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' C' C ' 350' ' ' LEU . . . . . 0.541 HD21 ' CD1' ' D' ' 350' ' ' LEU . 6.7 tt -63.18 -39.9 95.98 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.113 -0.992 . . . . 1.2 109.612 -179.839 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' C' C ' 351' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -59.16 -50.64 73.26 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.19 -0.944 . . . . 1.92 109.484 -179.843 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' C' C ' 352' ' ' ASP . . . . . . . . . . . . . 73.5 m-20 -55.69 -38.41 69.63 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.344 -0.847 . . . . 1.19 109.864 179.953 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' C' C ' 353' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.493 1.686 0 O-C-N 121.33 -0.856 . . . . 1.15 110.554 -179.328 . . . . . . . . 0 0 . 1 . 025 nuclear orig core ' D' D ' 326' ' ' GLU . . . . . . . . . . . . . 3.1 mm-40 . . . . . 0 N--CA 1.489 1.478 0 N-CA-C 109.379 -0.601 . . . . 2.13 109.379 . . . . . . . . . 0 0 . 1 . 025 nuclear orig core ' D' D ' 327' ' ' TYR . . . . . 0.505 ' CE1' ' HG2' ' B' ' 333' ' ' ARG . 48.7 m-85 -148.99 105.76 3.57 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.201 -0.937 . . . . 1.0 109.676 -179.8 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' D' D ' 328' ' ' PHE . . . . . 0.43 ' O ' ' NE2' ' B' ' 331' ' ' GLN . 67.3 m-85 -112.8 -163.9 0.88 Allowed 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.281 -0.887 . . . . 0.34 109.613 179.782 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' D' D ' 329' ' ' THR . . . . . . . . . . . . . 21.1 p -153.97 174.17 15.01 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.178 -0.951 . . . . 1.05 109.192 179.94 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' D' D ' 330' ' ' LEU . . . . . . . . . . . . . 29.1 tp -152.29 132.07 13.22 Favored 'General case' 0 N--CA 1.489 1.494 0 O-C-N 121.166 -0.959 . . . . 1.07 109.852 -179.864 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' D' D ' 331' ' ' GLN . . . . . 0.408 ' NE2' ' O ' ' B' ' 328' ' ' PHE . 46.3 tp60 -89.31 107.98 19.37 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.355 -0.841 . . . . 0.93 109.095 179.463 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' D' D ' 332' ' ' ILE . . . . . . . . . . . . . 33.5 mt -103.67 106.98 21.21 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.518 0 O-C-N 121.195 -0.94 . . . . 1.07 109.766 -179.855 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' D' D ' 333' ' ' ARG . . . . . 0.568 ' HG2' ' CE1' ' B' ' 327' ' ' TYR . 0.0 OUTLIER -73.58 154.35 39.84 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.37 -0.831 . . . . 3.42 109.402 179.693 . . . . . . . . 3 3 . 1 . 025 nuclear orig core ' D' D ' 334' ' ' GLY . . . . . . . . . . . . . . . 78.93 128.42 0.55 Allowed Glycine 0 N--CA 1.492 2.403 0 N-CA-C 109.94 -1.264 . . . . 0.41 109.94 179.607 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' D' D ' 335' ' ' ARG . . . . . 0.51 ' HG2' ' NH1' ' D' ' 335' ' ' ARG . 1.6 ttt-85 -80.24 -35.19 36.44 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.371 -1.076 . . . . 3.58 109.453 179.93 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' D' D ' 336' ' ' GLU . . . . . . . . . . . . . 2.4 tm-20 -57.19 -65.5 0.61 Allowed 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.311 -0.868 . . . . 2.26 109.685 -179.663 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' D' D ' 337' ' ' ARG . . . . . 0.431 HH11 ' CG ' ' D' ' 337' ' ' ARG . 0.0 OUTLIER -60.19 -29.11 68.49 Favored 'General case' 0 N--CA 1.489 1.486 0 O-C-N 121.392 -0.818 . . . . 3.64 109.543 -179.924 . . . . . . . . 3 3 . 1 . 025 nuclear orig core ' D' D ' 338' ' ' PHE . . . . . . . . . . . . . 54.9 t80 -54.84 -60.04 3.9 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.246 -0.909 . . . . 0.4 109.554 179.883 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' D' D ' 339' ' ' GLU . . . . . . . . . . . . . 60.7 mm-40 -51.63 -29.59 18.27 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.287 -0.883 . . . . 1.99 109.838 -179.813 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' D' D ' 340' ' ' MET . . . . . 0.409 ' HB3' ' O ' ' D' ' 337' ' ' ARG . 6.6 ttp -64.6 -50.61 66.52 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.15 -0.969 . . . . 1.13 109.58 -179.818 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' D' D ' 341' ' ' PHE . . . . . . . . . . . . . 46.5 m-85 -62.8 -46.26 88.78 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.347 -0.846 . . . . 0.21 109.954 -179.735 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' D' D ' 342' ' ' ARG . . . . . . . . . . . . . 5.5 ttm180 -49.09 -41.38 35.35 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.262 -0.899 . . . . 3.15 109.922 -179.429 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' D' D ' 343' ' ' GLU . . . . . . . . . . . . . 1.4 tt0 -58.66 -44.02 90.01 Favored 'General case' 0 N--CA 1.489 1.5 0 O-C-N 121.215 -0.928 . . . . 2.35 109.543 -179.621 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' D' D ' 344' ' ' LEU . . . . . 0.468 HD21 HD21 ' C' ' 344' ' ' LEU . 40.1 mt -62.92 -46.22 88.81 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.346 -0.846 . . . . 1.06 110.025 -179.743 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' D' D ' 345' ' ' ASN . . . . . . . . . . . . . 41.6 t-20 -55.59 -46.56 77.25 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.159 -0.963 . . . . 1.35 109.837 -179.519 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' D' D ' 346' ' ' GLU . . . . . . . . . . . . . 1.4 tp10 -60.67 -36.75 79.5 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.152 -0.967 . . . . 1.69 109.774 -179.806 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' D' D ' 347' ' ' ALA . . . . . . . . . . . . . . . -59.05 -50.95 72.14 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.091 -1.006 . . . . 1.03 110.025 -179.737 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' D' D ' 348' ' ' LEU . . . . . 0.457 HD21 ' O ' ' D' ' 344' ' ' LEU . 4.0 mm? -61.89 -43.84 98.02 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.129 -0.982 . . . . 1.04 109.829 -179.791 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' D' D ' 349' ' ' GLU . . . . . . . . . . . . . 2.3 mm-40 -59.05 -34.47 71.97 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.318 -0.864 . . . . 1.95 110.085 -179.531 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' D' D ' 350' ' ' LEU . . . . . 0.541 ' CD1' HD21 ' C' ' 350' ' ' LEU . 6.2 tt -62.83 -43.8 97.84 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.135 -0.978 . . . . 1.16 109.518 -179.87 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' D' D ' 351' ' ' LYS . . . . . . . . . . . . . 27.2 tttm -56.98 -42.7 80.69 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.352 -0.842 . . . . 1.97 109.728 -179.676 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' D' D ' 352' ' ' ASP . . . . . . . . . . . . . 33.7 m-20 -58.55 -50.36 74.07 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.118 -0.989 . . . . 1.17 109.613 -179.969 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' D' D ' 353' ' ' ALA . . . . . . . . . . . . . . . -66.93 -11.01 55.03 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.28 -0.888 . . . . 1.21 109.634 -179.794 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' D' D ' 354' ' ' GLN . . . . . 0.408 ' NE2' ' CD1' ' C' ' 350' ' ' LEU . 3.1 tt0 . . . . . 0 C--N 1.3 -1.552 0 O-C-N 121.281 -0.887 . . . . 1.68 109.775 -179.774 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 326' ' ' GLU . . . . . . . . . . . . . 32.4 mp0 . . . . . 0 N--CA 1.489 1.515 0 CA-C-O 121.338 0.59 . . . . 2.13 109.611 . . . . . . . . . 0 0 . 1 . 026 nuclear orig core ' A' A ' 327' ' ' TYR . . . . . 0.566 ' CE1' ' HG2' ' C' ' 333' ' ' ARG . 41.5 m-85 -148.78 112.6 5.11 Favored 'General case' 0 N--CA 1.489 1.5 0 O-C-N 121.373 -0.829 . . . . 1.0 109.555 180.0 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 328' ' ' PHE . . . . . . . . . . . . . 98.0 m-85 -113.88 -169.43 1.51 Allowed 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.258 -0.901 . . . . 0.34 109.369 179.804 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 329' ' ' THR . . . . . . . . . . . . . 20.8 p -153.29 168.95 24.32 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.302 -0.874 . . . . 1.05 109.665 -179.761 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 330' ' ' LEU . . . . . . . . . . . . . 41.7 tp -152.19 129.11 10.98 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.29 -0.881 . . . . 1.07 109.591 -179.856 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 331' ' ' GLN . . . . . . . . . . . . . 1.4 tt0 -87.13 114.61 23.89 Favored 'General case' 0 N--CA 1.488 1.429 0 O-C-N 121.403 -0.81 . . . . 0.91 109.14 179.537 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 332' ' ' ILE . . . . . . . . . . . . . 45.8 mt -103.32 104.3 16.44 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.54 0 O-C-N 121.095 -1.003 . . . . 1.09 109.487 -179.933 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 333' ' ' ARG . . . . . 0.489 ' HG2' ' CE2' ' C' ' 327' ' ' TYR . 49.4 mtt180 -72.82 143.58 47.82 Favored 'General case' 0 N--CA 1.488 1.433 0 O-C-N 121.306 -0.871 . . . . 3.41 109.108 179.822 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 334' ' ' GLY . . . . . . . . . . . . . . . 89.2 125.72 2.7 Favored Glycine 0 N--CA 1.491 2.342 0 N-CA-C 109.423 -1.471 . . . . 0.4 109.423 -179.93 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 335' ' ' ARG . . . . . . . . . . . . . 15.1 ttt180 -76.41 -40.39 50.97 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.202 -1.175 . . . . 3.55 109.742 -179.897 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 336' ' ' GLU . . . . . . . . . . . . . 20.0 tt0 -58.09 -58.76 7.03 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.42 -0.8 . . . . 2.29 109.928 -179.746 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 337' ' ' ARG . . . . . 0.433 ' NH1' ' CG ' ' A' ' 337' ' ' ARG . 0.0 OUTLIER -61.18 -32.51 72.25 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.229 -0.919 . . . . 3.64 109.509 -179.833 . . . . . . . . 3 3 . 1 . 026 nuclear orig core ' A' A ' 338' ' ' PHE . . . . . . . . . . . . . 53.0 t80 -55.75 -53.88 51.25 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.303 -0.873 . . . . 0.41 109.392 179.908 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 339' ' ' GLU . . . . . . . . . . . . . 43.1 mt-10 -50.8 -32.49 20.18 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.247 -0.908 . . . . 1.97 109.861 -179.644 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 340' ' ' MET . . . . . . . . . . . . . 19.6 ttp -63.1 -51.64 65.77 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.088 -1.007 . . . . 1.14 109.79 -179.551 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 341' ' ' PHE . . . . . . . . . . . . . 37.3 m-85 -62.06 -41.47 98.19 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.133 -0.98 . . . . 0.21 109.816 -179.829 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 342' ' ' ARG . . . . . . . . . . . . . 6.1 tpt180 -49.1 -43.46 41.32 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.261 -0.899 . . . . 3.15 110.105 -179.497 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 343' ' ' GLU . . . . . . . . . . . . . 1.3 tt0 -59.95 -46.02 90.75 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.202 -0.936 . . . . 2.35 109.639 -179.757 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 344' ' ' LEU . . . . . 0.419 ' O ' HD21 ' A' ' 348' ' ' LEU . 57.6 mt -62.04 -30.28 70.87 Favored 'General case' 0 N--CA 1.488 1.467 0 O-C-N 121.315 -0.866 . . . . 1.06 109.372 -179.954 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 345' ' ' ASN . . . . . . . . . . . . . 12.4 t-20 -59.24 -58.09 10.14 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.346 -0.846 . . . . 1.36 109.965 -179.725 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 346' ' ' GLU . . . . . . . . . . . . . 15.8 tt0 -61.74 -28.15 69.23 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.212 -0.93 . . . . 1.65 109.731 -179.555 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 347' ' ' ALA . . . . . . . . . . . . . . . -60.9 -61.71 2.38 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.099 -1.001 . . . . 1.03 110.011 -179.607 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 348' ' ' LEU . . . . . 0.462 ' N ' HD23 ' A' ' 348' ' ' LEU . 3.8 mm? -61.52 -45.65 93.3 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.278 -0.889 . . . . 1.04 110.21 -179.396 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 349' ' ' GLU . . . . . 0.43 ' OE2' ' HD2' ' C' ' 333' ' ' ARG . 3.5 mt-10 -57.69 -32.93 67.84 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.226 -0.921 . . . . 1.94 110.072 -179.339 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 350' ' ' LEU . . . . . 0.486 HD21 HD21 ' B' ' 350' ' ' LEU . 7.8 tt -65.75 -43.99 87.24 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.032 -1.043 . . . . 1.17 109.391 -179.91 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 351' ' ' LYS . . . . . . . . . . . . . 13.3 tttt -59.07 -50.95 72.11 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.381 -0.824 . . . . 1.97 109.352 -179.937 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 352' ' ' ASP . . . . . . . . . . . . . 2.3 m-20 -56.24 -31.23 63.36 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.205 -0.934 . . . . 1.16 109.82 -179.922 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 353' ' ' ALA . . . . . . . . . . . . . . . -67.25 -33.25 74.93 Favored 'General case' 0 N--CA 1.495 1.776 0 O-C-N 121.13 -0.981 . . . . 1.22 110.072 -179.731 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 354' ' ' GLN . . . . . . . . . . . . . 20.1 mt-30 . . . . . 0 N--CA 1.491 1.6 0 O-C-N 121.128 -0.983 . . . . 1.71 109.576 -179.696 . . . . . . . . 0 0 . 1 . 026 nuclear orig core ' B' B ' 326' ' ' GLU . . . . . . . . . . . . . 34.5 mp0 . . . . . 0 N--CA 1.491 1.611 0 CA-C-O 121.326 0.584 . . . . 2.13 109.768 . . . . . . . . . 0 0 . 1 . 026 nuclear orig core ' B' B ' 327' ' ' TYR . . . . . . . . . . . . . 41.8 m-85 -149.37 112.2 4.83 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.354 -0.841 . . . . 0.99 109.898 -179.994 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' B' B ' 328' ' ' PHE . . . . . 0.449 ' CE2' ' HA ' ' D' ' 335' ' ' ARG . 97.3 m-85 -113.52 -169.51 1.51 Allowed 'General case' 0 N--CA 1.487 1.411 0 O-C-N 121.342 -0.849 . . . . 0.36 109.503 179.942 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' B' B ' 329' ' ' THR . . . . . . . . . . . . . 18.0 p -152.94 169.27 23.28 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.182 -0.948 . . . . 1.05 109.792 -179.661 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' B' B ' 330' ' ' LEU . . . . . . . . . . . . . 39.6 tp -152.4 129.31 10.99 Favored 'General case' 0 N--CA 1.489 1.478 0 O-C-N 121.365 -0.835 . . . . 1.07 109.668 179.998 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' B' B ' 331' ' ' GLN . . . . . . . . . . . . . 1.3 tt0 -87.01 115.27 24.28 Favored 'General case' 0 N--CA 1.488 1.475 0 O-C-N 121.36 -0.837 . . . . 0.91 109.115 179.504 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' B' B ' 332' ' ' ILE . . . . . . . . . . . . . 42.6 mt -103.48 103.59 15.38 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.599 0 O-C-N 120.945 -1.097 . . . . 1.08 109.7 179.964 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' B' B ' 333' ' ' ARG . . . . . . . . . . . . . 50.3 mtt180 -72.4 142.75 48.7 Favored 'General case' 0 C--N 1.302 -1.463 0 O-C-N 121.085 -1.01 . . . . 3.42 109.261 179.759 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' B' B ' 334' ' ' GLY . . . . . . . . . . . . . . . 89.79 125.6 2.86 Favored Glycine 0 N--CA 1.49 2.29 0 N-CA-C 109.583 -1.407 . . . . 0.4 109.583 -179.821 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' B' B ' 335' ' ' ARG . . . . . . . . . . . . . 16.6 ttt180 -76.45 -40.37 50.69 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.151 -1.206 . . . . 3.55 109.72 -179.928 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' B' B ' 336' ' ' GLU . . . . . . . . . . . . . 24.1 tt0 -58.23 -59.31 5.51 Favored 'General case' 0 N--CA 1.489 1.49 0 O-C-N 121.083 -1.011 . . . . 2.28 109.69 -179.577 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' B' B ' 337' ' ' ARG . . . . . 0.451 ' CG ' ' NH1' ' B' ' 337' ' ' ARG . 0.0 OUTLIER -60.26 -32.42 71.14 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.12 -0.987 . . . . 3.64 109.766 -179.795 . . . . . . . . 3 3 . 1 . 026 nuclear orig core ' B' B ' 338' ' ' PHE . . . . . . . . . . . . . 52.4 t80 -55.93 -52.94 62.36 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.226 -0.921 . . . . 0.39 109.625 -179.895 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' B' B ' 339' ' ' GLU . . . . . . . . . . . . . 35.3 mt-10 -51.12 -33.03 24.71 Favored 'General case' 0 N--CA 1.488 1.461 0 O-C-N 121.35 -0.844 . . . . 1.98 109.848 -179.574 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' B' B ' 340' ' ' MET . . . . . . . . . . . . . 20.0 ttp -62.83 -51.36 67.32 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.115 -0.99 . . . . 1.14 109.924 -179.512 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' B' B ' 341' ' ' PHE . . . . . . . . . . . . . 35.6 m-85 -62.41 -41.72 98.9 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.128 -0.982 . . . . 0.22 109.796 -179.834 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' B' B ' 342' ' ' ARG . . . . . . . . . . . . . 5.7 tpt180 -48.88 -44.32 39.82 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.383 -0.823 . . . . 3.15 109.68 -179.806 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' B' B ' 343' ' ' GLU . . . . . . . . . . . . . 1.3 tt0 -58.44 -47.42 84.04 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.085 -1.009 . . . . 2.35 109.705 -179.85 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' B' B ' 344' ' ' LEU . . . . . 0.431 ' O ' HD21 ' B' ' 348' ' ' LEU . 51.6 mt -61.01 -30.52 70.35 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.158 -0.964 . . . . 1.05 109.684 -179.831 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' B' B ' 345' ' ' ASN . . . . . . . . . . . . . 12.1 t-20 -58.91 -58.33 9.12 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.314 -0.866 . . . . 1.35 110.132 -179.837 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' B' B ' 346' ' ' GLU . . . . . . . . . . . . . 17.7 tt0 -61.65 -28.44 69.38 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.112 -0.993 . . . . 1.66 109.568 -179.464 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' B' B ' 347' ' ' ALA . . . . . . . . . . . . . . . -60.59 -61.14 2.81 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.248 -0.908 . . . . 1.02 110.199 -179.778 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' B' B ' 348' ' ' LEU . . . . . 0.431 HD21 ' O ' ' B' ' 344' ' ' LEU . 3.8 mm? -62.36 -46.05 90.44 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.307 -0.871 . . . . 1.05 110.023 -179.279 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' B' B ' 349' ' ' GLU . . . . . . . . . . . . . 3.9 mt-10 -57.09 -33.2 67.07 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.025 -1.047 . . . . 1.95 110.099 -179.48 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' B' B ' 350' ' ' LEU . . . . . 0.486 HD21 HD21 ' A' ' 350' ' ' LEU . 7.8 tt -65.41 -44.3 87.87 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.159 -0.963 . . . . 1.18 109.442 -179.923 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' B' B ' 351' ' ' LYS . . . . . . . . . . . . . 15.0 tttt -58.74 -50.65 73.12 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.233 -0.917 . . . . 1.96 109.454 -179.984 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' B' B ' 352' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 -56.35 -31.92 64.23 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.224 -0.922 . . . . 1.16 109.841 -179.85 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' B' B ' 353' ' ' ALA . . . . . . . . . . . . . . . -66.82 -33.0 74.65 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.194 -0.941 . . . . 1.21 109.896 -179.661 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' B' B ' 354' ' ' GLN . . . . . . . . . . . . . 20.3 mt-30 . . . . . 0 N--CA 1.493 1.687 0 O-C-N 121.107 -0.995 . . . . 1.69 109.515 -179.914 . . . . . . . . 0 0 . 1 . 026 nuclear orig core ' C' C ' 326' ' ' GLU . . . . . 0.408 ' O ' ' CD1' ' C' ' 327' ' ' TYR . 3.5 mt-10 . . . . . 0 N--CA 1.49 1.566 0 N-CA-C 109.382 -0.599 . . . . 2.17 109.382 . . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' C' C ' 327' ' ' TYR . . . . . 0.489 ' CE2' ' HG2' ' A' ' 333' ' ' ARG . 33.7 m-85 -149.33 112.09 4.81 Favored 'General case' 0 N--CA 1.488 1.45 0 O-C-N 121.375 -0.828 . . . . 1.03 110.458 179.721 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' C' C ' 328' ' ' PHE . . . . . . . . . . . . . 68.9 m-85 -112.96 -166.36 1.07 Allowed 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.423 -0.798 . . . . 0.37 108.975 179.458 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' C' C ' 329' ' ' THR . . . . . . . . . . . . . 4.4 p -154.28 166.01 34.5 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.259 -0.901 . . . . 1.04 109.492 -179.944 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' C' C ' 330' ' ' LEU . . . . . . . . . . . . . 42.0 tp -150.07 129.42 12.9 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.24 -0.912 . . . . 1.09 109.762 -179.692 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' C' C ' 331' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -87.59 116.48 25.74 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.278 -0.889 . . . . 1.48 109.095 179.683 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' C' C ' 332' ' ' ILE . . . . . 0.465 HG22 ' HA ' ' C' ' 338' ' ' PHE . 76.1 mt -104.14 110.71 31.16 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.559 0 O-C-N 121.195 -0.941 . . . . 1.08 109.828 -179.748 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' C' C ' 333' ' ' ARG . . . . . 0.566 ' HG2' ' CE1' ' A' ' 327' ' ' TYR . 58.2 mtt180 -73.89 143.01 45.98 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.238 -0.914 . . . . 3.36 109.368 179.64 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' C' C ' 334' ' ' GLY . . . . . . . . . . . . . . . 80.92 133.71 1.38 Allowed Glycine 0 N--CA 1.491 2.341 0 N-CA-C 109.884 -1.286 . . . . 0.35 109.884 179.845 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' C' C ' 335' ' ' ARG . . . . . . . . . . . . . 3.8 ttt180 -77.69 -35.35 52.27 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.271 -1.135 . . . . 3.23 109.402 179.81 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' C' C ' 336' ' ' GLU . . . . . . . . . . . . . 2.0 mp0 -56.93 -57.38 12.78 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.239 -0.913 . . . . 2.62 109.763 -179.85 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' C' C ' 337' ' ' ARG . . . . . 0.423 HH11 ' HG3' ' C' ' 337' ' ' ARG . 0.3 OUTLIER -59.44 -34.52 72.62 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.158 -0.964 . . . . 3.61 109.683 -179.746 . . . . . . . . 3 3 . 1 . 026 nuclear orig core ' C' C ' 338' ' ' PHE . . . . . 0.465 ' HA ' HG22 ' C' ' 332' ' ' ILE . 61.2 t80 -54.87 -55.65 28.07 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.415 -0.803 . . . . 0.43 109.747 -179.841 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' C' C ' 339' ' ' GLU . . . . . . . . . . . . . 11.4 mm-40 -50.92 -35.85 35.4 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.319 -0.863 . . . . 2.05 110.367 -179.592 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' C' C ' 340' ' ' MET . . . . . . . . . . . . . 34.6 ttp -63.33 -48.66 77.11 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.112 -0.993 . . . . 1.1 110.054 -179.343 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' C' C ' 341' ' ' PHE . . . . . . . . . . . . . 30.9 m-85 -63.23 -46.32 87.5 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.187 -0.946 . . . . 0.21 110.251 -179.351 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' C' C ' 342' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -48.89 -39.96 27.95 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.015 -1.053 . . . . 3.42 109.799 -179.663 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' C' C ' 343' ' ' GLU . . . . . . . . . . . . . 31.3 tt0 -58.41 -52.82 63.99 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.08 -1.013 . . . . 2.14 109.507 179.913 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' C' C ' 344' ' ' LEU . . . . . . . . . . . . . 86.4 mt -62.02 -25.02 67.41 Favored 'General case' 0 N--CA 1.488 1.454 0 O-C-N 121.344 -0.848 . . . . 1.09 109.23 -179.943 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' C' C ' 345' ' ' ASN . . . . . . . . . . . . . 6.9 t-20 -60.31 -61.43 2.61 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.322 -0.861 . . . . 1.38 109.341 -179.942 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' C' C ' 346' ' ' GLU . . . . . . . . . . . . . 34.5 tt0 -61.29 -23.2 65.53 Favored 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.316 -0.865 . . . . 2.21 109.487 -179.931 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' C' C ' 347' ' ' ALA . . . . . . . . . . . . . . . -63.2 -62.8 1.45 Allowed 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.308 -0.87 . . . . 1.03 109.776 -179.941 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' C' C ' 348' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -61.6 -40.77 95.99 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.333 -0.854 . . . . 1.06 109.712 -179.676 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' C' C ' 349' ' ' GLU . . . . . 0.438 ' HA ' ' OE1' ' C' ' 349' ' ' GLU . 7.8 mm-40 -57.28 -38.66 74.26 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 120.994 -1.066 . . . . 2.19 109.52 -179.825 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' C' C ' 350' ' ' LEU . . . . . 0.554 ' CD2' HD12 ' D' ' 350' ' ' LEU . 9.5 tt -63.74 -44.02 94.75 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.429 -0.794 . . . . 1.2 109.07 179.853 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' C' C ' 351' ' ' LYS . . . . . . . . . . . . . 2.6 tttt -59.46 -39.4 83.52 Favored 'General case' 0 C--N 1.301 -1.532 0 O-C-N 121.504 -0.748 . . . . 1.92 109.431 179.981 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' C' C ' 352' ' ' ASP . . . . . . . . . . . . . 24.6 m-20 -58.44 -39.9 81.1 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.316 -0.865 . . . . 1.19 109.561 -179.781 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' C' C ' 353' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 1.569 0 O-C-N 121.276 -0.89 . . . . 1.15 109.795 -179.657 . . . . . . . . 0 0 . 1 . 026 nuclear orig core ' D' D ' 326' ' ' GLU . . . . . . . . . . . . . 33.9 mp0 . . . . . 0 N--CA 1.489 1.478 0 CA-C-O 121.413 0.625 . . . . 2.13 109.642 . . . . . . . . . 0 0 . 1 . 026 nuclear orig core ' D' D ' 327' ' ' TYR . . . . . . . . . . . . . 41.6 m-85 -149.62 112.21 4.76 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.321 -0.862 . . . . 1.0 109.784 -179.866 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' D' D ' 328' ' ' PHE . . . . . . . . . . . . . 98.7 m-85 -113.1 -169.41 1.48 Allowed 'General case' 0 C--N 1.302 -1.498 0 O-C-N 121.315 -0.866 . . . . 0.34 109.381 -179.969 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' D' D ' 329' ' ' THR . . . . . . . . . . . . . 16.9 p -152.66 168.71 24.73 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.222 -0.924 . . . . 1.05 109.639 -179.753 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' D' D ' 330' ' ' LEU . . . . . . . . . . . . . 41.4 tp -152.1 129.28 11.18 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.283 -0.885 . . . . 1.07 109.754 -179.982 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' D' D ' 331' ' ' GLN . . . . . . . . . . . . . 1.5 tt0 -87.55 115.31 24.89 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.112 -0.992 . . . . 0.93 109.291 179.654 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' D' D ' 332' ' ' ILE . . . . . . . . . . . . . 39.3 mt -103.2 102.92 14.33 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.562 0 O-C-N 121.165 -0.959 . . . . 1.07 109.739 -179.886 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' D' D ' 333' ' ' ARG . . . . . . . . . . . . . 49.3 mtt180 -71.84 141.88 49.61 Favored 'General case' 0 N--CA 1.487 1.403 0 O-C-N 121.372 -0.83 . . . . 3.42 109.189 179.626 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' D' D ' 334' ' ' GLY . . . . . . . . . . . . . . . 90.87 125.04 3.08 Favored Glycine 0 N--CA 1.492 2.377 0 N-CA-C 109.376 -1.49 . . . . 0.41 109.376 -179.931 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' D' D ' 335' ' ' ARG . . . . . 0.449 ' HA ' ' CE2' ' B' ' 328' ' ' PHE . 18.5 ttt180 -76.64 -40.64 48.57 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.158 -1.201 . . . . 3.58 109.734 -179.971 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' D' D ' 336' ' ' GLU . . . . . . . . . . . . . 24.1 tt0 -57.86 -58.58 7.76 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.269 -0.895 . . . . 2.26 109.785 -179.771 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' D' D ' 337' ' ' ARG . . . . . 0.46 ' NH1' ' CG ' ' D' ' 337' ' ' ARG . 0.0 OUTLIER -61.45 -32.33 72.31 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.072 -1.017 . . . . 3.64 109.581 -179.669 . . . . . . . . 3 3 . 1 . 026 nuclear orig core ' D' D ' 338' ' ' PHE . . . . . . . . . . . . . 52.7 t80 -55.6 -53.24 58.91 Favored 'General case' 0 N--CA 1.489 1.492 0 O-C-N 121.304 -0.872 . . . . 0.4 109.527 179.926 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' D' D ' 339' ' ' GLU . . . . . . . . . . . . . 28.7 mt-10 -50.91 -32.3 20.22 Favored 'General case' 0 N--CA 1.494 1.762 0 O-C-N 121.308 -0.87 . . . . 1.99 110.109 -179.806 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' D' D ' 340' ' ' MET . . . . . . . . . . . . . 20.7 ttp -63.7 -51.28 65.75 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.069 -1.019 . . . . 1.13 109.642 -179.626 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' D' D ' 341' ' ' PHE . . . . . . . . . . . . . 34.9 m-85 -62.48 -41.59 98.89 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.11 -0.994 . . . . 0.21 109.937 -179.656 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' D' D ' 342' ' ' ARG . . . . . . . . . . . . . 6.4 tpt180 -49.27 -43.51 43.09 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.162 -0.961 . . . . 3.15 109.819 -179.793 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' D' D ' 343' ' ' GLU . . . . . . . . . . . . . 1.3 tt0 -59.26 -47.3 85.87 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.293 -0.879 . . . . 2.35 109.679 -179.766 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' D' D ' 344' ' ' LEU . . . . . 0.427 ' O ' HD21 ' D' ' 348' ' ' LEU . 48.3 mt -61.42 -30.22 70.43 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.241 -0.912 . . . . 1.06 109.354 -179.89 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' D' D ' 345' ' ' ASN . . . . . . . . . . . . . 11.8 t-20 -58.67 -59.18 5.81 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.186 -0.946 . . . . 1.35 109.981 -179.979 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' D' D ' 346' ' ' GLU . . . . . . . . . . . . . 19.1 tt0 -60.87 -27.81 68.39 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.228 -0.92 . . . . 1.69 109.927 -179.542 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' D' D ' 347' ' ' ALA . . . . . . . . . . . . . . . -61.09 -61.49 2.53 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.082 -1.011 . . . . 1.03 110.111 -179.705 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' D' D ' 348' ' ' LEU . . . . . 0.444 ' N ' HD23 ' D' ' 348' ' ' LEU . 3.8 mm? -62.1 -45.89 91.49 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.368 -0.832 . . . . 1.04 110.239 -179.441 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' D' D ' 349' ' ' GLU . . . . . . . . . . . . . 3.8 mt-10 -57.6 -33.19 67.94 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.186 -0.946 . . . . 1.95 109.784 -179.299 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' D' D ' 350' ' ' LEU . . . . . 0.554 HD12 ' CD2' ' C' ' 350' ' ' LEU . 7.7 tt -65.01 -43.88 91.03 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.302 -0.874 . . . . 1.16 109.531 -179.98 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' D' D ' 351' ' ' LYS . . . . . . . . . . . . . 16.7 tttt -59.5 -50.16 74.98 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.502 -0.749 . . . . 1.97 109.543 -179.783 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' D' D ' 352' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 -56.62 -32.37 65.24 Favored 'General case' 0 N--CA 1.488 1.458 0 O-C-N 121.293 -0.879 . . . . 1.17 109.767 -179.799 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' D' D ' 353' ' ' ALA . . . . . . . . . . . . . . . -66.51 -32.31 73.58 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.296 -0.878 . . . . 1.21 109.929 -179.732 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' D' D ' 354' ' ' GLN . . . . . . . . . . . . . 19.9 mt-30 . . . . . 0 N--CA 1.49 1.552 0 O-C-N 121.1 -1.0 . . . . 1.68 109.687 -179.702 . . . . . . . . 0 0 . 1 . 027 nuclear orig core ' A' A ' 326' ' ' GLU . . . . . . . . . . . . . 5.7 mm-40 . . . . . 0 N--CA 1.492 1.657 0 N-CA-C 109.242 -0.651 . . . . 2.13 109.242 . . . . . . . . . 0 0 . 1 . 027 nuclear orig core ' A' A ' 327' ' ' TYR . . . . . 0.561 ' CE1' ' HG3' ' C' ' 333' ' ' ARG . 41.0 m-85 -148.76 108.07 3.94 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.25 -0.906 . . . . 1.0 109.849 -179.909 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 328' ' ' PHE . . . . . 0.476 ' CE2' ' HA ' ' C' ' 335' ' ' ARG . 46.7 m-85 -113.35 -166.45 1.09 Allowed 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.214 -0.929 . . . . 0.34 109.297 179.691 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 329' ' ' THR . . . . . . . . . . . . . 20.2 p -152.75 171.29 18.46 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.131 -0.98 . . . . 1.05 109.238 179.729 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 330' ' ' LEU . . . . . 0.431 HD23 ' HB2' ' C' ' 345' ' ' ASN . 35.0 tp -151.47 130.29 12.43 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.109 -0.995 . . . . 1.07 109.815 -179.799 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 331' ' ' GLN . . . . . . . . . . . . . 13.4 tp60 -88.22 109.12 19.67 Favored 'General case' 0 N--CA 1.488 1.471 0 O-C-N 121.446 -0.784 . . . . 0.91 108.938 179.463 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 332' ' ' ILE . . . . . . . . . . . . . 30.6 mt -103.21 106.68 20.55 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.6 0 O-C-N 120.965 -1.084 . . . . 1.09 109.641 -179.814 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 333' ' ' ARG . . . . . 0.47 ' HG2' ' CE1' ' C' ' 327' ' ' TYR . 61.8 mtt180 -72.81 148.67 44.29 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.205 -0.935 . . . . 3.41 109.585 179.873 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 334' ' ' GLY . . . . . . . . . . . . . . . 83.27 129.52 1.5 Allowed Glycine 0 N--CA 1.492 2.377 0 N-CA-C 109.648 -1.381 . . . . 0.4 109.648 179.734 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 335' ' ' ARG . . . . . . . . . . . . . 15.2 ttt180 -79.76 -32.8 41.03 Favored 'General case' 0 N--CA 1.489 1.476 0 O-C-N 121.27 -1.135 . . . . 3.55 109.486 179.774 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 336' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -56.87 -62.87 1.44 Allowed 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.359 -0.838 . . . . 2.29 109.415 -179.812 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 337' ' ' ARG . . . . . . . . . . . . . 1.4 mmt180 -60.92 -29.89 69.87 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.323 -0.861 . . . . 3.64 109.638 179.974 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 338' ' ' PHE . . . . . . . . . . . . . 72.0 t80 -54.72 -57.75 10.27 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.344 -0.848 . . . . 0.41 109.759 -179.881 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 339' ' ' GLU . . . . . . . . . . . . . 50.7 mt-10 -52.11 -36.18 50.26 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.087 -1.008 . . . . 1.97 109.958 -179.869 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 340' ' ' MET . . . . . . . . . . . . . 41.5 ttp -63.44 -46.39 86.54 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.137 -0.977 . . . . 1.14 109.888 -179.647 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 341' ' ' PHE . . . . . . . . . . . . . 39.9 m-85 -62.79 -46.25 88.86 Favored 'General case' 0 N--CA 1.494 1.74 0 O-C-N 121.106 -0.997 . . . . 0.21 110.076 -179.734 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 342' ' ' ARG . . . . . . . . . . . . . 22.3 ttt180 -49.38 -44.12 44.66 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.219 -0.926 . . . . 3.15 110.296 -179.414 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 343' ' ' GLU . . . . . . . . . . . . . 1.8 tp10 -57.33 -45.34 84.38 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.115 -0.991 . . . . 2.35 110.005 -179.735 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 344' ' ' LEU . . . . . 0.472 HD21 ' CD2' ' B' ' 344' ' ' LEU . 69.6 mt -62.59 -41.5 99.0 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.17 -0.956 . . . . 1.06 110.034 -179.558 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 345' ' ' ASN . . . . . . . . . . . . . 62.9 t-20 -56.95 -49.78 74.64 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.244 -0.91 . . . . 1.36 109.665 -179.737 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 346' ' ' GLU . . . . . . . . . . . . . 4.5 tp10 -62.72 -34.41 77.11 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.167 -0.958 . . . . 1.65 110.14 -179.788 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 347' ' ' ALA . . . . . . . . . . . . . . . -59.26 -55.44 34.83 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.083 -1.01 . . . . 1.03 109.956 -179.602 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 348' ' ' LEU . . . . . 0.408 HD23 ' N ' ' A' ' 348' ' ' LEU . 3.9 mm? -61.19 -44.62 97.01 Favored 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.345 -0.847 . . . . 1.04 109.871 -179.552 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 349' ' ' GLU . . . . . . . . . . . . . 2.5 mt-10 -57.4 -33.46 67.87 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.359 -0.838 . . . . 1.94 109.93 -179.364 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 350' ' ' LEU . . . . . 0.454 ' O ' HD22 ' A' ' 350' ' ' LEU . 4.8 tt -63.29 -46.27 87.51 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.175 -0.953 . . . . 1.17 109.299 -179.604 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 351' ' ' LYS . . . . . . . . . . . . . 42.8 tttt -59.58 -37.61 78.97 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.42 -0.8 . . . . 1.97 109.312 179.946 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 352' ' ' ASP . . . . . . . . . . . . . 3.5 m-20 -57.43 -43.6 84.0 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.34 -0.85 . . . . 1.16 109.698 179.837 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 353' ' ' ALA . . . . . . . . . . . . . . . -67.65 -18.69 65.04 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.183 -0.948 . . . . 1.22 109.936 -179.357 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 354' ' ' GLN . . . . . . . . . . . . . 5.7 tt0 . . . . . 0 N--CA 1.49 1.529 0 O-C-N 121.086 -1.009 . . . . 1.71 109.445 -179.887 . . . . . . . . 0 0 . 1 . 027 nuclear orig core ' B' B ' 326' ' ' GLU . . . . . . . . . . . . . 5.4 mm-40 . . . . . 0 N--CA 1.487 1.379 0 N-CA-C 109.209 -0.663 . . . . 2.13 109.209 . . . . . . . . . 0 0 . 1 . 027 nuclear orig core ' B' B ' 327' ' ' TYR . . . . . . . . . . . . . 40.0 m-85 -149.36 107.22 3.69 Favored 'General case' 0 C--N 1.303 -1.421 0 O-C-N 121.183 -0.948 . . . . 0.99 109.824 -179.983 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' B' B ' 328' ' ' PHE . . . . . . . . . . . . . 45.3 m-85 -113.03 -166.13 1.05 Allowed 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.213 -0.929 . . . . 0.36 109.12 179.8 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' B' B ' 329' ' ' THR . . . . . . . . . . . . . 22.4 p -153.33 170.63 20.17 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.321 -0.862 . . . . 1.05 109.197 -179.934 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' B' B ' 330' ' ' LEU . . . . . . . . . . . . . 33.4 tp -150.64 130.64 13.42 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.22 -0.925 . . . . 1.07 110.023 -179.804 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' B' B ' 331' ' ' GLN . . . . . . . . . . . . . 12.6 tp60 -88.49 108.87 19.62 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.335 -0.853 . . . . 0.91 108.934 179.415 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' B' B ' 332' ' ' ILE . . . . . . . . . . . . . 30.4 mt -103.08 106.75 20.65 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.546 0 O-C-N 121.171 -0.955 . . . . 1.08 109.651 -179.621 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' B' B ' 333' ' ' ARG . . . . . 0.418 ' HG2' ' CE1' ' D' ' 327' ' ' TYR . 62.2 mtt180 -72.89 148.81 44.03 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.361 -0.837 . . . . 3.42 109.632 179.911 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' B' B ' 334' ' ' GLY . . . . . . . . . . . . . . . 83.16 129.9 1.52 Allowed Glycine 0 N--CA 1.49 2.281 0 N-CA-C 109.569 -1.412 . . . . 0.4 109.569 179.585 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' B' B ' 335' ' ' ARG . . . . . . . . . . . . . 16.7 ttt180 -79.88 -32.81 40.37 Favored 'General case' 0 N--CA 1.489 1.5 0 O-C-N 121.351 -1.087 . . . . 3.55 109.425 179.929 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' B' B ' 336' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -57.22 -62.42 1.78 Allowed 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.063 -1.023 . . . . 2.28 109.677 -179.853 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' B' B ' 337' ' ' ARG . . . . . . . . . . . . . 1.1 mmt180 -61.11 -30.61 70.46 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.223 -0.923 . . . . 3.64 109.625 -179.907 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' B' B ' 338' ' ' PHE . . . . . . . . . . . . . 69.0 t80 -54.4 -56.8 15.0 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.315 -0.865 . . . . 0.39 109.731 -179.82 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' B' B ' 339' ' ' GLU . . . . . . . . . . . . . 51.7 mt-10 -52.86 -35.59 57.79 Favored 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.24 -0.912 . . . . 1.98 109.824 -179.692 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' B' B ' 340' ' ' MET . . . . . . . . . . . . . 42.1 ttp -63.87 -46.46 84.82 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.211 -0.931 . . . . 1.14 109.874 -179.678 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' B' B ' 341' ' ' PHE . . . . . . . . . . . . . 39.6 m-85 -62.73 -46.12 89.58 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.212 -0.93 . . . . 0.22 110.055 -179.57 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' B' B ' 342' ' ' ARG . . . . . . . . . . . . . 23.0 ttt180 -48.98 -43.93 40.56 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.302 -0.874 . . . . 3.15 110.318 -179.584 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' B' B ' 343' ' ' GLU . . . . . . . . . . . . . 1.9 tp10 -58.14 -45.0 88.12 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.224 -0.922 . . . . 2.35 109.934 -179.309 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' B' B ' 344' ' ' LEU . . . . . 0.472 ' CD2' HD21 ' A' ' 344' ' ' LEU . 70.6 mt -62.68 -42.26 99.53 Favored 'General case' 0 N--CA 1.488 1.459 0 O-C-N 121.18 -0.95 . . . . 1.05 109.808 -179.693 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' B' B ' 345' ' ' ASN . . . . . . . . . . . . . 63.2 t-20 -55.9 -49.97 71.96 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.197 -0.939 . . . . 1.35 109.786 -179.804 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' B' B ' 346' ' ' GLU . . . . . . . . . . . . . 4.3 tp10 -62.98 -34.65 78.0 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.261 -0.899 . . . . 1.66 109.909 -179.584 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' B' B ' 347' ' ' ALA . . . . . . . . . . . . . . . -58.99 -55.79 30.57 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.072 -1.018 . . . . 1.02 110.047 -179.587 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' B' B ' 348' ' ' LEU . . . . . 0.436 ' N ' HD23 ' B' ' 348' ' ' LEU . 3.9 mm? -60.86 -45.05 96.06 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.213 -0.93 . . . . 1.05 109.804 -179.709 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' B' B ' 349' ' ' GLU . . . . . . . . . . . . . 2.6 mt-10 -57.21 -32.84 66.91 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.442 -0.786 . . . . 1.95 110.06 -179.509 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' B' B ' 350' ' ' LEU . . . . . 0.451 HD23 HD23 ' A' ' 350' ' ' LEU . 4.8 tt -63.82 -46.7 83.91 Favored 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.091 -1.006 . . . . 1.18 109.399 -179.685 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' B' B ' 351' ' ' LYS . . . . . . . . . . . . . 42.6 tttt -59.19 -37.15 76.69 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.299 -0.876 . . . . 1.96 109.294 179.716 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' B' B ' 352' ' ' ASP . . . . . . . . . . . . . 2.3 m-20 -57.84 -43.46 85.86 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.336 -0.853 . . . . 1.16 109.873 -179.979 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' B' B ' 353' ' ' ALA . . . . . . . . . . . . . . . -67.42 -19.4 65.37 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.313 -0.867 . . . . 1.21 109.834 -179.722 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' B' B ' 354' ' ' GLN . . . . . . . . . . . . . 5.7 tt0 . . . . . 0 N--CA 1.493 1.676 0 O-C-N 121.037 -1.039 . . . . 1.69 109.534 -179.713 . . . . . . . . 0 0 . 1 . 027 nuclear orig core ' C' C ' 326' ' ' GLU . . . . . . . . . . . . . 1.8 mt-10 . . . . . 0 N--CA 1.488 1.444 0 N-CA-C 109.066 -0.716 . . . . 2.17 109.066 . . . . . . . . . 0 0 . 1 . 027 nuclear orig core ' C' C ' 327' ' ' TYR . . . . . 0.47 ' CE1' ' HG2' ' A' ' 333' ' ' ARG . 39.9 m-85 -150.81 108.37 3.65 Favored 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.139 -0.976 . . . . 1.03 109.86 -179.99 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' C' C ' 328' ' ' PHE . . . . . . . . . . . . . 98.4 m-85 -113.79 -166.97 1.14 Allowed 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.149 -0.97 . . . . 0.37 109.453 179.731 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' C' C ' 329' ' ' THR . . . . . 0.412 ' HA ' ' O ' ' A' ' 330' ' ' LEU . 6.7 p -152.03 172.41 16.34 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.107 -0.996 . . . . 1.04 109.595 -179.929 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' C' C ' 330' ' ' LEU . . . . . . . . . . . . . 31.1 tp -151.69 130.14 12.15 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.137 -0.977 . . . . 1.09 109.757 -179.609 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' C' C ' 331' ' ' GLN . . . . . . . . . . . . . 2.4 tp60 -86.85 109.85 19.58 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.208 -0.933 . . . . 1.48 109.355 179.8 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' C' C ' 332' ' ' ILE . . . . . 0.512 HD12 ' CB ' ' C' ' 341' ' ' PHE . 70.1 mt -103.16 106.04 19.37 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.518 0 O-C-N 121.185 -0.947 . . . . 1.08 109.945 -179.616 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' C' C ' 333' ' ' ARG . . . . . 0.561 ' HG3' ' CE1' ' A' ' 327' ' ' TYR . 0.0 OUTLIER -72.27 151.61 42.69 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.381 -0.825 . . . . 3.36 109.174 179.588 . . . . . . . . 3 3 . 1 . 027 nuclear orig core ' C' C ' 334' ' ' GLY . . . . . . . . . . . . . . . 80.19 129.92 0.84 Allowed Glycine 0 N--CA 1.49 2.237 0 N-CA-C 109.434 -1.466 . . . . 0.35 109.434 -179.91 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' C' C ' 335' ' ' ARG . . . . . 0.476 ' HA ' ' CE2' ' A' ' 328' ' ' PHE . 10.1 ttp180 -79.18 -35.8 41.28 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.246 -1.15 . . . . 3.23 109.876 -179.678 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' C' C ' 336' ' ' GLU . . . . . . . . . . . . . 89.4 mt-10 -58.6 -63.01 1.44 Allowed 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.201 -0.937 . . . . 2.62 109.921 -179.697 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' C' C ' 337' ' ' ARG . . . . . 0.46 ' NH1' ' CG ' ' C' ' 337' ' ' ARG . 0.3 OUTLIER -59.16 -31.06 68.63 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.126 -0.983 . . . . 3.61 109.278 179.966 . . . . . . . . 3 3 . 1 . 027 nuclear orig core ' C' C ' 338' ' ' PHE . . . . . 0.461 ' HB3' ' O ' ' C' ' 335' ' ' ARG . 66.8 t80 -52.95 -58.58 6.48 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.272 -0.892 . . . . 0.43 109.071 179.57 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' C' C ' 339' ' ' GLU . . . . . . . . . . . . . 2.7 mm-40 -51.55 -31.29 23.84 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.341 -0.849 . . . . 2.05 109.741 179.713 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' C' C ' 340' ' ' MET . . . . . . . . . . . . . 29.5 ttp -63.74 -53.14 55.66 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.153 -0.967 . . . . 1.1 109.681 -179.811 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' C' C ' 341' ' ' PHE . . . . . 0.512 ' CB ' HD12 ' C' ' 332' ' ' ILE . 46.0 m-85 -60.58 -38.1 83.51 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.345 -0.847 . . . . 0.21 109.413 -179.989 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' C' C ' 342' ' ' ARG . . . . . . . . . . . . . 11.7 ttp180 -51.71 -53.14 42.54 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.449 -0.782 . . . . 3.42 110.283 -179.683 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' C' C ' 343' ' ' GLU . . . . . . . . . . . . . 15.9 tp10 -55.73 -42.16 74.93 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.199 -0.938 . . . . 2.14 110.26 -179.135 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' C' C ' 344' ' ' LEU . . . . . 0.471 ' O ' HD21 ' C' ' 348' ' ' LEU . 57.7 mt -61.83 -40.85 96.74 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.117 -0.99 . . . . 1.09 109.503 -179.706 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' C' C ' 345' ' ' ASN . . . . . 0.431 ' HB2' HD23 ' A' ' 330' ' ' LEU . 46.8 t-20 -57.6 -51.08 70.97 Favored 'General case' 0 C--N 1.303 -1.451 0 O-C-N 121.441 -0.787 . . . . 1.38 109.331 179.803 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' C' C ' 346' ' ' GLU . . . . . . . . . . . . . 3.6 tm-20 -61.75 -32.4 72.65 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.376 -0.828 . . . . 2.21 109.751 -179.993 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' C' C ' 347' ' ' ALA . . . . . . . . . . . . . . . -62.79 -52.85 61.56 Favored 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.249 -0.907 . . . . 1.03 109.821 -179.846 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' C' C ' 348' ' ' LEU . . . . . 0.506 HD23 ' N ' ' C' ' 348' ' ' LEU . 4.2 mm? -61.13 -48.89 79.54 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.284 -0.885 . . . . 1.06 109.644 -179.544 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' C' C ' 349' ' ' GLU . . . . . . . . . . . . . 61.1 mt-10 -58.71 -31.21 68.06 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.293 -0.88 . . . . 2.19 109.754 -179.797 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' C' C ' 350' ' ' LEU . . . . . 0.599 ' CD2' ' CD1' ' D' ' 350' ' ' LEU . 10.2 tt -63.37 -40.72 98.02 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.218 -0.926 . . . . 1.2 109.109 179.838 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' C' C ' 351' ' ' LYS . . . . . . . . . . . . . 36.1 tttm -61.4 -43.22 99.25 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.362 -0.836 . . . . 1.92 109.483 179.869 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' C' C ' 352' ' ' ASP . . . . . . . . . . . . . 4.4 m-20 -56.23 -49.04 75.27 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.246 -0.909 . . . . 1.19 109.551 -179.957 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' C' C ' 353' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.488 1.471 0 O-C-N 121.312 -0.868 . . . . 1.15 109.363 -179.886 . . . . . . . . 0 0 . 1 . 027 nuclear orig core ' D' D ' 326' ' ' GLU . . . . . . . . . . . . . 5.6 mm-40 . . . . . 0 N--CA 1.489 1.476 0 N-CA-C 109.039 -0.726 . . . . 2.13 109.039 . . . . . . . . . 0 0 . 1 . 027 nuclear orig core ' D' D ' 327' ' ' TYR . . . . . 0.418 ' CE1' ' HG2' ' B' ' 333' ' ' ARG . 41.2 m-85 -149.54 107.25 3.67 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.106 -0.996 . . . . 1.0 109.75 -179.899 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' D' D ' 328' ' ' PHE . . . . . . . . . . . . . 45.9 m-85 -112.99 -166.06 1.05 Allowed 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.336 -0.852 . . . . 0.34 109.458 179.708 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' D' D ' 329' ' ' THR . . . . . . . . . . . . . 30.8 p -153.07 170.46 20.41 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.167 -0.958 . . . . 1.05 109.348 179.879 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' D' D ' 330' ' ' LEU . . . . . . . . . . . . . 32.4 tp -150.46 130.41 13.4 Favored 'General case' 0 C--N 1.304 -1.41 0 O-C-N 121.125 -0.984 . . . . 1.07 109.911 -179.973 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' D' D ' 331' ' ' GLN . . . . . . . . . . . . . 11.0 tp60 -88.41 108.56 19.43 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.427 -0.795 . . . . 0.93 108.961 179.526 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' D' D ' 332' ' ' ILE . . . . . . . . . . . . . 25.3 mt -103.0 106.41 20.01 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.617 0 O-C-N 121.045 -1.034 . . . . 1.07 109.831 -179.632 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' D' D ' 333' ' ' ARG . . . . . . . . . . . . . 60.6 mtt180 -72.46 148.35 45.21 Favored 'General case' 0 N--CA 1.488 1.452 0 O-C-N 121.403 -0.811 . . . . 3.42 109.574 179.956 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' D' D ' 334' ' ' GLY . . . . . . . . . . . . . . . 83.47 130.43 1.71 Allowed Glycine 0 N--CA 1.492 2.37 0 N-CA-C 109.834 -1.306 . . . . 0.41 109.834 179.676 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' D' D ' 335' ' ' ARG . . . . . . . . . . . . . 19.5 ttt180 -79.82 -32.81 40.67 Favored 'General case' 0 N--CA 1.489 1.478 0 O-C-N 121.293 -1.122 . . . . 3.58 109.499 179.851 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' D' D ' 336' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -57.44 -63.49 1.21 Allowed 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.272 -0.892 . . . . 2.26 109.636 -179.91 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' D' D ' 337' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -60.45 -29.88 69.3 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.112 -0.992 . . . . 3.64 109.694 -179.983 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' D' D ' 338' ' ' PHE . . . . . . . . . . . . . 69.2 t80 -55.23 -56.7 16.95 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.224 -0.922 . . . . 0.4 109.648 -179.722 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' D' D ' 339' ' ' GLU . . . . . . . . . . . . . 52.9 mt-10 -52.53 -35.62 53.81 Favored 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.278 -0.889 . . . . 1.99 109.948 -179.824 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' D' D ' 340' ' ' MET . . . . . . . . . . . . . 42.4 ttp -63.94 -45.98 86.74 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.25 -0.906 . . . . 1.13 109.916 -179.615 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' D' D ' 341' ' ' PHE . . . . . . . . . . . . . 40.1 m-85 -63.44 -45.53 90.47 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.306 -0.871 . . . . 0.21 110.005 -179.464 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' D' D ' 342' ' ' ARG . . . . . . . . . . . . . 22.1 ttt180 -49.4 -43.5 44.47 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.172 -0.955 . . . . 3.15 110.145 -179.401 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' D' D ' 343' ' ' GLU . . . . . . . . . . . . . 2.1 tp10 -57.98 -45.44 86.75 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.138 -0.976 . . . . 2.35 109.96 -179.263 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' D' D ' 344' ' ' LEU . . . . . 0.41 ' O ' HD21 ' D' ' 348' ' ' LEU . 70.9 mt -62.5 -42.28 99.4 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.257 -0.902 . . . . 1.06 109.956 -179.661 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' D' D ' 345' ' ' ASN . . . . . . . . . . . . . 63.5 t-20 -56.27 -49.56 73.87 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.145 -0.972 . . . . 1.35 109.471 -179.723 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' D' D ' 346' ' ' GLU . . . . . . . . . . . . . 4.1 tp10 -62.64 -34.96 78.13 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.269 -0.894 . . . . 1.69 110.116 -179.932 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' D' D ' 347' ' ' ALA . . . . . . . . . . . . . . . -59.44 -56.04 27.09 Favored 'General case' 0 N--CA 1.493 1.692 0 O-C-N 120.984 -1.072 . . . . 1.03 110.104 -179.611 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' D' D ' 348' ' ' LEU . . . . . 0.458 ' N ' HD23 ' D' ' 348' ' ' LEU . 3.9 mm? -60.67 -44.84 95.99 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.156 -0.965 . . . . 1.04 109.789 -179.761 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' D' D ' 349' ' ' GLU . . . . . . . . . . . . . 2.5 mt-10 -57.71 -32.62 67.58 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.421 -0.8 . . . . 1.95 109.97 -179.45 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' D' D ' 350' ' ' LEU . . . . . 0.599 ' CD1' ' CD2' ' C' ' 350' ' ' LEU . 4.9 tt -63.8 -46.75 83.74 Favored 'General case' 0 N--CA 1.489 1.479 0 O-C-N 120.927 -1.108 . . . . 1.16 109.365 -179.79 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' D' D ' 351' ' ' LYS . . . . . . . . . . . . . 39.0 tttt -59.29 -36.7 76.07 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.443 -0.786 . . . . 1.97 109.413 -179.935 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' D' D ' 352' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -58.31 -43.08 87.99 Favored 'General case' 0 N--CA 1.489 1.475 0 O-C-N 121.34 -0.85 . . . . 1.17 109.634 -179.961 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' D' D ' 353' ' ' ALA . . . . . . . . . . . . . . . -67.59 -19.06 65.2 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.201 -0.937 . . . . 1.21 110.091 -179.413 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' D' D ' 354' ' ' GLN . . . . . . . . . . . . . 5.9 tt0 . . . . . 0 N--CA 1.489 1.516 0 O-C-N 121.285 -0.885 . . . . 1.68 109.554 -179.744 . . . . . . . . 0 0 . 1 . 028 nuclear orig core ' A' A ' 326' ' ' GLU . . . . . . . . . . . . . 32.2 mm-40 . . . . . 0 N--CA 1.488 1.447 0 CA-C-O 121.375 0.607 . . . . 2.13 109.594 . . . . . . . . . 0 0 . 1 . 028 nuclear orig core ' A' A ' 327' ' ' TYR . . . . . 0.407 ' CE1' ' HG2' ' C' ' 333' ' ' ARG . 39.4 m-85 -148.24 110.99 4.77 Favored 'General case' 0 C--N 1.303 -1.416 0 O-C-N 121.246 -0.909 . . . . 1.0 109.759 179.998 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 328' ' ' PHE . . . . . 0.474 ' O ' HG21 ' A' ' 329' ' ' THR . 29.5 m-85 -113.9 -171.78 1.96 Allowed 'General case' 0 C--N 1.301 -1.533 0 O-C-N 121.428 -0.795 . . . . 0.34 109.395 179.753 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 329' ' ' THR . . . . . 0.474 HG21 ' O ' ' A' ' 328' ' ' PHE . 3.3 p -149.16 167.0 27.14 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.307 -0.871 . . . . 1.05 109.059 179.898 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 330' ' ' LEU . . . . . 0.406 ' O ' ' HA ' ' C' ' 329' ' ' THR . 63.3 tp -149.82 129.29 13.01 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.313 -0.867 . . . . 1.07 109.762 -179.576 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 331' ' ' GLN . . . . . . . . . . . . . 1.1 tp60 -87.32 113.2 22.83 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.394 -0.816 . . . . 0.91 109.418 179.701 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 332' ' ' ILE . . . . . . . . . . . . . 69.7 mt -102.19 107.63 22.16 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.527 0 O-C-N 121.112 -0.993 . . . . 1.09 109.611 -179.959 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 333' ' ' ARG . . . . . 0.471 ' HG2' ' CE1' ' C' ' 327' ' ' TYR . 76.1 mtt180 -72.51 143.75 48.25 Favored 'General case' 0 C--N 1.303 -1.445 0 O-C-N 121.492 -0.755 . . . . 3.41 109.456 179.925 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 334' ' ' GLY . . . . . . . . . . . . . . . 85.43 128.26 1.98 Allowed Glycine 0 N--CA 1.49 2.252 0 N-CA-C 109.596 -1.402 . . . . 0.4 109.596 179.949 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 335' ' ' ARG . . . . . . . . . . . . . 9.2 ttp180 -77.06 -33.36 57.22 Favored 'General case' 0 C--N 1.303 -1.433 0 O-C-N 121.388 -1.066 . . . . 3.55 109.197 179.903 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 336' ' ' GLU . . . . . . . . . . . . . 15.1 mt-10 -59.19 -63.89 1.14 Allowed 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.326 -0.859 . . . . 2.29 109.936 -179.781 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 337' ' ' ARG . . . . . 0.46 ' NH1' ' CG ' ' A' ' 337' ' ' ARG . 0.0 OUTLIER -59.25 -29.83 67.83 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 120.985 -1.072 . . . . 3.64 109.496 -179.791 . . . . . . . . 3 3 . 1 . 028 nuclear orig core ' A' A ' 338' ' ' PHE . . . . . . . . . . . . . 66.5 t80 -55.3 -54.14 47.22 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.199 -0.938 . . . . 0.41 109.544 179.867 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 339' ' ' GLU . . . . . . . . . . . . . 44.6 mt-10 -53.89 -35.37 61.51 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.26 -0.9 . . . . 1.97 109.91 179.979 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 340' ' ' MET . . . . . . . . . . . . . 6.7 ttp -63.46 -52.74 60.12 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.17 -0.956 . . . . 1.14 110.442 -179.075 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 341' ' ' PHE . . . . . . . . . . . . . 51.7 m-85 -60.74 -42.38 97.22 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.05 -1.031 . . . . 0.21 109.816 -179.353 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 342' ' ' ARG . . . . . . . . . . . . . 60.6 ttt180 -50.86 -43.34 59.31 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.357 -0.84 . . . . 3.15 109.884 -179.73 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 343' ' ' GLU . . . . . . . . . . . . . 3.9 tt0 -59.67 -45.99 90.4 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.178 -0.951 . . . . 2.35 109.954 -179.553 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 344' ' ' LEU . . . . . . . . . . . . . 42.8 mt -61.3 -38.69 87.72 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.248 -0.907 . . . . 1.06 109.889 -179.625 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 345' ' ' ASN . . . . . . . . . . . . . 64.2 t-20 -57.77 -49.64 75.9 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.202 -0.936 . . . . 1.36 110.002 -179.773 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 346' ' ' GLU . . . . . . . . . . . . . 45.8 tt0 -60.78 -33.1 72.47 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.103 -0.998 . . . . 1.65 109.837 -179.666 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 347' ' ' ALA . . . . . . . . . . . . . . . -59.7 -55.4 34.81 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.058 -1.026 . . . . 1.03 110.013 -179.618 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 348' ' ' LEU . . . . . 0.451 ' N ' ' CD2' ' A' ' 348' ' ' LEU . 3.9 mm? -62.7 -40.22 96.46 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.167 -0.958 . . . . 1.04 109.909 -179.455 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 349' ' ' GLU . . . . . 0.444 ' OE2' ' HD3' ' C' ' 333' ' ' ARG . 7.3 mm-40 -57.65 -39.48 77.11 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.218 -0.926 . . . . 1.94 109.792 -179.431 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 350' ' ' LEU . . . . . 0.519 HD21 ' CD1' ' B' ' 350' ' ' LEU . 7.6 tt -61.86 -44.59 96.52 Favored 'General case' 0 N--CA 1.488 1.463 0 O-C-N 121.321 -0.862 . . . . 1.17 109.334 -179.972 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 351' ' ' LYS . . . . . . . . . . . . . 42.0 tttt -58.85 -43.5 90.81 Favored 'General case' 0 N--CA 1.488 1.468 0 O-C-N 121.326 -0.859 . . . . 1.97 109.235 179.98 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 352' ' ' ASP . . . . . . . . . . . . . 7.3 m-20 -56.65 -55.37 34.93 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.346 -0.846 . . . . 1.16 109.676 -179.976 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 353' ' ' ALA . . . . . . . . . . . . . . . -69.02 -11.45 60.8 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.23 -0.919 . . . . 1.22 109.386 179.937 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 354' ' ' GLN . . . . . . . . . . . . . 2.9 tt0 . . . . . 0 N--CA 1.489 1.511 0 O-C-N 121.181 -0.95 . . . . 1.71 109.488 -179.699 . . . . . . . . 0 0 . 1 . 028 nuclear orig core ' B' B ' 326' ' ' GLU . . . . . . . . . . . . . 30.9 mm-40 . . . . . 0 N--CA 1.49 1.565 0 CA-C-O 121.392 0.615 . . . . 2.13 109.522 . . . . . . . . . 0 0 . 1 . 028 nuclear orig core ' B' B ' 327' ' ' TYR . . . . . . . . . . . . . 38.0 m-85 -148.62 110.51 4.55 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.324 -0.86 . . . . 0.99 109.764 -179.695 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' B' B ' 328' ' ' PHE . . . . . 0.481 ' O ' HG21 ' B' ' 329' ' ' THR . 30.7 m-85 -114.3 -172.9 2.19 Favored 'General case' 0 N--CA 1.489 1.491 0 O-C-N 121.53 -0.731 . . . . 0.36 109.626 179.862 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' B' B ' 329' ' ' THR . . . . . 0.481 HG21 ' O ' ' B' ' 328' ' ' PHE . 3.2 p -148.36 167.19 25.89 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.096 -1.002 . . . . 1.05 109.143 -179.905 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' B' B ' 330' ' ' LEU . . . . . . . . . . . . . 62.0 tp -150.17 129.6 12.97 Favored 'General case' 0 C--N 1.303 -1.438 0 O-C-N 121.238 -0.914 . . . . 1.07 109.617 -179.501 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' B' B ' 331' ' ' GLN . . . . . . . . . . . . . 1.1 tp60 -87.47 114.17 23.84 Favored 'General case' 0 C--N 1.304 -1.412 0 O-C-N 121.3 -0.875 . . . . 0.91 109.007 179.608 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' B' B ' 332' ' ' ILE . . . . . . . . . . . . . 70.1 mt -102.87 106.75 20.59 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.465 0 O-C-N 121.227 -0.921 . . . . 1.08 109.256 -179.749 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' B' B ' 333' ' ' ARG . . . . . . . . . . . . . 74.9 mtt180 -71.78 144.42 49.2 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.157 -0.964 . . . . 3.42 109.458 -179.871 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' B' B ' 334' ' ' GLY . . . . . . . . . . . . . . . 84.75 128.39 1.79 Allowed Glycine 0 N--CA 1.489 2.229 0 N-CA-C 109.741 -1.344 . . . . 0.4 109.741 179.886 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' B' B ' 335' ' ' ARG . . . . . . . . . . . . . 8.5 ttp180 -77.42 -32.96 55.02 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.321 -1.106 . . . . 3.55 109.449 179.866 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' B' B ' 336' ' ' GLU . . . . . . . . . . . . . 14.1 mt-10 -59.77 -62.8 1.61 Allowed 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.242 -0.911 . . . . 2.28 109.843 -179.69 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' B' B ' 337' ' ' ARG . . . . . 0.472 ' CG ' ' NH1' ' B' ' 337' ' ' ARG . 0.0 OUTLIER -59.96 -30.04 68.83 Favored 'General case' 0 N--CA 1.488 1.472 0 O-C-N 121.166 -0.959 . . . . 3.64 109.354 -179.794 . . . . . . . . 3 3 . 1 . 028 nuclear orig core ' B' B ' 338' ' ' PHE . . . . . . . . . . . . . 66.8 t80 -55.39 -53.75 52.31 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.146 -0.971 . . . . 0.39 109.629 179.9 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' B' B ' 339' ' ' GLU . . . . . . . . . . . . . 49.3 mt-10 -53.84 -35.83 61.91 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.134 -0.979 . . . . 1.98 109.976 179.827 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' B' B ' 340' ' ' MET . . . . . . . . . . . . . 6.2 ttp -63.12 -52.21 63.48 Favored 'General case' 0 N--CA 1.495 1.785 0 O-C-N 121.196 -0.94 . . . . 1.14 110.649 -179.141 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' B' B ' 341' ' ' PHE . . . . . . . . . . . . . 49.5 m-85 -60.93 -43.49 98.57 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.13 -0.981 . . . . 0.22 109.59 -179.494 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' B' B ' 342' ' ' ARG . . . . . . . . . . . . . 61.7 ttt180 -49.99 -43.38 50.45 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.433 -0.792 . . . . 3.15 109.993 -179.841 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' B' B ' 343' ' ' GLU . . . . . . . . . . . . . 3.7 tt0 -59.88 -45.86 91.16 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.232 -0.918 . . . . 2.35 110.14 -179.536 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' B' B ' 344' ' ' LEU . . . . . . . . . . . . . 43.5 mt -61.84 -37.95 86.36 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.189 -0.945 . . . . 1.05 110.024 -179.621 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' B' B ' 345' ' ' ASN . . . . . . . . . . . . . 64.8 t-20 -58.23 -49.05 78.45 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.291 -0.88 . . . . 1.35 109.879 -179.708 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' B' B ' 346' ' ' GLU . . . . . . . . . . . . . 46.8 tt0 -60.98 -32.95 72.5 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.209 -0.932 . . . . 1.66 109.819 -179.669 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' B' B ' 347' ' ' ALA . . . . . . . . . . . . . . . -60.03 -56.18 24.87 Favored 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.101 -1.0 . . . . 1.02 110.009 -179.598 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' B' B ' 348' ' ' LEU . . . . . 0.49 ' N ' HD23 ' B' ' 348' ' ' LEU . 3.9 mm? -62.25 -40.36 95.94 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.284 -0.885 . . . . 1.05 109.866 -179.567 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' B' B ' 349' ' ' GLU . . . . . . . . . . . . . 7.2 mm-40 -57.43 -39.17 75.65 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 121.211 -0.93 . . . . 1.95 109.913 -179.648 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' B' B ' 350' ' ' LEU . . . . . 0.519 ' CD1' HD21 ' A' ' 350' ' ' LEU . 7.7 tt -62.35 -45.29 93.84 Favored 'General case' 0 N--CA 1.488 1.456 0 O-C-N 121.201 -0.937 . . . . 1.18 109.242 -179.786 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' B' B ' 351' ' ' LYS . . . . . . . . . . . . . 39.2 tttt -58.16 -43.94 87.69 Favored 'General case' 0 C--N 1.302 -1.457 0 O-C-N 121.297 -0.877 . . . . 1.96 109.286 179.975 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' B' B ' 352' ' ' ASP . . . . . . . . . . . . . 7.4 m-20 -56.13 -55.72 29.56 Favored 'General case' 0 N--CA 1.488 1.439 0 O-C-N 121.279 -0.888 . . . . 1.16 109.526 -179.953 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' B' B ' 353' ' ' ALA . . . . . . . . . . . . . . . -68.38 -12.35 60.98 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.153 -0.967 . . . . 1.21 109.777 179.977 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' B' B ' 354' ' ' GLN . . . . . 0.437 ' NE2' ' CD1' ' A' ' 350' ' ' LEU . 3.2 tt0 . . . . . 0 N--CA 1.492 1.666 0 O-C-N 121.326 -0.859 . . . . 1.69 109.683 -179.772 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' C' C ' 326' ' ' GLU . . . . . 0.492 ' HB3' ' CE2' ' C' ' 328' ' ' PHE . 13.5 mm-40 . . . . . 0 N--CA 1.49 1.562 0 N-CA-C 109.398 -0.593 . . . . 2.17 109.398 . . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' C' C ' 327' ' ' TYR . . . . . 0.471 ' CE1' ' HG2' ' A' ' 333' ' ' ARG . 38.4 m-85 -147.22 99.09 3.11 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.184 -0.948 . . . . 1.03 109.475 179.965 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' C' C ' 328' ' ' PHE . . . . . 0.492 ' CE2' ' HB3' ' C' ' 326' ' ' GLU . 95.0 m-85 -106.85 -167.03 1.23 Allowed 'General case' 0 N--CA 1.487 1.406 0 O-C-N 121.485 -0.759 . . . . 0.37 109.055 179.914 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' C' C ' 329' ' ' THR . . . . . 0.406 ' HA ' ' O ' ' A' ' 330' ' ' LEU . 41.5 p -150.98 169.0 22.86 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.31 -0.869 . . . . 1.04 109.353 179.967 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' C' C ' 330' ' ' LEU . . . . . . . . . . . . . 29.0 tp -148.72 127.52 12.58 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.214 -0.929 . . . . 1.09 109.622 -179.853 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' C' C ' 331' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -87.62 111.64 21.47 Favored 'General case' 0 N--CA 1.489 1.479 0 O-C-N 121.308 -0.87 . . . . 1.48 109.367 179.806 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' C' C ' 332' ' ' ILE . . . . . . . . . . . . . 7.3 mt -103.9 108.04 23.67 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.448 0 O-C-N 121.183 -0.948 . . . . 1.08 109.436 179.748 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' C' C ' 333' ' ' ARG . . . . . 0.485 ' NH1' ' HG2' ' C' ' 333' ' ' ARG . 0.0 OUTLIER -73.47 158.39 35.02 Favored 'General case' 0 C--N 1.303 -1.424 0 O-C-N 121.293 -0.879 . . . . 3.36 108.871 179.516 . . . . . . . . 3 3 . 1 . 028 nuclear orig core ' C' C ' 334' ' ' GLY . . . . . . . . . . . . . . . 74.04 125.94 0.13 Allowed Glycine 0 N--CA 1.491 2.303 0 N-CA-C 109.452 -1.459 . . . . 0.35 109.452 -179.929 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' C' C ' 335' ' ' ARG . . . . . 0.515 ' HG3' ' NH1' ' C' ' 335' ' ' ARG . 0.0 OUTLIER -74.75 -33.32 62.31 Favored 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.117 -1.226 . . . . 3.23 109.775 -179.861 . . . . . . . . 3 3 . 1 . 028 nuclear orig core ' C' C ' 336' ' ' GLU . . . . . . . . . . . . . 1.3 mt-10 -57.49 -59.84 4.55 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.115 -0.991 . . . . 2.62 109.678 -179.88 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' C' C ' 337' ' ' ARG . . . . . . . . . . . . . 1.7 mpt_? -61.16 -32.97 72.69 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.252 -0.905 . . . . 3.61 109.982 -179.688 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' C' C ' 338' ' ' PHE . . . . . . . . . . . . . 63.7 t80 -55.49 -61.62 2.22 Favored 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.041 -1.037 . . . . 0.43 109.615 -179.797 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' C' C ' 339' ' ' GLU . . . . . . . . . . . . . 1.1 mm-40 -49.38 -36.64 22.39 Favored 'General case' 0 C--N 1.3 -1.547 0 O-C-N 121.407 -0.808 . . . . 2.05 110.358 -179.114 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' C' C ' 340' ' ' MET . . . . . . . . . . . . . 37.9 ttp -63.9 -48.5 76.37 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.036 -1.04 . . . . 1.1 110.051 -179.212 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' C' C ' 341' ' ' PHE . . . . . . . . . . . . . 38.8 m-85 -61.37 -45.92 92.35 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 120.951 -1.093 . . . . 0.21 109.539 -179.763 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' C' C ' 342' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -47.63 -38.42 14.67 Favored 'General case' 0 N--CA 1.489 1.491 0 O-C-N 121.252 -0.905 . . . . 3.42 109.959 -179.804 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' C' C ' 343' ' ' GLU . . . . . . . . . . . . . 29.0 tp10 -59.04 -50.96 72.09 Favored 'General case' 0 N--CA 1.488 1.47 0 O-C-N 121.182 -0.949 . . . . 2.14 109.598 -179.906 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' C' C ' 344' ' ' LEU . . . . . . . . . . . . . 70.8 mt -62.37 -31.55 72.22 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.364 -0.835 . . . . 1.09 109.56 179.931 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' C' C ' 345' ' ' ASN . . . . . . . . . . . . . 18.7 t-20 -57.07 -58.36 8.52 Favored 'General case' 0 N--CA 1.487 1.412 0 O-C-N 121.254 -0.904 . . . . 1.38 109.564 179.928 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' C' C ' 346' ' ' GLU . . . . . . . . . . . . . 8.4 tm-20 -61.44 -27.87 68.87 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.46 -0.775 . . . . 2.21 110.028 -179.731 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' C' C ' 347' ' ' ALA . . . . . . . . . . . . . . . -62.93 -61.79 2.16 Favored 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.024 -1.048 . . . . 1.03 110.16 -179.651 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' C' C ' 348' ' ' LEU . . . . . 0.405 ' N ' ' CD2' ' C' ' 348' ' ' LEU . 4.2 mm? -60.59 -42.87 97.62 Favored 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.209 -0.932 . . . . 1.06 109.707 -179.72 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' C' C ' 349' ' ' GLU . . . . . . . . . . . . . 3.7 mm-40 -58.49 -35.98 73.06 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.11 -0.994 . . . . 2.19 109.834 -179.729 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' C' C ' 350' ' ' LEU . . . . . 0.555 HD23 ' CD2' ' D' ' 350' ' ' LEU . 4.1 tt -65.16 -39.59 93.18 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.048 -1.033 . . . . 1.2 109.043 179.766 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' C' C ' 351' ' ' LYS . . . . . . . . . . . . . 4.1 tttm -59.25 -40.82 87.19 Favored 'General case' 0 N--CA 1.488 1.452 0 O-C-N 121.394 -0.816 . . . . 1.92 109.108 179.914 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' C' C ' 352' ' ' ASP . . . . . . . . . . . . . 41.8 m-20 -57.73 -48.91 78.25 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.41 -0.806 . . . . 1.19 109.519 -179.996 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' C' C ' 353' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.487 1.42 0 O-C-N 121.42 -0.8 . . . . 1.15 109.537 -179.873 . . . . . . . . 0 0 . 1 . 028 nuclear orig core ' D' D ' 326' ' ' GLU . . . . . . . . . . . . . 32.9 mm-40 . . . . . 0 N--CA 1.49 1.574 0 N-CA-C 109.464 -0.569 . . . . 2.13 109.464 . . . . . . . . . 0 0 . 1 . 028 nuclear orig core ' D' D ' 327' ' ' TYR . . . . . . . . . . . . . 39.1 m-85 -148.45 110.67 4.63 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.187 -0.945 . . . . 1.0 109.574 179.916 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' D' D ' 328' ' ' PHE . . . . . 0.492 ' O ' HG21 ' D' ' 329' ' ' THR . 32.9 m-85 -114.06 -171.66 1.95 Allowed 'General case' 0 N--CA 1.488 1.437 0 O-C-N 121.297 -0.877 . . . . 0.34 109.402 179.925 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' D' D ' 329' ' ' THR . . . . . 0.492 HG21 ' O ' ' D' ' 328' ' ' PHE . 3.2 p -149.73 165.95 30.87 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.457 -0.777 . . . . 1.05 109.058 179.944 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' D' D ' 330' ' ' LEU . . . . . 0.409 ' O ' ' HA ' ' B' ' 329' ' ' THR . 63.0 tp -149.46 130.17 14.11 Favored 'General case' 0 C--N 1.303 -1.414 0 O-C-N 121.14 -0.975 . . . . 1.07 109.783 -179.534 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' D' D ' 331' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -87.27 113.12 22.72 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.396 -0.815 . . . . 0.93 109.302 179.838 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' D' D ' 332' ' ' ILE . . . . . . . . . . . . . 64.5 mt -101.89 106.09 19.11 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.41 0 O-C-N 121.15 -0.969 . . . . 1.07 109.467 -179.877 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' D' D ' 333' ' ' ARG . . . . . . . . . . . . . 72.6 mtt180 -71.74 142.54 49.77 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.476 -0.765 . . . . 3.42 109.552 179.952 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' D' D ' 334' ' ' GLY . . . . . . . . . . . . . . . 86.76 127.71 2.3 Favored Glycine 0 N--CA 1.489 2.209 0 N-CA-C 109.56 -1.416 . . . . 0.41 109.56 179.732 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' D' D ' 335' ' ' ARG . . . . . 0.458 ' HB2' ' CZ ' ' B' ' 328' ' ' PHE . 7.8 ttp180 -76.96 -33.66 57.65 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.129 -1.218 . . . . 3.58 109.31 -179.938 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' D' D ' 336' ' ' GLU . . . . . . . . . . . . . 12.3 mt-10 -58.6 -63.06 1.42 Allowed 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.414 -0.804 . . . . 2.26 110.093 -179.854 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' D' D ' 337' ' ' ARG . . . . . 0.456 ' NH1' ' CG ' ' D' ' 337' ' ' ARG . 0.0 OUTLIER -60.42 -29.25 68.87 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.085 -1.009 . . . . 3.64 109.307 -179.868 . . . . . . . . 3 3 . 1 . 028 nuclear orig core ' D' D ' 338' ' ' PHE . . . . . . . . . . . . . 66.6 t80 -55.83 -53.98 50.13 Favored 'General case' 0 N--CA 1.489 1.492 0 O-C-N 121.247 -0.908 . . . . 0.4 109.288 179.98 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' D' D ' 339' ' ' GLU . . . . . . . . . . . . . 53.4 mt-10 -53.94 -34.97 61.18 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.199 -0.938 . . . . 1.99 110.081 179.94 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' D' D ' 340' ' ' MET . . . . . . . . . . . . . 5.3 ttp -63.68 -52.75 59.26 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.258 -0.901 . . . . 1.13 110.263 -179.112 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' D' D ' 341' ' ' PHE . . . . . . . . . . . . . 50.5 m-85 -60.35 -42.86 96.6 Favored 'General case' 0 N--CA 1.496 1.827 0 O-C-N 121.087 -1.008 . . . . 0.21 109.807 -179.656 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' D' D ' 342' ' ' ARG . . . . . . . . . . . . . 62.2 ttt180 -50.66 -43.27 57.32 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.369 -0.832 . . . . 3.15 110.123 -179.844 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' D' D ' 343' ' ' GLU . . . . . . . . . . . . . 3.3 tt0 -59.68 -46.66 88.39 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.272 -0.893 . . . . 2.35 109.851 -179.712 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' D' D ' 344' ' ' LEU . . . . . . . . . . . . . 43.4 mt -61.07 -39.24 89.12 Favored 'General case' 0 N--CA 1.489 1.525 0 O-C-N 121.207 -0.933 . . . . 1.06 110.004 -179.465 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' D' D ' 345' ' ' ASN . . . . . . . . . . . . . 61.8 t-20 -56.99 -48.95 77.22 Favored 'General case' 0 N--CA 1.488 1.438 0 O-C-N 121.177 -0.952 . . . . 1.35 109.943 -179.768 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' D' D ' 346' ' ' GLU . . . . . . . . . . . . . 46.4 tt0 -61.15 -32.69 72.4 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 120.918 -1.114 . . . . 1.69 110.037 -179.52 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' D' D ' 347' ' ' ALA . . . . . . . . . . . . . . . -60.12 -56.5 20.86 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.073 -1.017 . . . . 1.03 110.104 -179.752 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' D' D ' 348' ' ' LEU . . . . . 0.496 ' N ' HD23 ' D' ' 348' ' ' LEU . 3.9 mm? -62.43 -40.35 96.28 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.141 -0.974 . . . . 1.04 109.881 -179.509 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' D' D ' 349' ' ' GLU . . . . . . . . . . . . . 10.3 mm-40 -57.3 -39.74 76.39 Favored 'General case' 0 N--CA 1.495 1.777 0 O-C-N 121.304 -0.872 . . . . 1.95 109.858 -179.568 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' D' D ' 350' ' ' LEU . . . . . 0.555 ' CD2' HD23 ' C' ' 350' ' ' LEU . 7.9 tt -61.89 -45.71 92.56 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.285 -0.885 . . . . 1.16 109.317 179.936 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' D' D ' 351' ' ' LYS . . . . . . . . . . . . . 34.4 tttt -58.05 -42.95 86.5 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.418 -0.802 . . . . 1.97 109.453 179.851 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' D' D ' 352' ' ' ASP . . . . . . . . . . . . . 8.0 m-20 -57.01 -54.88 41.69 Favored 'General case' 0 N--CA 1.488 1.448 0 O-C-N 121.262 -0.899 . . . . 1.17 109.473 -179.993 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' D' D ' 353' ' ' ALA . . . . . . . . . . . . . . . -69.2 -12.36 61.61 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.326 -0.859 . . . . 1.21 109.705 179.923 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' D' D ' 354' ' ' GLN . . . . . . . . . . . . . 3.2 tt0 . . . . . 0 N--CA 1.488 1.472 0 O-C-N 121.161 -0.962 . . . . 1.68 109.802 -179.918 . . . . . . . . 0 0 . 1 . 029 nuclear orig core ' A' A ' 326' ' ' GLU . . . . . . . . . . . . . 2.4 mt-10 . . . . . 0 N--CA 1.489 1.508 0 N-CA-C 109.151 -0.685 . . . . 2.13 109.151 . . . . . . . . . 0 0 . 1 . 029 nuclear orig core ' A' A ' 327' ' ' TYR . . . . . 0.53 ' CE1' ' HG2' ' C' ' 333' ' ' ARG . 46.3 m-85 -150.29 108.56 3.77 Favored 'General case' 0 N--CA 1.488 1.463 0 O-C-N 121.152 -0.967 . . . . 1.0 109.788 -179.888 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 328' ' ' PHE . . . . . 0.452 ' CZ ' ' HG3' ' C' ' 335' ' ' ARG . 86.6 m-85 -108.45 -161.86 0.79 Allowed 'General case' 0 N--CA 1.488 1.47 0 O-C-N 121.308 -0.87 . . . . 0.34 109.377 179.936 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 329' ' ' THR . . . . . . . . . . . . . 24.2 p -155.27 167.69 29.53 Favored 'General case' 0 N--CA 1.488 1.469 0 O-C-N 121.272 -0.892 . . . . 1.05 109.193 179.913 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 330' ' ' LEU . . . . . 0.418 ' O ' ' HA ' ' C' ' 329' ' ' THR . 24.4 tp -150.06 125.4 10.15 Favored 'General case' 0 N--CA 1.489 1.486 0 O-C-N 121.212 -0.93 . . . . 1.07 109.594 -179.924 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 331' ' ' GLN . . . . . . . . . . . . . 1.3 tt0 -87.01 115.69 24.56 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.316 -0.865 . . . . 0.91 109.209 179.857 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 332' ' ' ILE . . . . . 0.465 HD12 ' HB2' ' A' ' 341' ' ' PHE . 68.6 mt -103.61 113.98 41.96 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.511 0 O-C-N 121.217 -0.927 . . . . 1.09 109.588 -179.871 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 333' ' ' ARG . . . . . 0.417 ' HG2' ' CE1' ' C' ' 327' ' ' TYR . 31.6 mtt180 -72.74 151.84 41.94 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.313 -0.867 . . . . 3.41 109.404 179.9 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 334' ' ' GLY . . . . . . . . . . . . . . . 73.92 131.47 0.21 Allowed Glycine 0 N--CA 1.492 2.374 0 N-CA-C 109.589 -1.404 . . . . 0.4 109.589 -179.967 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 335' ' ' ARG . . . . . 0.428 ' HA ' ' CE1' ' C' ' 328' ' ' PHE . 0.1 OUTLIER -77.59 -35.29 53.06 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.283 -1.128 . . . . 3.55 109.463 -179.994 . . . . . . . . 3 3 . 1 . 029 nuclear orig core ' A' A ' 336' ' ' GLU . . . . . . . . . . . . . 45.3 mt-10 -57.59 -61.5 2.46 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.259 -0.901 . . . . 2.29 109.723 -179.843 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 337' ' ' ARG . . . . . . . . . . . . . 1.9 mtp180 -60.07 -31.35 69.91 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.273 -0.892 . . . . 3.64 109.571 -179.877 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 338' ' ' PHE . . . . . . . . . . . . . 44.5 t80 -54.89 -61.1 2.53 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.297 -0.877 . . . . 0.41 109.284 179.835 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 339' ' ' GLU . . . . . . . . . . . . . 93.4 mt-10 -51.43 -27.8 11.23 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.273 -0.892 . . . . 1.97 109.586 -179.941 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 340' ' ' MET . . . . . . . . . . . . . 26.9 ttp -64.74 -54.26 34.29 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.241 -0.912 . . . . 1.14 109.716 -179.903 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 341' ' ' PHE . . . . . 0.465 ' HB2' HD12 ' A' ' 332' ' ' ILE . 47.5 m-85 -61.79 -41.77 98.15 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.24 -0.912 . . . . 0.21 109.656 -179.746 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 342' ' ' ARG . . . . . . . . . . . . . 4.4 ttt180 -49.2 -42.2 39.44 Favored 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.3 -0.875 . . . . 3.15 109.524 179.988 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 343' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -59.2 -46.66 87.85 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.175 -0.953 . . . . 2.35 109.735 -179.835 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 344' ' ' LEU . . . . . 0.436 ' O ' HD21 ' A' ' 348' ' ' LEU . 36.6 mt -61.85 -31.82 72.11 Favored 'General case' 0 N--CA 1.489 1.486 0 O-C-N 121.144 -0.972 . . . . 1.06 109.559 -179.91 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 345' ' ' ASN . . . . . . . . . . . . . 26.5 t-20 -57.95 -57.31 13.37 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.231 -0.918 . . . . 1.36 109.683 -179.867 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 346' ' ' GLU . . . . . . . . . . . . . 20.3 tt0 -60.66 -28.32 68.5 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.306 -0.871 . . . . 1.65 109.912 -179.571 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 347' ' ' ALA . . . . . . . . . . . . . . . -60.47 -58.95 6.32 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.225 -0.922 . . . . 1.03 109.933 -179.805 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 348' ' ' LEU . . . . . 0.455 ' N ' ' CD2' ' A' ' 348' ' ' LEU . 4.0 mm? -62.23 -46.83 87.12 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.196 -0.94 . . . . 1.04 110.007 -179.482 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 349' ' ' GLU . . . . . . . . . . . . . 2.3 mt-10 -58.21 -29.05 65.37 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.22 -0.925 . . . . 1.94 109.965 -179.459 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 350' ' ' LEU . . . . . 0.474 ' CD2' ' C ' ' A' ' 350' ' ' LEU . 3.4 tt -64.17 -50.93 66.2 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.118 -0.989 . . . . 1.17 109.22 179.957 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 351' ' ' LYS . . . . . . . . . . . . . 24.7 tttt -60.03 -38.54 83.03 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.372 -0.83 . . . . 1.97 109.375 179.965 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 352' ' ' ASP . . . . . 0.43 ' OD1' ' NH2' ' C' ' 337' ' ' ARG . 16.9 m-20 -56.95 -44.78 82.91 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.206 -0.934 . . . . 1.16 109.756 179.997 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 353' ' ' ALA . . . . . . . . . . . . . . . -67.01 -20.1 65.81 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.29 -0.881 . . . . 1.22 109.798 -179.624 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 354' ' ' GLN . . . . . . . . . . . . . 1.5 mt-30 . . . . . 0 N--CA 1.49 1.569 0 O-C-N 121.06 -1.025 . . . . 1.71 109.561 -179.999 . . . . . . . . 0 0 . 1 . 029 nuclear orig core ' B' B ' 326' ' ' GLU . . . . . . . . . . . . . 2.4 mt-10 . . . . . 0 N--CA 1.49 1.572 0 N-CA-C 109.158 -0.682 . . . . 2.13 109.158 . . . . . . . . . 0 0 . 1 . 029 nuclear orig core ' B' B ' 327' ' ' TYR . . . . . 0.448 ' CE1' ' HG2' ' D' ' 333' ' ' ARG . 46.9 m-85 -150.24 108.55 3.77 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.163 -0.96 . . . . 0.99 109.815 -179.902 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' B' B ' 328' ' ' PHE . . . . . . . . . . . . . 86.5 m-85 -108.45 -162.18 0.81 Allowed 'General case' 0 N--CA 1.489 1.48 0 O-C-N 121.267 -0.895 . . . . 0.36 109.404 179.817 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' B' B ' 329' ' ' THR . . . . . 0.43 ' HA ' ' O ' ' D' ' 330' ' ' LEU . 24.2 p -155.11 167.52 30.09 Favored 'General case' 0 N--CA 1.489 1.491 0 O-C-N 121.27 -0.893 . . . . 1.05 109.283 179.795 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' B' B ' 330' ' ' LEU . . . . . 0.46 ' O ' ' HA ' ' D' ' 329' ' ' THR . 24.3 tp -149.79 125.74 10.55 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.171 -0.955 . . . . 1.07 109.531 -179.846 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' B' B ' 331' ' ' GLN . . . . . . . . . . . . . 1.3 tt0 -87.28 115.6 24.79 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.256 -0.902 . . . . 0.91 109.289 179.832 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' B' B ' 332' ' ' ILE . . . . . 0.457 HD12 ' HB2' ' B' ' 341' ' ' PHE . 68.4 mt -103.47 114.47 43.17 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.521 0 O-C-N 121.136 -0.978 . . . . 1.08 109.644 -179.971 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' B' B ' 333' ' ' ARG . . . . . 0.477 ' HG2' ' CE1' ' D' ' 327' ' ' TYR . 32.6 mtt180 -73.15 151.86 41.38 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.253 -0.904 . . . . 3.42 109.429 179.887 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' B' B ' 334' ' ' GLY . . . . . . . . . . . . . . . 73.88 131.2 0.2 Allowed Glycine 0 N--CA 1.491 2.327 0 N-CA-C 109.523 -1.431 . . . . 0.4 109.523 179.959 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' B' B ' 335' ' ' ARG . . . . . 0.42 ' HA ' ' CE1' ' D' ' 328' ' ' PHE . 0.1 OUTLIER -77.36 -35.34 54.62 Favored 'General case' 0 N--CA 1.488 1.47 0 O-C-N 121.294 -1.121 . . . . 3.55 109.477 -179.979 . . . . . . . . 3 3 . 1 . 029 nuclear orig core ' B' B ' 336' ' ' GLU . . . . . . . . . . . . . 46.3 mt-10 -57.22 -61.79 2.22 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.295 -0.878 . . . . 2.28 109.656 -179.926 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' B' B ' 337' ' ' ARG . . . . . . . . . . . . . 1.9 mtp180 -60.14 -30.99 69.67 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.249 -0.907 . . . . 3.64 109.611 -179.698 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' B' B ' 338' ' ' PHE . . . . . . . . . . . . . 44.8 t80 -55.21 -60.94 2.7 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.235 -0.916 . . . . 0.39 109.293 179.872 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' B' B ' 339' ' ' GLU . . . . . . . . . . . . . 93.4 mt-10 -51.4 -27.81 11.06 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.271 -0.893 . . . . 1.98 109.483 179.952 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' B' B ' 340' ' ' MET . . . . . . . . . . . . . 27.4 ttp -64.75 -54.21 34.91 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.351 -0.843 . . . . 1.14 109.698 -179.852 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' B' B ' 341' ' ' PHE . . . . . 0.457 ' HB2' HD12 ' B' ' 332' ' ' ILE . 46.9 m-85 -61.79 -42.07 98.53 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.317 -0.865 . . . . 0.22 109.656 -179.69 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' B' B ' 342' ' ' ARG . . . . . . . . . . . . . 4.3 ttt180 -49.01 -42.12 36.91 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.219 -0.926 . . . . 3.15 109.552 -179.95 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' B' B ' 343' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -59.24 -46.63 87.96 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.278 -0.889 . . . . 2.35 109.681 -179.797 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' B' B ' 344' ' ' LEU . . . . . 0.443 ' O ' HD21 ' B' ' 348' ' ' LEU . 36.2 mt -61.87 -31.93 72.24 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.178 -0.951 . . . . 1.05 109.559 -179.928 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' B' B ' 345' ' ' ASN . . . . . . . . . . . . . 27.1 t-20 -57.69 -57.67 11.7 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.326 -0.858 . . . . 1.35 109.759 -179.909 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' B' B ' 346' ' ' GLU . . . . . . . . . . . . . 20.4 tt0 -60.36 -28.29 68.07 Favored 'General case' 0 N--CA 1.489 1.525 0 O-C-N 121.385 -0.822 . . . . 1.66 109.916 -179.589 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' B' B ' 347' ' ' ALA . . . . . . . . . . . . . . . -60.7 -58.71 7.31 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.12 -0.988 . . . . 1.02 109.894 -179.732 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' B' B ' 348' ' ' LEU . . . . . 0.464 ' CD2' ' N ' ' B' ' 348' ' ' LEU . 4.0 mm? -62.1 -47.2 85.67 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.23 -0.918 . . . . 1.05 109.955 -179.563 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' B' B ' 349' ' ' GLU . . . . . . . . . . . . . 2.3 mt-10 -57.95 -29.05 64.87 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.233 -0.917 . . . . 1.95 109.967 -179.458 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' B' B ' 350' ' ' LEU . . . . . 0.471 ' C ' ' CD2' ' B' ' 350' ' ' LEU . 3.5 tt -64.17 -51.11 65.38 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.15 -0.969 . . . . 1.18 109.207 179.871 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' B' B ' 351' ' ' LYS . . . . . . . . . . . . . 24.1 tttt -59.81 -38.43 81.95 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.403 -0.811 . . . . 1.96 109.41 -179.938 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' B' B ' 352' ' ' ASP . . . . . . . . . . . . . 18.1 m-20 -57.07 -44.88 83.51 Favored 'General case' 0 N--CA 1.491 1.625 0 O-C-N 121.334 -0.854 . . . . 1.16 109.773 -179.971 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' B' B ' 353' ' ' ALA . . . . . . . . . . . . . . . -66.88 -19.9 65.82 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.208 -0.933 . . . . 1.21 109.742 -179.572 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' B' B ' 354' ' ' GLN . . . . . . . . . . . . . 1.6 mt-30 . . . . . 0 N--CA 1.491 1.595 0 O-C-N 121.215 -0.928 . . . . 1.69 109.527 -179.973 . . . . . . . . 0 0 . 1 . 029 nuclear orig core ' C' C ' 326' ' ' GLU . . . . . . . . . . . . . 80.2 mm-40 . . . . . 0 N--CA 1.49 1.545 0 N-CA-C 109.146 -0.687 . . . . 2.17 109.146 . . . . . . . . . 0 0 . 1 . 029 nuclear orig core ' C' C ' 327' ' ' TYR . . . . . 0.417 ' CE1' ' HG2' ' A' ' 333' ' ' ARG . 55.5 m-85 -149.57 107.14 3.65 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.058 -1.026 . . . . 1.03 109.816 -179.744 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' C' C ' 328' ' ' PHE . . . . . 0.428 ' CE1' ' HA ' ' A' ' 335' ' ' ARG . 80.8 m-85 -107.16 -162.86 0.87 Allowed 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.126 -0.984 . . . . 0.37 109.36 179.663 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' C' C ' 329' ' ' THR . . . . . 0.418 ' HA ' ' O ' ' A' ' 330' ' ' LEU . 34.0 p -155.23 163.31 40.35 Favored 'General case' 0 N--CA 1.489 1.497 0 O-C-N 121.272 -0.892 . . . . 1.04 109.259 179.915 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' C' C ' 330' ' ' LEU . . . . . . . . . . . . . 48.5 tp -149.55 128.56 12.67 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.235 -0.916 . . . . 1.09 109.555 -179.767 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' C' C ' 331' ' ' GLN . . . . . . . . . . . . . 1.1 tt0 -86.29 117.72 25.28 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.231 -0.918 . . . . 1.48 109.251 179.881 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' C' C ' 332' ' ' ILE . . . . . . . . . . . . . 40.6 mt -103.38 112.36 36.57 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.557 0 O-C-N 121.244 -0.91 . . . . 1.08 109.714 -179.805 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' C' C ' 333' ' ' ARG . . . . . 0.53 ' HG2' ' CE1' ' A' ' 327' ' ' TYR . 0.1 OUTLIER -74.25 136.34 42.69 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.303 -0.873 . . . . 3.36 109.546 179.847 . . . . . . . . 3 3 . 1 . 029 nuclear orig core ' C' C ' 334' ' ' GLY . . . . . . . . . . . . . . . 87.52 132.81 3.79 Favored Glycine 0 N--CA 1.492 2.388 0 N-CA-C 109.741 -1.344 . . . . 0.35 109.741 179.692 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' C' C ' 335' ' ' ARG . . . . . 0.452 ' HG3' ' CZ ' ' A' ' 328' ' ' PHE . 1.8 tmm_? -80.43 -38.06 30.84 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.292 -1.122 . . . . 3.23 109.724 -179.971 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' C' C ' 336' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -56.44 -58.22 8.95 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.13 -0.981 . . . . 2.62 109.67 -179.831 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' C' C ' 337' ' ' ARG . . . . . 0.43 ' NH2' ' OD1' ' A' ' 352' ' ' ASP . 0.4 OUTLIER -60.63 -30.14 69.68 Favored 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.28 -0.887 . . . . 3.61 109.657 -179.803 . . . . . . . . 3 3 . 1 . 029 nuclear orig core ' C' C ' 338' ' ' PHE . . . . . 0.403 ' HB3' ' O ' ' C' ' 335' ' ' ARG . 61.1 t80 -56.01 -55.91 27.06 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.152 -0.968 . . . . 0.43 109.87 -179.841 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' C' C ' 339' ' ' GLU . . . . . . . . . . . . . 5.1 mt-10 -50.16 -34.14 21.39 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.11 -0.994 . . . . 2.05 109.887 -179.735 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' C' C ' 340' ' ' MET . . . . . . . . . . . . . 3.5 ttt -62.98 -50.2 71.7 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.118 -0.989 . . . . 1.1 109.889 -179.702 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' C' C ' 341' ' ' PHE . . . . . . . . . . . . . 37.1 m-85 -62.14 -49.62 75.15 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.087 -1.008 . . . . 0.21 110.113 -179.664 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' C' C ' 342' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -47.86 -38.71 16.79 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.222 -0.924 . . . . 3.42 110.011 -179.655 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' C' C ' 343' ' ' GLU . . . . . . . . . . . . . 2.5 tt0 -58.27 -49.47 77.03 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.143 -0.973 . . . . 2.14 109.579 -179.823 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' C' C ' 344' ' ' LEU . . . . . 0.443 HD23 ' CD2' ' D' ' 344' ' ' LEU . 81.3 mt -63.52 -33.52 75.76 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.257 -0.902 . . . . 1.09 109.836 -179.971 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' C' C ' 345' ' ' ASN . . . . . 0.418 ' C ' ' OD1' ' C' ' 345' ' ' ASN . 16.6 t-20 -57.5 -58.76 6.86 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.192 -0.942 . . . . 1.38 109.732 -179.791 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' C' C ' 346' ' ' GLU . . . . . . . . . . . . . 1.3 tt0 -60.46 -26.61 66.89 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.192 -0.943 . . . . 2.21 109.57 -179.603 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' C' C ' 347' ' ' ALA . . . . . . . . . . . . . . . -62.9 -56.69 15.0 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.185 -0.947 . . . . 1.03 109.738 179.923 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' C' C ' 348' ' ' LEU . . . . . 0.5 HD23 ' N ' ' C' ' 348' ' ' LEU . 4.2 mm? -61.73 -47.97 82.82 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.245 -0.909 . . . . 1.06 110.061 -179.672 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' C' C ' 349' ' ' GLU . . . . . . . . . . . . . 47.9 mm-40 -57.78 -34.6 69.75 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.25 -0.906 . . . . 2.19 110.269 -179.229 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' C' C ' 350' ' ' LEU . . . . . 0.455 HD23 HD23 ' D' ' 350' ' ' LEU . 5.4 tt -63.98 -45.88 87.07 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.11 -0.994 . . . . 1.2 109.221 -179.887 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' C' C ' 351' ' ' LYS . . . . . . . . . . . . . 12.7 tttp -60.15 -46.45 89.62 Favored 'General case' 0 N--CA 1.488 1.426 0 O-C-N 121.455 -0.778 . . . . 1.92 109.381 179.892 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' C' C ' 352' ' ' ASP . . . . . . . . . . . . . 76.6 m-20 -57.7 -37.93 74.34 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.351 -0.843 . . . . 1.19 109.565 -179.967 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' C' C ' 353' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.493 1.676 0 O-C-N 121.287 -0.883 . . . . 1.15 109.767 -179.809 . . . . . . . . 0 0 . 1 . 029 nuclear orig core ' D' D ' 326' ' ' GLU . . . . . . . . . . . . . 2.4 mt-10 . . . . . 0 N--CA 1.489 1.498 0 N-CA-C 109.287 -0.634 . . . . 2.13 109.287 . . . . . . . . . 0 0 . 1 . 029 nuclear orig core ' D' D ' 327' ' ' TYR . . . . . 0.477 ' CE1' ' HG2' ' B' ' 333' ' ' ARG . 47.2 m-85 -150.12 108.42 3.77 Favored 'General case' 0 N--CA 1.489 1.485 0 O-C-N 121.162 -0.961 . . . . 1.0 109.818 -179.803 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' D' D ' 328' ' ' PHE . . . . . 0.42 ' CE1' ' HA ' ' B' ' 335' ' ' ARG . 87.4 m-85 -108.25 -161.96 0.8 Allowed 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.302 -0.874 . . . . 0.34 109.433 179.771 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' D' D ' 329' ' ' THR . . . . . 0.46 ' HA ' ' O ' ' B' ' 330' ' ' LEU . 23.6 p -155.24 167.64 29.71 Favored 'General case' 0 N--CA 1.489 1.49 0 O-C-N 121.253 -0.905 . . . . 1.05 109.244 179.864 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' D' D ' 330' ' ' LEU . . . . . 0.43 ' O ' ' HA ' ' B' ' 329' ' ' THR . 24.0 tp -149.98 125.51 10.27 Favored 'General case' 0 N--CA 1.489 1.478 0 O-C-N 121.195 -0.941 . . . . 1.07 109.605 -179.951 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' D' D ' 331' ' ' GLN . . . . . . . . . . . . . 1.3 tt0 -87.03 115.6 24.52 Favored 'General case' 0 N--CA 1.488 1.471 0 O-C-N 121.245 -0.909 . . . . 0.93 109.23 179.837 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' D' D ' 332' ' ' ILE . . . . . 0.466 HD12 ' HB2' ' D' ' 341' ' ' PHE . 69.9 mt -103.55 114.24 42.59 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.507 0 O-C-N 121.177 -0.952 . . . . 1.07 109.537 -179.898 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' D' D ' 333' ' ' ARG . . . . . 0.448 ' HG2' ' CE1' ' B' ' 327' ' ' TYR . 32.9 mtt180 -72.83 151.98 41.76 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.321 -0.862 . . . . 3.42 109.391 179.835 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' D' D ' 334' ' ' GLY . . . . . . . . . . . . . . . 73.64 131.38 0.19 Allowed Glycine 0 N--CA 1.491 2.33 0 N-CA-C 109.546 -1.422 . . . . 0.41 109.546 179.902 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' D' D ' 335' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -77.45 -35.36 53.99 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.269 -1.136 . . . . 3.58 109.453 -179.986 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' D' D ' 336' ' ' GLU . . . . . . . . . . . . . 47.8 mt-10 -57.33 -61.6 2.36 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.251 -0.906 . . . . 2.26 109.647 -179.909 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' D' D ' 337' ' ' ARG . . . . . . . . . . . . . 1.9 mtp180 -60.18 -31.03 69.73 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.304 -0.873 . . . . 3.64 109.64 -179.755 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' D' D ' 338' ' ' PHE . . . . . . . . . . . . . 45.2 t80 -55.18 -60.72 3.0 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.301 -0.874 . . . . 0.4 109.279 179.909 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' D' D ' 339' ' ' GLU . . . . . . . . . . . . . 92.9 mt-10 -51.62 -27.86 12.58 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.401 -0.812 . . . . 1.99 109.565 179.988 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' D' D ' 340' ' ' MET . . . . . . . . . . . . . 28.0 ttp -64.73 -54.2 35.26 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.204 -0.935 . . . . 1.13 109.748 -179.953 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' D' D ' 341' ' ' PHE . . . . . 0.466 ' HB2' HD12 ' D' ' 332' ' ' ILE . 47.3 m-85 -61.78 -41.92 98.34 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.222 -0.924 . . . . 0.21 109.713 -179.728 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' D' D ' 342' ' ' ARG . . . . . . . . . . . . . 4.5 ttt180 -49.25 -41.77 38.61 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.264 -0.898 . . . . 3.15 109.563 -179.972 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' D' D ' 343' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -59.59 -46.64 88.34 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.361 -0.837 . . . . 2.35 109.63 -179.839 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' D' D ' 344' ' ' LEU . . . . . 0.45 ' O ' HD21 ' D' ' 348' ' ' LEU . 36.7 mt -61.99 -31.63 72.01 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.132 -0.98 . . . . 1.06 109.515 -179.939 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' D' D ' 345' ' ' ASN . . . . . . . . . . . . . 26.7 t-20 -58.07 -57.15 14.09 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.174 -0.954 . . . . 1.35 109.736 -179.868 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' D' D ' 346' ' ' GLU . . . . . . . . . . . . . 19.3 tt0 -60.75 -28.28 68.58 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.358 -0.839 . . . . 1.69 109.916 -179.542 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' D' D ' 347' ' ' ALA . . . . . . . . . . . . . . . -60.89 -58.56 7.91 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.189 -0.944 . . . . 1.03 109.83 -179.71 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' D' D ' 348' ' ' LEU . . . . . 0.46 ' CD2' ' N ' ' D' ' 348' ' ' LEU . 4.0 mm? -62.22 -47.01 86.3 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.19 -0.944 . . . . 1.04 109.98 -179.514 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' D' D ' 349' ' ' GLU . . . . . . . . . . . . . 2.4 mt-10 -58.25 -29.03 65.44 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.168 -0.957 . . . . 1.95 110.04 -179.493 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' D' D ' 350' ' ' LEU . . . . . 0.485 ' C ' ' CD2' ' D' ' 350' ' ' LEU . 3.5 tt -63.98 -50.87 66.86 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.141 -0.974 . . . . 1.16 109.235 179.818 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' D' D ' 351' ' ' LYS . . . . . . . . . . . . . 24.2 tttt -59.94 -38.53 82.67 Favored 'General case' 0 N--CA 1.489 1.487 0 O-C-N 121.44 -0.787 . . . . 1.97 109.47 179.915 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' D' D ' 352' ' ' ASP . . . . . . . . . . . . . 19.9 m-20 -57.19 -44.34 83.5 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.202 -0.936 . . . . 1.17 109.797 -179.94 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' D' D ' 353' ' ' ALA . . . . . . . . . . . . . . . -67.26 -20.2 65.62 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.232 -0.917 . . . . 1.21 109.743 -179.652 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' D' D ' 354' ' ' GLN . . . . . 0.439 ' NE2' HD13 ' C' ' 350' ' ' LEU . 1.5 mt-30 . . . . . 0 N--CA 1.491 1.577 0 O-C-N 121.115 -0.991 . . . . 1.68 109.554 -179.925 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 326' ' ' GLU . . . . . . . . . . . . . 8.6 mt-10 . . . . . 0 N--CA 1.487 1.38 0 N-CA-C 109.457 -0.571 . . . . 2.13 109.457 . . . . . . . . . 0 0 . 1 . 030 nuclear orig core ' A' A ' 327' ' ' TYR . . . . . 0.564 ' CE1' ' HG2' ' C' ' 333' ' ' ARG . 44.9 m-85 -149.08 107.96 3.87 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.082 -1.011 . . . . 1.0 109.885 -179.529 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 328' ' ' PHE . . . . . 0.454 ' O ' HG21 ' A' ' 329' ' ' THR . 18.4 m-85 -112.88 -166.72 1.1 Allowed 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.341 -0.849 . . . . 0.34 109.389 179.912 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 329' ' ' THR . . . . . 0.454 HG21 ' O ' ' A' ' 328' ' ' PHE . 13.6 p -153.88 169.53 23.19 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.431 -0.793 . . . . 1.05 109.012 179.98 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 330' ' ' LEU . . . . . . . . . . . . . 18.2 tp -151.51 134.23 15.61 Favored 'General case' 0 C--N 1.302 -1.457 0 O-C-N 121.176 -0.952 . . . . 1.07 109.561 179.758 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 331' ' ' GLN . . . . . . . . . . . . . 2.1 tp60 -86.66 114.19 23.16 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.204 -0.935 . . . . 0.91 109.413 179.835 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 332' ' ' ILE . . . . . 0.502 ' CG2' ' HA ' ' A' ' 338' ' ' PHE . 64.0 mt -103.17 101.65 12.5 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.392 0 O-C-N 121.323 -0.861 . . . . 1.09 109.331 179.835 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 333' ' ' ARG . . . . . . . . . . . . . 57.3 mtt180 -71.86 152.72 42.4 Favored 'General case' 0 N--CA 1.487 1.409 0 O-C-N 121.403 -0.81 . . . . 3.41 109.829 -179.516 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 334' ' ' GLY . . . . . . . . . . . . . . . 76.27 131.36 0.39 Allowed Glycine 0 N--CA 1.489 2.224 0 N-CA-C 109.813 -1.315 . . . . 0.4 109.813 179.974 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 335' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -74.61 -34.85 62.91 Favored 'General case' 0 N--CA 1.488 1.449 0 O-C-N 121.181 -1.188 . . . . 3.55 109.743 -179.867 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 336' ' ' GLU . . . . . . . . . . . . . 15.1 mt-10 -58.82 -58.35 9.0 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.195 -0.941 . . . . 2.29 109.777 -179.864 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 337' ' ' ARG . . . . . . . . . . . . . 5.8 mmt180 -60.73 -36.2 78.26 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.082 -1.011 . . . . 3.64 109.754 -179.783 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 338' ' ' PHE . . . . . 0.502 ' HA ' ' CG2' ' A' ' 332' ' ' ILE . 59.7 t80 -53.89 -60.89 2.74 Favored 'General case' 0 C--N 1.302 -1.486 0 O-C-N 120.95 -1.094 . . . . 0.41 109.419 179.978 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 339' ' ' GLU . . . . . . . . . . . . . 73.8 mt-10 -49.44 -36.31 22.05 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.384 -0.823 . . . . 1.97 110.64 -179.432 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 340' ' ' MET . . . . . . . . . . . . . 48.2 ttp -63.28 -49.65 73.21 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 120.979 -1.076 . . . . 1.14 110.145 -179.417 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 341' ' ' PHE . . . . . . . . . . . . . 52.7 m-85 -62.52 -46.17 89.62 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.308 -0.87 . . . . 0.21 109.636 -179.546 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 342' ' ' ARG . . . . . . . . . . . . . 12.6 ttp180 -47.43 -43.89 24.27 Favored 'General case' 0 N--CA 1.493 1.711 0 O-C-N 121.401 -0.812 . . . . 3.15 109.928 -179.579 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 343' ' ' GLU . . . . . . . . . . . . . 29.1 tt0 -58.6 -48.51 80.71 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.372 -0.83 . . . . 2.35 109.869 -179.517 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 344' ' ' LEU . . . . . . . . . . . . . 55.3 mt -60.97 -30.79 70.47 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.196 -0.94 . . . . 1.06 109.566 -179.671 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 345' ' ' ASN . . . . . . . . . . . . . 11.3 t-20 -57.8 -59.59 5.0 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.252 -0.905 . . . . 1.36 109.635 -179.943 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 346' ' ' GLU . . . . . . . . . . . . . 79.4 tt0 -60.01 -24.78 64.76 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.148 -0.97 . . . . 1.65 109.652 -179.767 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 347' ' ' ALA . . . . . . . . . . . . . . . -61.84 -61.61 2.38 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.376 -0.827 . . . . 1.03 109.75 179.809 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 348' ' ' LEU . . . . . 0.456 ' N ' HD23 ' A' ' 348' ' ' LEU . 3.8 mm? -61.39 -46.67 89.19 Favored 'General case' 0 N--CA 1.495 1.812 0 O-C-N 121.31 -0.869 . . . . 1.04 109.868 -179.604 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 349' ' ' GLU . . . . . . . . . . . . . 25.8 mm-40 -56.44 -34.0 66.4 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.235 -0.916 . . . . 1.94 109.736 -179.456 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 350' ' ' LEU . . . . . 0.491 HD23 HD23 ' B' ' 350' ' ' LEU . 5.8 tt -62.5 -47.03 85.76 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.197 -0.939 . . . . 1.17 109.02 -179.936 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 351' ' ' LYS . . . . . . . . . . . . . 6.3 tttt -57.44 -43.36 83.83 Favored 'General case' 0 C--N 1.302 -1.489 0 O-C-N 121.329 -0.857 . . . . 1.97 109.385 179.621 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 352' ' ' ASP . . . . . . . . . . . . . 23.1 m-20 -55.87 -40.1 72.46 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.275 -0.891 . . . . 1.16 109.397 179.857 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 353' ' ' ALA . . . . . . . . . . . . . . . -69.01 -26.65 65.11 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.37 -0.831 . . . . 1.22 109.736 -179.901 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 354' ' ' GLN . . . . . . . . . . . . . 5.1 tt0 . . . . . 0 N--CA 1.495 1.782 0 O-C-N 121.116 -0.99 . . . . 1.71 109.877 -179.893 . . . . . . . . 0 0 . 1 . 030 nuclear orig core ' B' B ' 326' ' ' GLU . . . . . . . . . . . . . 6.2 mt-10 . . . . . 0 N--CA 1.489 1.48 0 N-CA-C 109.282 -0.636 . . . . 2.13 109.282 . . . . . . . . . 0 0 . 1 . 030 nuclear orig core ' B' B ' 327' ' ' TYR . . . . . 0.404 ' CE1' ' HD3' ' D' ' 333' ' ' ARG . 41.3 m-85 -149.37 108.94 3.99 Favored 'General case' 0 C--N 1.303 -1.429 0 O-C-N 121.324 -0.86 . . . . 0.99 109.684 -179.843 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' B' B ' 328' ' ' PHE . . . . . 0.449 ' O ' HG21 ' B' ' 329' ' ' THR . 18.9 m-85 -113.0 -166.96 1.13 Allowed 'General case' 0 C--N 1.302 -1.476 0 O-C-N 121.273 -0.892 . . . . 0.36 109.366 179.964 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' B' B ' 329' ' ' THR . . . . . 0.449 HG21 ' O ' ' B' ' 328' ' ' PHE . 16.5 p -153.9 169.2 24.01 Favored 'General case' 0 N--CA 1.488 1.463 0 O-C-N 121.351 -0.843 . . . . 1.05 108.994 179.611 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' B' B ' 330' ' ' LEU . . . . . . . . . . . . . 18.1 tp -151.53 134.42 15.73 Favored 'General case' 0 N--CA 1.491 1.625 0 O-C-N 121.334 -0.854 . . . . 1.07 109.673 179.796 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' B' B ' 331' ' ' GLN . . . . . . . . . . . . . 2.1 tp60 -86.94 114.58 23.69 Favored 'General case' 0 C--N 1.302 -1.47 0 O-C-N 121.416 -0.803 . . . . 0.91 109.66 179.672 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' B' B ' 332' ' ' ILE . . . . . 0.467 ' CG2' ' HA ' ' B' ' 338' ' ' PHE . 58.0 mt -103.03 101.93 12.89 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.458 0 O-C-N 121.245 -0.909 . . . . 1.08 109.181 179.751 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' B' B ' 333' ' ' ARG . . . . . . . . . . . . . 54.7 mtt180 -72.1 152.14 42.56 Favored 'General case' 0 N--CA 1.488 1.456 0 O-C-N 121.259 -0.901 . . . . 3.42 109.613 -179.71 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' B' B ' 334' ' ' GLY . . . . . . . . . . . . . . . 77.51 130.42 0.49 Allowed Glycine 0 N--CA 1.491 2.33 0 N-CA-C 109.795 -1.322 . . . . 0.4 109.795 179.735 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' B' B ' 335' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -74.22 -34.56 63.73 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.165 -1.197 . . . . 3.55 109.759 179.9 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' B' B ' 336' ' ' GLU . . . . . . . . . . . . . 11.4 mt-10 -59.22 -58.28 9.34 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.199 -0.938 . . . . 2.28 109.688 -179.697 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' B' B ' 337' ' ' ARG . . . . . . . . . . . . . 5.1 mmt180 -60.81 -36.13 78.28 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.441 -0.787 . . . . 3.64 109.655 -179.674 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' B' B ' 338' ' ' PHE . . . . . 0.467 ' HA ' ' CG2' ' B' ' 332' ' ' ILE . 62.7 t80 -54.23 -60.07 3.83 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.233 -0.917 . . . . 0.39 109.435 179.884 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' B' B ' 339' ' ' GLU . . . . . . . . . . . . . 80.8 mt-10 -49.9 -36.56 27.91 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.262 -0.899 . . . . 1.98 110.379 -179.64 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' B' B ' 340' ' ' MET . . . . . . . . . . . . . 47.9 ttp -63.38 -50.32 70.35 Favored 'General case' 0 N--CA 1.494 1.76 0 O-C-N 121.088 -1.008 . . . . 1.14 110.278 -179.387 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' B' B ' 341' ' ' PHE . . . . . . . . . . . . . 54.5 m-85 -62.24 -45.72 92.05 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.128 -0.983 . . . . 0.22 109.998 -179.707 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' B' B ' 342' ' ' ARG . . . . . . . . . . . . . 13.0 ttp180 -47.59 -43.75 25.81 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.329 -0.857 . . . . 3.15 109.849 -179.931 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' B' B ' 343' ' ' GLU . . . . . . . . . . . . . 30.6 tt0 -58.84 -48.91 79.67 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.417 -0.802 . . . . 2.35 109.68 -179.578 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' B' B ' 344' ' ' LEU . . . . . . . . . . . . . 52.9 mt -60.97 -29.96 69.97 Favored 'General case' 0 N--CA 1.489 1.486 0 O-C-N 121.021 -1.049 . . . . 1.05 109.576 -179.538 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' B' B ' 345' ' ' ASN . . . . . . . . . . . . . 11.2 t-20 -58.13 -59.99 4.44 Favored 'General case' 0 N--CA 1.489 1.493 0 O-C-N 121.248 -0.908 . . . . 1.35 109.702 179.875 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' B' B ' 346' ' ' GLU . . . . . . . . . . . . . 86.1 tt0 -60.16 -24.14 64.5 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.253 -0.904 . . . . 1.66 109.382 -179.724 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' B' B ' 347' ' ' ALA . . . . . . . . . . . . . . . -62.18 -61.8 2.21 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.147 -0.97 . . . . 1.02 109.967 -179.829 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' B' B ' 348' ' ' LEU . . . . . 0.475 ' N ' HD23 ' B' ' 348' ' ' LEU . 3.8 mm? -61.26 -45.77 93.14 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.325 -0.86 . . . . 1.05 109.824 -179.722 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' B' B ' 349' ' ' GLU . . . . . . . . . . . . . 27.6 mm-40 -56.68 -33.49 66.47 Favored 'General case' 0 N--CA 1.494 1.762 0 O-C-N 121.399 -0.813 . . . . 1.95 109.832 -179.399 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' B' B ' 350' ' ' LEU . . . . . 0.493 HD22 ' O ' ' B' ' 350' ' ' LEU . 5.7 tt -63.53 -46.75 84.59 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.381 -0.824 . . . . 1.18 108.847 -179.943 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' B' B ' 351' ' ' LYS . . . . . . . . . . . . . 5.7 tttt -57.62 -44.04 85.25 Favored 'General case' 0 C--N 1.302 -1.481 0 O-C-N 121.449 -0.782 . . . . 1.96 109.022 179.584 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' B' B ' 352' ' ' ASP . . . . . . . . . . . . . 25.2 m-20 -55.3 -39.55 70.05 Favored 'General case' 0 N--CA 1.488 1.456 0 O-C-N 121.389 -0.82 . . . . 1.16 109.502 179.82 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' B' B ' 353' ' ' ALA . . . . . . . . . . . . . . . -69.53 -26.45 64.53 Favored 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.454 -0.779 . . . . 1.21 109.889 -179.898 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' B' B ' 354' ' ' GLN . . . . . . . . . . . . . 4.6 tt0 . . . . . 0 C--N 1.302 -1.479 0 O-C-N 120.954 -1.091 . . . . 1.69 109.798 -179.91 . . . . . . . . 0 0 . 1 . 030 nuclear orig core ' C' C ' 326' ' ' GLU . . . . . . . . . . . . . 2.9 mp0 . . . . . 0 N--CA 1.486 1.362 0 CA-C-O 121.326 0.584 . . . . 2.17 109.433 . . . . . . . . . 0 0 . 1 . 030 nuclear orig core ' C' C ' 327' ' ' TYR . . . . . . . . . . . . . 49.5 m-85 -150.75 114.19 4.89 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.062 -1.024 . . . . 1.03 109.835 179.752 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' C' C ' 328' ' ' PHE . . . . . . . . . . . . . 79.5 m-85 -113.38 -167.81 1.25 Allowed 'General case' 0 N--CA 1.488 1.466 0 O-C-N 121.217 -0.927 . . . . 0.37 109.491 179.542 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' C' C ' 329' ' ' THR . . . . . . . . . . . . . 4.4 p -153.91 161.84 41.69 Favored 'General case' 0 C--N 1.301 -1.508 0 O-C-N 121.068 -1.02 . . . . 1.04 109.536 -179.881 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' C' C ' 330' ' ' LEU . . . . . . . . . . . . . 15.0 tp -149.24 129.43 13.65 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.291 -0.881 . . . . 1.09 109.671 -179.703 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' C' C ' 331' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -87.15 119.88 27.85 Favored 'General case' 0 N--CA 1.487 1.4 0 O-C-N 121.334 -0.854 . . . . 1.48 109.229 179.632 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' C' C ' 332' ' ' ILE . . . . . 0.541 HD12 ' CD2' ' C' ' 341' ' ' PHE . 14.1 mt -103.23 105.89 19.12 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.574 0 O-C-N 121.18 -0.95 . . . . 1.08 109.299 179.915 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' C' C ' 333' ' ' ARG . . . . . 0.564 ' HG2' ' CE1' ' A' ' 327' ' ' TYR . 8.3 mtt180 -72.65 134.9 45.32 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.228 -0.92 . . . . 3.36 109.155 179.624 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' C' C ' 334' ' ' GLY . . . . . . . . . . . . . . . 92.78 134.79 6.94 Favored Glycine 0 N--CA 1.489 2.176 0 N-CA-C 109.714 -1.354 . . . . 0.35 109.714 179.959 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' C' C ' 335' ' ' ARG . . . . . . . . . . . . . 6.7 tpt180 -80.33 -34.25 36.83 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.502 -0.999 . . . . 3.23 109.319 179.922 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' C' C ' 336' ' ' GLU . . . . . . . . . . . . . 1.3 tt0 -57.96 -61.45 2.53 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.189 -0.945 . . . . 2.62 109.69 -179.974 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' C' C ' 337' ' ' ARG . . . . . . . . . . . . . 3.0 mtt180 -59.19 -28.57 66.76 Favored 'General case' 0 N--CA 1.487 1.384 0 O-C-N 121.065 -1.022 . . . . 3.61 109.553 -179.91 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' C' C ' 338' ' ' PHE . . . . . 0.471 ' HA ' HD11 ' C' ' 332' ' ' ILE . 48.4 t80 -55.21 -62.4 1.69 Allowed 'General case' 0 N--CA 1.487 1.389 0 O-C-N 121.275 -0.891 . . . . 0.43 109.61 179.887 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' C' C ' 339' ' ' GLU . . . . . . . . . . . . . 1.3 mm-40 -49.79 -31.44 11.63 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 120.994 -1.066 . . . . 2.05 109.662 -179.819 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' C' C ' 340' ' ' MET . . . . . . . . . . . . . 24.2 ttp -63.27 -57.38 10.62 Favored 'General case' 0 N--CA 1.488 1.462 0 O-C-N 121.271 -0.893 . . . . 1.1 110.35 -179.429 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' C' C ' 341' ' ' PHE . . . . . 0.541 ' CD2' HD12 ' C' ' 332' ' ' ILE . 51.7 m-85 -61.57 -47.87 83.54 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.004 -1.06 . . . . 0.21 109.715 -179.575 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' C' C ' 342' ' ' ARG . . . . . 0.431 ' NH1' ' CG ' ' C' ' 342' ' ' ARG . 0.0 OUTLIER -47.15 -40.93 16.76 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.556 -0.715 . . . . 3.42 109.947 -179.983 . . . . . . . . 3 3 . 1 . 030 nuclear orig core ' C' C ' 343' ' ' GLU . . . . . 0.441 ' HA ' ' OE1' ' C' ' 343' ' ' GLU . 4.6 tp10 -60.1 -48.73 80.51 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.236 -0.915 . . . . 2.14 109.611 -179.951 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' C' C ' 344' ' ' LEU . . . . . 0.461 ' O ' HD21 ' C' ' 348' ' ' LEU . 28.7 mt -62.18 -31.1 71.57 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.324 -0.86 . . . . 1.09 109.47 -179.899 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' C' C ' 345' ' ' ASN . . . . . . . . . . . . . 8.8 t-20 -57.57 -50.53 72.79 Favored 'General case' 0 C--N 1.301 -1.529 0 O-C-N 121.16 -0.962 . . . . 1.38 109.258 -179.928 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' C' C ' 346' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -63.9 -33.43 75.69 Favored 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.247 -0.908 . . . . 2.21 109.85 -179.849 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' C' C ' 347' ' ' ALA . . . . . . . . . . . . . . . -61.26 -60.1 4.27 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.225 -0.922 . . . . 1.03 110.285 -179.459 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' C' C ' 348' ' ' LEU . . . . . 0.461 HD21 ' O ' ' C' ' 344' ' ' LEU . 3.8 mm? -59.0 -44.45 91.67 Favored 'General case' 0 N--CA 1.488 1.472 0 O-C-N 121.154 -0.966 . . . . 1.06 109.814 -179.025 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' C' C ' 349' ' ' GLU . . . . . . . . . . . . . 20.2 mt-10 -58.61 -34.4 71.1 Favored 'General case' 0 N--CA 1.489 1.525 0 O-C-N 121.094 -1.004 . . . . 2.19 109.735 -179.751 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' C' C ' 350' ' ' LEU . . . . . 0.539 HD23 ' CD1' ' D' ' 350' ' ' LEU . 4.9 tt -64.07 -46.78 82.79 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.304 -0.872 . . . . 1.2 109.459 -179.713 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' C' C ' 351' ' ' LYS . . . . . 0.515 ' N ' HD21 ' C' ' 350' ' ' LEU . 3.5 tttt -61.16 -44.02 97.97 Favored 'General case' 0 C--N 1.301 -1.531 0 O-C-N 121.408 -0.807 . . . . 1.92 109.587 -179.79 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' C' C ' 352' ' ' ASP . . . . . . . . . . . . . 56.2 m-20 -55.76 -47.0 77.75 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.353 -0.842 . . . . 1.19 109.951 -179.696 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' C' C ' 353' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 1.667 0 O-C-N 121.309 -0.869 . . . . 1.15 109.709 -179.578 . . . . . . . . 0 0 . 1 . 030 nuclear orig core ' D' D ' 326' ' ' GLU . . . . . . . . . . . . . 5.7 mt-10 . . . . . 0 N--CA 1.489 1.501 0 N-CA-C 109.496 -0.557 . . . . 2.13 109.496 . . . . . . . . . 0 0 . 1 . 030 nuclear orig core ' D' D ' 327' ' ' TYR . . . . . . . . . . . . . 41.3 m-85 -148.35 109.13 4.22 Favored 'General case' 0 C--N 1.302 -1.484 0 O-C-N 121.072 -1.018 . . . . 1.0 109.407 179.949 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' D' D ' 328' ' ' PHE . . . . . 0.419 ' O ' HG21 ' D' ' 329' ' ' THR . 18.6 m-85 -113.9 -167.88 1.27 Allowed 'General case' 0 N--CA 1.489 1.49 0 O-C-N 121.158 -0.964 . . . . 0.34 109.125 -179.802 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' D' D ' 329' ' ' THR . . . . . 0.419 HG21 ' O ' ' D' ' 328' ' ' PHE . 15.2 p -153.58 169.35 23.44 Favored 'General case' 0 C--N 1.302 -1.49 0 O-C-N 121.373 -0.829 . . . . 1.05 108.855 -179.902 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' D' D ' 330' ' ' LEU . . . . . . . . . . . . . 20.7 tp -151.78 134.48 15.54 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.44 -0.788 . . . . 1.07 109.686 -179.909 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' D' D ' 331' ' ' GLN . . . . . . . . . . . . . 3.3 tp60 -87.19 114.54 23.89 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.526 -0.733 . . . . 0.93 109.583 179.714 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' D' D ' 332' ' ' ILE . . . . . 0.454 HG23 ' HA ' ' D' ' 338' ' ' PHE . 57.8 mt -103.25 101.68 12.54 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.475 0 O-C-N 121.348 -0.845 . . . . 1.07 109.079 179.85 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' D' D ' 333' ' ' ARG . . . . . 0.404 ' HD3' ' CE1' ' B' ' 327' ' ' TYR . 47.0 mtt180 -72.17 153.42 41.64 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.322 -0.861 . . . . 3.42 109.733 -179.72 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' D' D ' 334' ' ' GLY . . . . . . . . . . . . . . . 76.38 131.33 0.4 Allowed Glycine 0 N--CA 1.492 2.378 0 N-CA-C 109.588 -1.405 . . . . 0.41 109.588 179.672 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' D' D ' 335' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -75.31 -35.15 61.29 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.222 -1.164 . . . . 3.58 109.762 179.994 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' D' D ' 336' ' ' GLU . . . . . . . . . . . . . 9.7 mt-10 -58.46 -58.01 10.42 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.131 -0.981 . . . . 2.26 109.716 -179.937 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' D' D ' 337' ' ' ARG . . . . . . . . . . . . . 5.9 mmt180 -60.81 -35.46 76.57 Favored 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.099 -1.001 . . . . 3.64 109.865 179.927 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' D' D ' 338' ' ' PHE . . . . . 0.454 ' HA ' HG23 ' D' ' 332' ' ' ILE . 65.6 t80 -54.99 -59.47 4.7 Favored 'General case' 0 N--CA 1.487 1.376 0 O-C-N 121.082 -1.011 . . . . 0.4 109.364 179.998 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' D' D ' 339' ' ' GLU . . . . . . . . . . . . . 78.1 mt-10 -50.09 -36.5 29.7 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.592 -0.693 . . . . 1.99 110.485 -179.43 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' D' D ' 340' ' ' MET . . . . . . . . . . . . . 43.5 ttp -64.39 -50.49 67.45 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.078 -1.014 . . . . 1.13 110.278 -179.266 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' D' D ' 341' ' ' PHE . . . . . . . . . . . . . 53.9 m-85 -61.81 -45.53 93.43 Favored 'General case' 0 C--N 1.298 -1.631 0 O-C-N 120.925 -1.109 . . . . 0.21 110.249 -179.408 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' D' D ' 342' ' ' ARG . . . . . . . . . . . . . 11.6 ttp180 -48.12 -43.91 31.48 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.157 -0.964 . . . . 3.15 109.896 -179.656 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' D' D ' 343' ' ' GLU . . . . . . . . . . . . . 27.7 tt0 -58.24 -48.26 80.95 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.246 -0.909 . . . . 2.35 109.7 -179.539 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' D' D ' 344' ' ' LEU . . . . . . . . . . . . . 46.4 mt -61.47 -30.31 70.52 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.074 -1.016 . . . . 1.06 109.551 -179.872 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' D' D ' 345' ' ' ASN . . . . . . . . . . . . . 12.6 t-20 -57.82 -59.11 5.73 Favored 'General case' 0 C--N 1.305 -1.367 0 O-C-N 121.148 -0.97 . . . . 1.35 109.587 -179.931 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' D' D ' 346' ' ' GLU . . . . . . . . . . . . . 83.4 tt0 -60.52 -25.22 65.95 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.327 -0.858 . . . . 1.69 109.692 -179.755 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' D' D ' 347' ' ' ALA . . . . . . . . . . . . . . . -61.71 -60.89 2.99 Favored 'General case' 0 C--N 1.301 -1.515 0 O-C-N 121.171 -0.956 . . . . 1.03 109.773 -179.77 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' D' D ' 348' ' ' LEU . . . . . 0.462 ' N ' HD23 ' D' ' 348' ' ' LEU . 3.8 mm? -61.84 -46.33 89.92 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.35 -0.843 . . . . 1.04 109.716 -179.239 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' D' D ' 349' ' ' GLU . . . . . . . . . . . . . 21.1 mm-40 -56.85 -31.67 65.03 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.374 -0.829 . . . . 1.95 109.904 -179.516 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' D' D ' 350' ' ' LEU . . . . . 0.539 ' CD1' HD23 ' C' ' 350' ' ' LEU . 5.8 tt -64.75 -47.12 79.37 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.466 -0.771 . . . . 1.16 108.957 179.787 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' D' D ' 351' ' ' LYS . . . . . . . . . . . . . 6.1 tttt -57.71 -43.67 85.36 Favored 'General case' 0 N--CA 1.489 1.513 0 N-CA-C 109.047 -0.723 . . . . 1.97 109.047 179.755 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' D' D ' 352' ' ' ASP . . . . . . . . . . . . . 15.7 m-20 -55.05 -39.87 69.66 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.362 -0.836 . . . . 1.17 109.603 179.904 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' D' D ' 353' ' ' ALA . . . . . . . . . . . . . . . -69.0 -27.12 65.41 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.465 -0.772 . . . . 1.21 109.848 -179.927 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' D' D ' 354' ' ' GLN . . . . . . . . . . . . . 4.4 tt0 . . . . . 0 N--CA 1.488 1.468 0 O-C-N 120.946 -1.096 . . . . 1.68 109.997 -179.636 . . . . . . . . 0 0 . 1 . 031 nuclear orig core ' A' A ' 326' ' ' GLU . . . . . . . . . . . . . 2.6 mt-10 . . . . . 0 N--CA 1.488 1.47 0 N-CA-C 109.042 -0.725 . . . . 2.13 109.042 . . . . . . . . . 0 0 . 1 . 031 nuclear orig core ' A' A ' 327' ' ' TYR . . . . . 0.484 ' CE1' ' HG2' ' C' ' 333' ' ' ARG . 33.6 m-85 -148.5 112.42 5.14 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.212 -0.93 . . . . 1.0 109.722 179.901 . . . . . . . . 2 2 . 1 . 031 nuclear orig core ' A' A ' 328' ' ' PHE . . . . . 0.401 ' CZ ' ' HG3' ' C' ' 335' ' ' ARG . 85.1 m-85 -114.78 -168.12 1.33 Allowed 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.452 -0.78 . . . . 0.34 109.45 179.972 . . . . . . . . 2 2 . 1 . 031 nuclear orig core ' A' A ' 329' ' ' THR . . . . . . . . . . . . . 37.0 p -154.18 157.93 39.56 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.206 -0.934 . . . . 1.05 109.315 -179.971 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 330' ' ' LEU . . . . . . . . . . . . . 21.9 tp -150.73 128.81 11.85 Favored 'General case' 0 N--CA 1.488 1.465 0 O-C-N 121.213 -0.929 . . . . 1.07 109.888 -179.546 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 331' ' ' GLN . . . . . . . . . . . . . 1.3 tt0 -86.92 117.06 25.4 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.242 -0.911 . . . . 0.91 109.095 179.673 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 332' ' ' ILE . . . . . . . . . . . . . 96.2 mt -103.43 106.49 20.24 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.565 0 O-C-N 121.114 -0.991 . . . . 1.09 109.96 -179.576 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 333' ' ' ARG . . . . . 0.578 ' HG2' ' CE1' ' C' ' 327' ' ' TYR . 1.6 mtp180 -73.15 154.21 40.42 Favored 'General case' 0 C--N 1.303 -1.439 0 O-C-N 121.466 -0.771 . . . . 3.41 109.429 179.781 . . . . . . . . 2 2 . 1 . 031 nuclear orig core ' A' A ' 334' ' ' GLY . . . . . . . . . . . . . . . 79.62 129.67 0.73 Allowed Glycine 0 N--CA 1.492 2.397 0 N-CA-C 109.882 -1.287 . . . . 0.4 109.882 179.621 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 335' ' ' ARG . . . . . 0.522 ' NH1' ' HG2' ' A' ' 335' ' ' ARG . 21.6 ttt-85 -79.8 -38.24 33.46 Favored 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.355 -1.085 . . . . 3.55 109.229 179.627 . . . . . . . . 2 2 . 1 . 031 nuclear orig core ' A' A ' 336' ' ' GLU . . . . . . . . . . . . . 21.4 mt-10 -58.69 -59.14 5.88 Favored 'General case' 0 N--CA 1.488 1.436 0 O-C-N 121.399 -0.813 . . . . 2.29 109.59 -179.996 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 337' ' ' ARG . . . . . . . . . . . . . 2.5 mmt180 -60.17 -30.62 69.46 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.292 -0.88 . . . . 3.64 109.3 -179.981 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 338' ' ' PHE . . . . . 0.416 ' HB3' ' O ' ' A' ' 335' ' ' ARG . 64.3 t80 -55.48 -58.1 9.14 Favored 'General case' 0 N--CA 1.488 1.474 0 O-C-N 121.171 -0.955 . . . . 0.41 109.278 179.826 . . . . . . . . 2 2 . 1 . 031 nuclear orig core ' A' A ' 339' ' ' GLU . . . . . . . . . . . . . 7.2 mt-10 -51.92 -30.95 26.58 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.139 -0.975 . . . . 1.97 109.99 -179.847 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 340' ' ' MET . . . . . . . . . . . . . 16.0 ttp -64.67 -54.4 32.34 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.166 -0.959 . . . . 1.14 109.885 -179.6 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 341' ' ' PHE . . . . . . . . . . . . . 35.7 m-85 -62.61 -52.77 62.08 Favored 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.3 -0.875 . . . . 0.21 110.024 -179.6 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 342' ' ' ARG . . . . . . . . . . . . . 12.9 ttp180 -47.93 -41.17 24.07 Favored 'General case' 0 N--CA 1.489 1.481 0 O-C-N 121.234 -0.916 . . . . 3.15 109.946 -179.576 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 343' ' ' GLU . . . . . . . . . . . . . 42.9 tt0 -59.17 -45.11 91.86 Favored 'General case' 0 N--CA 1.494 1.74 0 O-C-N 121.156 -0.965 . . . . 2.35 109.741 -179.859 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 344' ' ' LEU . . . . . . . . . . . . . 39.8 mt -62.81 -41.63 99.37 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.118 -0.989 . . . . 1.06 109.781 -179.864 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 345' ' ' ASN . . . . . . . . . . . . . 33.2 t-20 -56.16 -45.46 79.67 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.113 -0.992 . . . . 1.36 109.464 -179.826 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 346' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -60.88 -36.08 78.28 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.255 -0.903 . . . . 1.65 109.746 -179.949 . . . . . . . . 2 2 . 1 . 031 nuclear orig core ' A' A ' 347' ' ' ALA . . . . . 0.502 ' CB ' ' HB3' ' B' ' 347' ' ' ALA . . . -60.54 -52.32 65.7 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.164 -0.96 . . . . 1.03 110.27 -179.646 . . . . . . . . 2 2 . 1 . 031 nuclear orig core ' A' A ' 348' ' ' LEU . . . . . 0.41 ' N ' HD23 ' A' ' 348' ' ' LEU . 3.9 mm? -60.78 -49.74 76.28 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.196 -0.94 . . . . 1.04 109.888 -179.403 . . . . . . . . 2 2 . 1 . 031 nuclear orig core ' A' A ' 349' ' ' GLU . . . . . . . . . . . . . 53.3 mt-10 -57.49 -31.08 65.65 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.233 -0.917 . . . . 1.94 110.038 -179.332 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 350' ' ' LEU . . . . . 0.52 HD12 ' NE2' ' B' ' 354' ' ' GLN . 4.7 tt -63.81 -41.28 97.92 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.075 -1.016 . . . . 1.17 109.054 179.92 . . . . . . . . 2 2 . 1 . 031 nuclear orig core ' A' A ' 351' ' ' LYS . . . . . . . . . . . . . 6.3 tttt -59.65 -44.94 93.34 Favored 'General case' 0 C--N 1.302 -1.497 0 O-C-N 121.342 -0.849 . . . . 1.97 109.647 179.94 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 352' ' ' ASP . . . . . . . . . . . . . 63.8 m-20 -54.48 -43.33 71.65 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.162 -0.962 . . . . 1.16 109.623 -179.917 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 353' ' ' ALA . . . . . . . . . . . . . . . -67.61 -28.91 68.15 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.194 -0.941 . . . . 1.22 109.599 -179.687 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 354' ' ' GLN . . . . . 0.437 ' NE2' HD12 ' B' ' 350' ' ' LEU . 0.4 OUTLIER . . . . . 0 N--CA 1.491 1.611 0 O-C-N 121.211 -0.93 . . . . 1.71 109.378 179.853 . . . . . . . . 2 2 . 1 . 031 nuclear orig core ' B' B ' 326' ' ' GLU . . . . . . . . . . . . . 2.6 mt-10 . . . . . 0 N--CA 1.488 1.471 0 N-CA-C 109.314 -0.624 . . . . 2.13 109.314 . . . . . . . . . 0 0 . 1 . 031 nuclear orig core ' B' B ' 327' ' ' TYR . . . . . 0.604 ' CE1' ' HG2' ' D' ' 333' ' ' ARG . 35.9 m-85 -148.57 112.44 5.13 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.42 -0.8 . . . . 0.99 109.671 179.74 . . . . . . . . 2 2 . 1 . 031 nuclear orig core ' B' B ' 328' ' ' PHE . . . . . 0.478 ' CE2' ' HA ' ' D' ' 335' ' ' ARG . 85.4 m-85 -114.94 -168.88 1.45 Allowed 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.429 -0.794 . . . . 0.36 109.287 179.756 . . . . . . . . 2 2 . 1 . 031 nuclear orig core ' B' B ' 329' ' ' THR . . . . . . . . . . . . . 37.9 p -153.53 158.53 41.41 Favored 'General case' 0 N--CA 1.489 1.495 0 O-C-N 121.243 -0.911 . . . . 1.05 109.262 179.989 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' B' B ' 330' ' ' LEU . . . . . . . . . . . . . 20.5 tp -151.11 129.61 12.16 Favored 'General case' 0 C--N 1.303 -1.429 0 O-C-N 121.275 -0.891 . . . . 1.07 109.628 -179.758 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' B' B ' 331' ' ' GLN . . . . . . . . . . . . . 1.4 tt0 -87.42 117.73 26.39 Favored 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.289 -0.882 . . . . 0.91 108.863 179.475 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' B' B ' 332' ' ' ILE . . . . . . . . . . . . . 95.4 mt -103.97 106.71 20.77 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.597 0 O-C-N 121.178 -0.951 . . . . 1.08 110.048 -179.724 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' B' B ' 333' ' ' ARG . . . . . 0.524 ' HG2' ' CE1' ' D' ' 327' ' ' TYR . 1.7 mtp180 -73.38 154.84 39.88 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.268 -0.895 . . . . 3.42 109.536 179.751 . . . . . . . . 2 2 . 1 . 031 nuclear orig core ' B' B ' 334' ' ' GLY . . . . . . . . . . . . . . . 77.99 128.63 0.46 Allowed Glycine 0 N--CA 1.491 2.303 0 N-CA-C 109.987 -1.245 . . . . 0.4 109.987 179.82 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' B' B ' 335' ' ' ARG . . . . . 0.533 ' HG2' ' NH1' ' B' ' 335' ' ' ARG . 23.1 ttt-85 -78.77 -38.72 37.88 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.285 -1.127 . . . . 3.55 109.293 179.787 . . . . . . . . 2 2 . 1 . 031 nuclear orig core ' B' B ' 336' ' ' GLU . . . . . . . . . . . . . 22.1 mt-10 -57.73 -59.1 5.72 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.317 -0.864 . . . . 2.28 109.563 179.935 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' B' B ' 337' ' ' ARG . . . . . . . . . . . . . 2.5 mmt180 -60.54 -30.43 69.76 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.207 -0.933 . . . . 3.64 109.34 -179.886 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' B' B ' 338' ' ' PHE . . . . . 0.44 ' HB3' ' O ' ' B' ' 335' ' ' ARG . 65.8 t80 -55.52 -57.73 10.71 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.332 -0.855 . . . . 0.39 109.379 179.723 . . . . . . . . 2 2 . 1 . 031 nuclear orig core ' B' B ' 339' ' ' GLU . . . . . . . . . . . . . 7.9 mt-10 -52.38 -31.06 32.05 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.218 -0.926 . . . . 1.98 109.755 -179.848 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' B' B ' 340' ' ' MET . . . . . . . . . . . . . 17.5 ttp -64.3 -54.54 31.63 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.246 -0.909 . . . . 1.14 109.88 -179.5 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' B' B ' 341' ' ' PHE . . . . . . . . . . . . . 36.4 m-85 -62.73 -53.34 55.92 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.389 -0.819 . . . . 0.22 109.857 -179.579 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' B' B ' 342' ' ' ARG . . . . . . . . . . . . . 13.6 ttp180 -47.2 -41.37 18.04 Favored 'General case' 0 C--N 1.301 -1.511 0 O-C-N 121.274 -0.891 . . . . 3.15 109.99 -179.6 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' B' B ' 343' ' ' GLU . . . . . . . . . . . . . 41.0 tt0 -58.77 -45.61 89.37 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.013 -1.054 . . . . 2.35 109.704 -179.719 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' B' B ' 344' ' ' LEU . . . . . 0.443 ' O ' HD21 ' B' ' 348' ' ' LEU . 41.1 mt -62.8 -40.93 98.86 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.237 -0.914 . . . . 1.05 110.078 -179.586 . . . . . . . . 2 2 . 1 . 031 nuclear orig core ' B' B ' 345' ' ' ASN . . . . . . . . . . . . . 33.9 t-20 -56.84 -44.99 82.64 Favored 'General case' 0 C--N 1.301 -1.522 0 O-C-N 121.242 -0.911 . . . . 1.35 109.449 -179.877 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' B' B ' 346' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -61.36 -35.43 77.43 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.191 -0.943 . . . . 1.66 109.73 -179.924 . . . . . . . . 2 2 . 1 . 031 nuclear orig core ' B' B ' 347' ' ' ALA . . . . . 0.502 ' HB3' ' CB ' ' A' ' 347' ' ' ALA . . . -61.3 -51.98 66.6 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.24 -0.913 . . . . 1.02 110.078 -179.48 . . . . . . . . 2 2 . 1 . 031 nuclear orig core ' B' B ' 348' ' ' LEU . . . . . 0.443 HD21 ' O ' ' B' ' 344' ' ' LEU . 3.9 mm? -61.0 -49.62 76.69 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.085 -1.009 . . . . 1.05 109.933 -179.494 . . . . . . . . 2 2 . 1 . 031 nuclear orig core ' B' B ' 349' ' ' GLU . . . . . . . . . . . . . 53.7 mt-10 -57.7 -31.61 66.56 Favored 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.243 -0.91 . . . . 1.95 109.897 -179.335 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' B' B ' 350' ' ' LEU . . . . . 0.486 HD22 ' O ' ' B' ' 350' ' ' LEU . 4.7 tt -62.98 -41.88 99.68 Favored 'General case' 0 N--CA 1.488 1.474 0 O-C-N 120.981 -1.074 . . . . 1.18 109.108 179.857 . . . . . . . . 2 2 . 1 . 031 nuclear orig core ' B' B ' 351' ' ' LYS . . . . . . . . . . . . . 6.3 tttt -59.0 -44.67 91.7 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.311 -0.868 . . . . 1.96 109.715 179.908 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' B' B ' 352' ' ' ASP . . . . . . . . . . . . . 65.4 m-20 -54.74 -43.59 72.82 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.195 -0.941 . . . . 1.16 109.776 -179.695 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' B' B ' 353' ' ' ALA . . . . . . . . . . . . . . . -67.49 -28.86 68.19 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.216 -0.927 . . . . 1.21 109.366 -179.955 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' B' B ' 354' ' ' GLN . . . . . 0.52 ' NE2' HD12 ' A' ' 350' ' ' LEU . 0.4 OUTLIER . . . . . 0 N--CA 1.49 1.536 0 O-C-N 121.287 -0.883 . . . . 1.69 109.661 179.862 . . . . . . . . 2 2 . 1 . 031 nuclear orig core ' C' C ' 326' ' ' GLU . . . . . . . . . . . . . 1.9 mm-40 . . . . . 0 N--CA 1.49 1.561 0 CA-C-O 121.407 0.622 . . . . 2.17 109.432 . . . . . . . . . 0 0 . 1 . 031 nuclear orig core ' C' C ' 327' ' ' TYR . . . . . 0.578 ' CE1' ' HG2' ' A' ' 333' ' ' ARG . 32.7 m-85 -148.2 101.34 3.26 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.193 -0.942 . . . . 1.03 109.629 179.864 . . . . . . . . 2 2 . 1 . 031 nuclear orig core ' C' C ' 328' ' ' PHE . . . . . . . . . . . . . 92.8 m-85 -108.17 -164.37 0.95 Allowed 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.258 -0.901 . . . . 0.37 109.414 179.878 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' C' C ' 329' ' ' THR . . . . . . . . . . . . . 3.0 p -154.19 157.5 38.92 Favored 'General case' 0 C--N 1.303 -1.426 0 O-C-N 121.405 -0.809 . . . . 1.04 109.039 -179.968 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' C' C ' 330' ' ' LEU . . . . . . . . . . . . . 19.8 tp -148.38 127.27 12.68 Favored 'General case' 0 N--CA 1.489 1.48 0 O-C-N 121.234 -0.916 . . . . 1.09 109.687 -179.735 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' C' C ' 331' ' ' GLN . . . . . . . . . . . . . 1.1 tt0 -86.82 120.06 27.7 Favored 'General case' 0 N--CA 1.487 1.41 0 N-CA-C 108.587 -0.894 . . . . 1.48 108.587 179.286 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' C' C ' 332' ' ' ILE . . . . . 0.445 HG23 ' HA ' ' C' ' 338' ' ' PHE . 15.0 mt -102.84 103.11 14.58 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.588 0 O-C-N 121.178 -0.951 . . . . 1.08 109.845 -179.405 . . . . . . . . 2 2 . 1 . 031 nuclear orig core ' C' C ' 333' ' ' ARG . . . . . 0.484 ' HG2' ' CE1' ' A' ' 327' ' ' TYR . 1.6 mtt-85 -73.49 126.25 29.79 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.44 -0.787 . . . . 3.36 109.47 179.812 . . . . . . . . 2 2 . 1 . 031 nuclear orig core ' C' C ' 334' ' ' GLY . . . . . . . . . . . . . . . 104.68 125.76 5.65 Favored Glycine 0 N--CA 1.49 2.243 0 N-CA-C 109.473 -1.451 . . . . 0.35 109.473 -179.889 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' C' C ' 335' ' ' ARG . . . . . 0.46 ' O ' ' HB3' ' C' ' 338' ' ' PHE . 2.6 ttm180 -78.65 -36.21 44.21 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.305 -1.115 . . . . 3.23 109.612 -179.69 . . . . . . . . 2 2 . 1 . 031 nuclear orig core ' C' C ' 336' ' ' GLU . . . . . . . . . . . . . 3.0 mm-40 -58.57 -63.31 1.33 Allowed 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.182 -0.949 . . . . 2.62 109.598 -179.802 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' C' C ' 337' ' ' ARG . . . . . . . . . . . . . 14.9 mmt180 -59.12 -27.79 65.93 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.265 -0.897 . . . . 3.61 109.615 -179.995 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' C' C ' 338' ' ' PHE . . . . . 0.46 ' HB3' ' O ' ' C' ' 335' ' ' ARG . 59.8 t80 -55.34 -58.28 8.39 Favored 'General case' 0 N--CA 1.489 1.489 0 O-C-N 121.25 -0.906 . . . . 0.43 109.731 179.969 . . . . . . . . 2 2 . 1 . 031 nuclear orig core ' C' C ' 339' ' ' GLU . . . . . . . . . . . . . 17.9 mt-10 -50.52 -32.95 19.76 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.097 -1.002 . . . . 2.05 110.087 -179.544 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' C' C ' 340' ' ' MET . . . . . . . . . . . . . 35.0 ttp -64.19 -55.27 22.89 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.13 -0.981 . . . . 1.1 110.116 -179.496 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' C' C ' 341' ' ' PHE . . . . . . . . . . . . . 49.6 m-85 -60.93 -53.64 54.79 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.126 -0.984 . . . . 0.21 109.999 -179.486 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' C' C ' 342' ' ' ARG . . . . . . . . . . . . . 16.6 ttt180 -46.98 -38.47 10.76 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.088 -1.008 . . . . 3.42 109.805 -179.581 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' C' C ' 343' ' ' GLU . . . . . . . . . . . . . 31.4 tt0 -60.18 -47.35 86.3 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.165 -0.96 . . . . 2.14 109.848 -179.858 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' C' C ' 344' ' ' LEU . . . . . 0.473 ' O ' HD21 ' C' ' 348' ' ' LEU . 36.0 mt -62.55 -35.48 79.6 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.146 -0.971 . . . . 1.09 109.925 -179.507 . . . . . . . . 2 2 . 1 . 031 nuclear orig core ' C' C ' 345' ' ' ASN . . . . . . . . . . . . . 54.8 t-20 -56.37 -48.83 76.03 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.062 -1.024 . . . . 1.38 109.371 -179.991 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' C' C ' 346' ' ' GLU . . . . . . . . . . . . . 2.1 tp10 -62.47 -32.76 73.7 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.253 -0.904 . . . . 2.21 109.734 179.945 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' C' C ' 347' ' ' ALA . . . . . 0.525 ' HB3' ' CB ' ' D' ' 347' ' ' ALA . . . -62.11 -55.96 23.62 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.205 -0.935 . . . . 1.03 110.083 -179.718 . . . . . . . . 2 2 . 1 . 031 nuclear orig core ' C' C ' 348' ' ' LEU . . . . . 0.473 HD21 ' O ' ' C' ' 344' ' ' LEU . 3.9 mm? -60.97 -49.56 76.94 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.218 -0.926 . . . . 1.06 109.832 -179.403 . . . . . . . . 2 2 . 1 . 031 nuclear orig core ' C' C ' 349' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -56.43 -33.47 65.87 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.127 -0.983 . . . . 2.19 109.373 -179.704 . . . . . . . . 2 2 . 1 . 031 nuclear orig core ' C' C ' 350' ' ' LEU . . . . . 0.491 HD23 HD23 ' D' ' 350' ' ' LEU . 6.4 tt -62.53 -43.35 99.03 Favored 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.337 -0.852 . . . . 1.2 109.092 179.759 . . . . . . . . 2 2 . 1 . 031 nuclear orig core ' C' C ' 351' ' ' LYS . . . . . . . . . . . . . 36.3 tttt -58.15 -41.84 84.64 Favored 'General case' 0 C--N 1.301 -1.514 0 O-C-N 121.377 -0.827 . . . . 1.92 109.045 179.742 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' C' C ' 352' ' ' ASP . . . . . . . . . . . . . 50.5 m-20 -56.39 -49.2 75.16 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.241 -0.912 . . . . 1.19 109.455 179.668 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' C' C ' 353' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 1.628 0 O-C-N 121.434 -0.791 . . . . 1.15 109.303 179.943 . . . . . . . . 0 0 . 1 . 031 nuclear orig core ' D' D ' 326' ' ' GLU . . . . . . . . . . . . . 2.6 mt-10 . . . . . 0 N--CA 1.488 1.468 0 N-CA-C 109.074 -0.713 . . . . 2.13 109.074 . . . . . . . . . 0 0 . 1 . 031 nuclear orig core ' D' D ' 327' ' ' TYR . . . . . 0.524 ' CE1' ' HG2' ' B' ' 333' ' ' ARG . 34.8 m-85 -148.65 111.58 4.85 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.199 -0.938 . . . . 1.0 109.814 179.866 . . . . . . . . 2 2 . 1 . 031 nuclear orig core ' D' D ' 328' ' ' PHE . . . . . . . . . . . . . 85.6 m-85 -113.88 -168.4 1.34 Allowed 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.394 -0.816 . . . . 0.34 109.372 179.796 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' D' D ' 329' ' ' THR . . . . . . . . . . . . . 35.5 p -153.9 157.79 39.76 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.169 -0.957 . . . . 1.05 109.132 -179.771 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' D' D ' 330' ' ' LEU . . . . . . . . . . . . . 18.3 tp -150.81 129.44 12.27 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.216 -0.928 . . . . 1.07 109.864 -179.767 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' D' D ' 331' ' ' GLN . . . . . . . . . . . . . 1.7 tt0 -87.43 116.63 25.67 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.218 -0.926 . . . . 0.93 109.27 179.702 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' D' D ' 332' ' ' ILE . . . . . . . . . . . . . 95.0 mt -102.85 106.2 19.59 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.528 0 O-C-N 121.25 -0.906 . . . . 1.07 110.132 -179.572 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' D' D ' 333' ' ' ARG . . . . . 0.604 ' HG2' ' CE1' ' B' ' 327' ' ' TYR . 1.8 mtp180 -72.95 155.25 40.05 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.375 -0.828 . . . . 3.42 109.553 179.614 . . . . . . . . 2 2 . 1 . 031 nuclear orig core ' D' D ' 334' ' ' GLY . . . . . . . . . . . . . . . 78.09 128.91 0.48 Allowed Glycine 0 N--CA 1.491 2.337 0 N-CA-C 109.847 -1.301 . . . . 0.41 109.847 179.643 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' D' D ' 335' ' ' ARG . . . . . 0.517 ' HG2' ' NH1' ' D' ' 335' ' ' ARG . 22.0 ttt-85 -79.68 -37.72 35.17 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.246 -1.149 . . . . 3.58 109.235 179.734 . . . . . . . . 2 2 . 1 . 031 nuclear orig core ' D' D ' 336' ' ' GLU . . . . . . . . . . . . . 23.6 mt-10 -58.49 -59.54 5.21 Favored 'General case' 0 C--N 1.304 -1.383 0 O-C-N 121.261 -0.899 . . . . 2.26 109.483 179.922 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' D' D ' 337' ' ' ARG . . . . . . . . . . . . . 2.0 mmt180 -60.02 -30.18 68.99 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.313 -0.867 . . . . 3.64 109.438 -179.947 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' D' D ' 338' ' ' PHE . . . . . 0.426 ' HB3' ' O ' ' D' ' 335' ' ' ARG . 65.6 t80 -55.37 -58.37 8.01 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.278 -0.889 . . . . 0.4 109.376 179.855 . . . . . . . . 2 2 . 1 . 031 nuclear orig core ' D' D ' 339' ' ' GLU . . . . . . . . . . . . . 8.0 mt-10 -51.9 -31.2 27.32 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.27 -0.894 . . . . 1.99 109.7 -179.939 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' D' D ' 340' ' ' MET . . . . . . . . . . . . . 17.6 ttp -64.21 -54.27 36.12 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.019 -1.051 . . . . 1.13 109.915 -179.627 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' D' D ' 341' ' ' PHE . . . . . . . . . . . . . 36.3 m-85 -62.72 -53.19 58.16 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.222 -0.924 . . . . 0.21 109.984 -179.539 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' D' D ' 342' ' ' ARG . . . . . . . . . . . . . 13.6 ttp180 -47.86 -40.29 21.07 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.357 -0.84 . . . . 3.15 109.943 -179.593 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' D' D ' 343' ' ' GLU . . . . . . . . . . . . . 40.2 tt0 -59.67 -45.4 92.17 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.042 -1.037 . . . . 2.35 109.723 -179.699 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' D' D ' 344' ' ' LEU . . . . . 0.427 ' O ' HD21 ' D' ' 348' ' ' LEU . 41.9 mt -63.0 -40.76 98.74 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.27 -0.894 . . . . 1.06 109.998 -179.678 . . . . . . . . 2 2 . 1 . 031 nuclear orig core ' D' D ' 345' ' ' ASN . . . . . . . . . . . . . 33.5 t-20 -56.7 -44.93 82.03 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.34 -0.85 . . . . 1.35 109.454 -179.699 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' D' D ' 346' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -61.72 -35.86 79.26 Favored 'General case' 0 C--N 1.303 -1.447 0 O-C-N 121.476 -0.765 . . . . 1.69 109.746 -179.809 . . . . . . . . 2 2 . 1 . 031 nuclear orig core ' D' D ' 347' ' ' ALA . . . . . 0.525 ' CB ' ' HB3' ' C' ' 347' ' ' ALA . . . -60.58 -51.82 67.79 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.289 -0.882 . . . . 1.03 110.203 -179.614 . . . . . . . . 2 2 . 1 . 031 nuclear orig core ' D' D ' 348' ' ' LEU . . . . . 0.427 HD21 ' O ' ' D' ' 344' ' ' LEU . 3.9 mm? -61.16 -49.87 75.49 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.077 -1.014 . . . . 1.04 109.818 -179.315 . . . . . . . . 2 2 . 1 . 031 nuclear orig core ' D' D ' 349' ' ' GLU . . . . . . . . . . . . . 55.6 mt-10 -57.45 -31.29 65.77 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.168 -0.957 . . . . 1.95 110.062 -179.368 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' D' D ' 350' ' ' LEU . . . . . 0.491 HD23 HD23 ' C' ' 350' ' ' LEU . 4.7 tt -63.47 -41.47 98.6 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 120.972 -1.08 . . . . 1.16 109.11 179.83 . . . . . . . . 2 2 . 1 . 031 nuclear orig core ' D' D ' 351' ' ' LYS . . . . . . . . . . . . . 6.7 tttt -59.6 -44.29 93.43 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.377 -0.827 . . . . 1.97 109.517 -179.992 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' D' D ' 352' ' ' ASP . . . . . . . . . . . . . 66.6 m-20 -54.93 -43.5 73.4 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.201 -0.937 . . . . 1.17 109.747 -179.859 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' D' D ' 353' ' ' ALA . . . . . . . . . . . . . . . -67.87 -28.2 67.33 Favored 'General case' 0 N--CA 1.489 1.488 0 O-C-N 121.215 -0.928 . . . . 1.21 109.703 -179.739 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' D' D ' 354' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.491 1.618 0 O-C-N 121.41 -0.806 . . . . 1.68 109.515 179.883 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 326' ' ' GLU . . . . . 0.406 ' HB2' ' CE1' ' A' ' 328' ' ' PHE . 44.9 mt-10 . . . . . 0 N--CA 1.489 1.49 0 N-CA-C 109.369 -0.604 . . . . 2.13 109.369 . . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 327' ' ' TYR . . . . . . . . . . . . . 44.6 m-85 -149.49 109.27 4.05 Favored 'General case' 0 N--CA 1.488 1.452 0 O-C-N 121.337 -0.852 . . . . 1.0 109.267 179.993 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 328' ' ' PHE . . . . . 0.406 ' CE1' ' HB2' ' A' ' 326' ' ' GLU . 41.7 m-85 -113.58 -169.16 1.45 Allowed 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.288 -0.882 . . . . 0.34 109.473 -179.809 . . . . . . . . 2 2 . 1 . 032 nuclear orig core ' A' A ' 329' ' ' THR . . . . . . . . . . . . . 6.4 p -153.6 168.39 26.34 Favored 'General case' 0 N--CA 1.488 1.456 0 O-C-N 121.294 -0.879 . . . . 1.05 109.216 -179.948 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 330' ' ' LEU . . . . . . . . . . . . . 20.6 tp -150.19 129.03 12.47 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.171 -0.956 . . . . 1.07 109.704 -179.783 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 331' ' ' GLN . . . . . . . . . . . . . 1.2 tp60 -87.7 113.35 23.29 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.441 -0.787 . . . . 0.91 109.393 179.739 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 332' ' ' ILE . . . . . 0.43 ' CG2' ' HA ' ' A' ' 338' ' ' PHE . 76.2 mt -103.57 105.06 17.66 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.573 0 O-C-N 121.193 -0.942 . . . . 1.09 109.431 -179.975 . . . . . . . . 2 2 . 1 . 032 nuclear orig core ' A' A ' 333' ' ' ARG . . . . . 0.471 ' NH1' ' HG2' ' A' ' 333' ' ' ARG . 0.0 OUTLIER -71.75 150.71 44.2 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.264 -0.898 . . . . 3.41 109.284 179.822 . . . . . . . . 3 3 . 1 . 032 nuclear orig core ' A' A ' 334' ' ' GLY . . . . . . . . . . . . . . . 76.43 126.73 0.25 Allowed Glycine 0 N--CA 1.49 2.267 0 N-CA-C 109.473 -1.451 . . . . 0.4 109.473 -179.982 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 335' ' ' ARG . . . . . 0.447 ' HB2' ' OE1' ' C' ' 326' ' ' GLU . 0.4 OUTLIER -74.02 -32.84 63.54 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.264 -1.139 . . . . 3.55 109.681 -179.879 . . . . . . . . 3 3 . 1 . 032 nuclear orig core ' A' A ' 336' ' ' GLU . . . . . . . . . . . . . 3.1 mt-10 -58.05 -61.5 2.5 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.282 -0.886 . . . . 2.29 109.796 -179.763 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 337' ' ' ARG . . . . . . . . . . . . . 22.4 mmm180 -59.78 -33.69 72.02 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.194 -0.941 . . . . 3.64 109.633 -179.704 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 338' ' ' PHE . . . . . 0.43 ' HA ' ' CG2' ' A' ' 332' ' ' ILE . 59.5 t80 -55.89 -55.12 36.37 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.159 -0.963 . . . . 0.41 109.964 -179.75 . . . . . . . . 2 2 . 1 . 032 nuclear orig core ' A' A ' 339' ' ' GLU . . . . . . . . . . . . . 45.4 mt-10 -50.86 -33.92 25.88 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.237 -0.914 . . . . 1.97 110.369 -179.354 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 340' ' ' MET . . . . . . . . . . . . . 24.2 ttp -64.08 -51.7 62.8 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 120.976 -1.077 . . . . 1.14 110.081 -179.457 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 341' ' ' PHE . . . . . . . . . . . . . 45.2 m-85 -61.98 -45.18 94.76 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.137 -0.977 . . . . 0.21 110.017 -179.437 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 342' ' ' ARG . . . . . 0.408 ' O ' ' HB3' ' A' ' 345' ' ' ASN . 40.5 ttt180 -50.77 -40.39 54.84 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.144 -0.973 . . . . 3.15 109.817 -179.75 . . . . . . . . 2 2 . 1 . 032 nuclear orig core ' A' A ' 343' ' ' GLU . . . . . . . . . . . . . 35.5 tp10 -58.43 -51.53 69.46 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.095 -1.003 . . . . 2.35 109.766 -179.624 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 344' ' ' LEU . . . . . 0.41 ' O ' HD21 ' A' ' 348' ' ' LEU . 84.6 mt -61.08 -32.0 71.65 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.239 -0.913 . . . . 1.06 109.338 -179.895 . . . . . . . . 2 2 . 1 . 032 nuclear orig core ' A' A ' 345' ' ' ASN . . . . . 0.408 ' HB3' ' O ' ' A' ' 342' ' ' ARG . 8.7 t-20 -58.67 -55.0 40.7 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.254 -0.904 . . . . 1.36 109.325 179.861 . . . . . . . . 2 2 . 1 . 032 nuclear orig core ' A' A ' 346' ' ' GLU . . . . . . . . . . . . . 32.4 tp10 -61.62 -32.1 72.22 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.382 -0.824 . . . . 1.65 109.843 -179.736 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 347' ' ' ALA . . . . . . . . . . . . . . . -59.5 -57.04 14.69 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.187 -0.945 . . . . 1.03 109.787 -179.738 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 348' ' ' LEU . . . . . 0.516 ' N ' HD23 ' A' ' 348' ' ' LEU . 3.5 mm? -61.82 -38.73 89.25 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.171 -0.956 . . . . 1.04 109.645 -179.675 . . . . . . . . 2 2 . 1 . 032 nuclear orig core ' A' A ' 349' ' ' GLU . . . . . . . . . . . . . 1.8 mt-10 -58.86 -38.39 78.66 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.306 -0.871 . . . . 1.94 110.168 -179.443 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 350' ' ' LEU . . . . . 0.444 HD23 HD23 ' B' ' 350' ' ' LEU . 7.8 tt -63.76 -43.67 95.73 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.179 -0.951 . . . . 1.17 109.87 -179.576 . . . . . . . . 2 2 . 1 . 032 nuclear orig core ' A' A ' 351' ' ' LYS . . . . . . . . . . . . . 18.8 tttm -58.34 -42.02 85.94 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.311 -0.868 . . . . 1.97 109.549 -179.774 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 352' ' ' ASP . . . . . . . . . . . . . 48.0 m-20 -56.2 -41.52 75.72 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.252 -0.905 . . . . 1.16 109.522 -179.983 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 353' ' ' ALA . . . . . . . . . . . . . . . -67.97 -25.54 65.48 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.229 -0.92 . . . . 1.22 109.434 -179.936 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 354' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.491 1.594 0 O-C-N 121.261 -0.9 . . . . 1.71 109.508 179.968 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' B' B ' 326' ' ' GLU . . . . . 0.417 ' HB2' ' CE1' ' B' ' 328' ' ' PHE . 45.0 mt-10 . . . . . 0 N--CA 1.488 1.462 0 N-CA-C 109.348 -0.612 . . . . 2.13 109.348 . . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' B' B ' 327' ' ' TYR . . . . . . . . . . . . . 44.6 m-85 -149.6 109.22 4.02 Favored 'General case' 0 N--CA 1.488 1.447 0 O-C-N 121.259 -0.901 . . . . 0.99 109.291 179.914 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' B' B ' 328' ' ' PHE . . . . . 0.417 ' CE1' ' HB2' ' B' ' 326' ' ' GLU . 40.8 m-85 -113.63 -169.23 1.47 Allowed 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.255 -0.903 . . . . 0.36 109.496 -179.772 . . . . . . . . 2 2 . 1 . 032 nuclear orig core ' B' B ' 329' ' ' THR . . . . . . . . . . . . . 6.4 p -153.52 168.64 25.46 Favored 'General case' 0 N--CA 1.488 1.458 0 O-C-N 121.247 -0.908 . . . . 1.05 109.267 -179.989 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' B' B ' 330' ' ' LEU . . . . . 0.417 ' O ' ' HA ' ' D' ' 329' ' ' THR . 20.0 tp -150.26 129.15 12.51 Favored 'General case' 0 N--CA 1.489 1.487 0 O-C-N 121.18 -0.95 . . . . 1.07 109.759 -179.88 . . . . . . . . 2 2 . 1 . 032 nuclear orig core ' B' B ' 331' ' ' GLN . . . . . . . . . . . . . 1.2 tp60 -87.83 113.27 23.33 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.355 -0.841 . . . . 0.91 109.383 179.739 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' B' B ' 332' ' ' ILE . . . . . 0.431 ' CG2' ' HA ' ' B' ' 338' ' ' PHE . 76.0 mt -103.59 105.01 17.57 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.554 0 O-C-N 121.29 -0.881 . . . . 1.08 109.444 -179.948 . . . . . . . . 2 2 . 1 . 032 nuclear orig core ' B' B ' 333' ' ' ARG . . . . . 0.476 ' HG2' ' NH1' ' B' ' 333' ' ' ARG . 0.0 OUTLIER -71.51 150.71 44.56 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.178 -0.952 . . . . 3.42 109.359 179.802 . . . . . . . . 3 3 . 1 . 032 nuclear orig core ' B' B ' 334' ' ' GLY . . . . . . . . . . . . . . . 76.24 126.78 0.24 Allowed Glycine 0 N--CA 1.49 2.276 0 N-CA-C 109.553 -1.419 . . . . 0.4 109.553 -179.933 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' B' B ' 335' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -74.04 -32.9 63.53 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.25 -1.147 . . . . 3.55 109.654 -179.855 . . . . . . . . 2 2 . 1 . 032 nuclear orig core ' B' B ' 336' ' ' GLU . . . . . . . . . . . . . 3.1 mt-10 -57.96 -61.42 2.55 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.132 -0.98 . . . . 2.28 109.781 -179.723 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' B' B ' 337' ' ' ARG . . . . . . . . . . . . . 22.2 mmm180 -59.94 -33.78 72.36 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.225 -0.922 . . . . 3.64 109.674 -179.716 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' B' B ' 338' ' ' PHE . . . . . 0.431 ' HA ' ' CG2' ' B' ' 332' ' ' ILE . 59.0 t80 -55.89 -55.11 36.48 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.16 -0.963 . . . . 0.39 109.873 -179.715 . . . . . . . . 2 2 . 1 . 032 nuclear orig core ' B' B ' 339' ' ' GLU . . . . . . . . . . . . . 45.0 mt-10 -50.65 -34.22 25.47 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.21 -0.931 . . . . 1.98 110.399 -179.435 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' B' B ' 340' ' ' MET . . . . . . . . . . . . . 23.9 ttp -64.01 -51.57 63.63 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.049 -1.032 . . . . 1.14 110.115 -179.375 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' B' B ' 341' ' ' PHE . . . . . . . . . . . . . 44.8 m-85 -61.9 -45.46 93.65 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.167 -0.958 . . . . 0.22 109.96 -179.451 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' B' B ' 342' ' ' ARG . . . . . 0.414 ' O ' ' HB3' ' B' ' 345' ' ' ASN . 41.1 ttt180 -50.62 -40.36 52.67 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.187 -0.946 . . . . 3.15 109.933 -179.796 . . . . . . . . 2 2 . 1 . 032 nuclear orig core ' B' B ' 343' ' ' GLU . . . . . . . . . . . . . 35.4 tp10 -58.46 -51.51 69.53 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.192 -0.943 . . . . 2.35 109.825 -179.604 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' B' B ' 344' ' ' LEU . . . . . 0.408 ' O ' HD21 ' B' ' 348' ' ' LEU . 84.0 mt -61.01 -31.99 71.6 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.137 -0.977 . . . . 1.05 109.345 -179.949 . . . . . . . . 2 2 . 1 . 032 nuclear orig core ' B' B ' 345' ' ' ASN . . . . . 0.414 ' HB3' ' O ' ' B' ' 342' ' ' ARG . 9.0 t-20 -58.65 -55.06 39.98 Favored 'General case' 0 N--CA 1.488 1.451 0 O-C-N 121.325 -0.859 . . . . 1.35 109.372 179.83 . . . . . . . . 2 2 . 1 . 032 nuclear orig core ' B' B ' 346' ' ' GLU . . . . . . . . . . . . . 32.4 tp10 -61.52 -32.21 72.25 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.478 -0.764 . . . . 1.66 109.815 -179.867 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' B' B ' 347' ' ' ALA . . . . . . . . . . . . . . . -59.59 -56.95 15.51 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.166 -0.959 . . . . 1.02 109.912 -179.756 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' B' B ' 348' ' ' LEU . . . . . 0.516 ' N ' HD23 ' B' ' 348' ' ' LEU . 3.5 mm? -61.92 -38.83 89.89 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.168 -0.957 . . . . 1.05 109.71 -179.734 . . . . . . . . 2 2 . 1 . 032 nuclear orig core ' B' B ' 349' ' ' GLU . . . . . . . . . . . . . 1.8 mt-10 -58.67 -38.36 78.02 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.298 -0.876 . . . . 1.95 110.184 -179.583 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' B' B ' 350' ' ' LEU . . . . . 0.446 HD22 ' O ' ' B' ' 350' ' ' LEU . 7.8 tt -63.81 -43.58 95.84 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.089 -1.007 . . . . 1.18 109.827 -179.512 . . . . . . . . 2 2 . 1 . 032 nuclear orig core ' B' B ' 351' ' ' LYS . . . . . . . . . . . . . 18.7 tttm -58.39 -42.14 86.42 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.189 -0.944 . . . . 1.96 109.53 -179.744 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' B' B ' 352' ' ' ASP . . . . . . . . . . . . . 48.5 m-20 -55.91 -41.6 74.79 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.284 -0.885 . . . . 1.16 109.524 -179.996 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' B' B ' 353' ' ' ALA . . . . . . . . . . . . . . . -68.03 -25.6 65.46 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.19 -0.944 . . . . 1.21 109.494 -179.871 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' B' B ' 354' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.49 1.552 0 O-C-N 121.213 -0.929 . . . . 1.69 109.54 179.884 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' C' C ' 326' ' ' GLU . . . . . 0.447 ' OE1' ' HB2' ' A' ' 335' ' ' ARG . 95.0 mt-10 . . . . . 0 N--CA 1.49 1.527 0 N-CA-C 109.286 -0.635 . . . . 2.17 109.286 . . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' C' C ' 327' ' ' TYR . . . . . . . . . . . . . 59.0 m-85 -149.02 104.53 3.44 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.102 -0.999 . . . . 1.03 109.808 -179.744 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' C' C ' 328' ' ' PHE . . . . . . . . . . . . . 96.3 m-85 -106.03 -164.53 1.02 Allowed 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.297 -0.877 . . . . 0.37 109.303 179.654 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' C' C ' 329' ' ' THR . . . . . . . . . . . . . 4.2 p -155.75 167.01 31.77 Favored 'General case' 0 N--CA 1.489 1.491 0 O-C-N 121.214 -0.929 . . . . 1.04 109.751 -179.982 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' C' C ' 330' ' ' LEU . . . . . . . . . . . . . 40.3 tp -150.94 125.57 9.62 Favored 'General case' 0 N--CA 1.488 1.471 0 O-C-N 121.321 -0.862 . . . . 1.09 109.174 179.802 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' C' C ' 331' ' ' GLN . . . . . . . . . . . . . 3.5 tp60 -87.45 113.06 22.81 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.164 -0.96 . . . . 1.48 109.732 -179.857 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' C' C ' 332' ' ' ILE . . . . . . . . . . . . . 31.7 mt -103.77 109.5 27.32 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.643 0 O-C-N 121.25 -0.906 . . . . 1.08 109.537 179.871 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' C' C ' 333' ' ' ARG . . . . . 0.48 ' HG3' ' NH1' ' C' ' 333' ' ' ARG . 16.0 mtm-85 -73.86 149.7 41.39 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.227 -0.921 . . . . 3.36 109.428 179.786 . . . . . . . . 2 2 . 1 . 032 nuclear orig core ' C' C ' 334' ' ' GLY . . . . . . . . . . . . . . . 76.72 132.16 0.47 Allowed Glycine 0 N--CA 1.49 2.289 0 N-CA-C 109.6 -1.4 . . . . 0.35 109.6 179.903 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' C' C ' 335' ' ' ARG . . . . . 0.411 ' O ' ' HB3' ' C' ' 338' ' ' PHE . 2.6 tmt_? -76.45 -30.74 57.47 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.309 -1.112 . . . . 3.23 109.647 179.943 . . . . . . . . 2 2 . 1 . 032 nuclear orig core ' C' C ' 336' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -55.81 -57.11 13.39 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.322 -0.861 . . . . 2.62 109.959 -179.603 . . . . . . . . 2 2 . 1 . 032 nuclear orig core ' C' C ' 337' ' ' ARG . . . . . 0.541 ' HG3' ' NH1' ' C' ' 337' ' ' ARG . 1.4 mtm-85 -60.82 -30.56 70.16 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.098 -1.002 . . . . 3.61 109.718 -179.839 . . . . . . . . 2 2 . 1 . 032 nuclear orig core ' C' C ' 338' ' ' PHE . . . . . 0.411 ' HB3' ' O ' ' C' ' 335' ' ' ARG . 75.9 t80 -54.0 -59.84 4.11 Favored 'General case' 0 N--CA 1.489 1.49 0 O-C-N 121.306 -0.871 . . . . 0.43 110.265 -179.257 . . . . . . . . 2 2 . 1 . 032 nuclear orig core ' C' C ' 339' ' ' GLU . . . . . . . . . . . . . 1.1 mt-10 -50.0 -37.75 34.07 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.024 -1.048 . . . . 2.05 110.58 -179.283 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' C' C ' 340' ' ' MET . . . . . . . . . . . . . 25.9 ttp -63.62 -54.8 30.16 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.034 -1.041 . . . . 1.1 110.426 -179.097 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' C' C ' 341' ' ' PHE . . . . . . . . . . . . . 59.5 m-85 -61.8 -58.49 7.77 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.117 -0.989 . . . . 0.21 110.006 -179.298 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' C' C ' 342' ' ' ARG . . . . . 0.455 ' CG ' ' NH1' ' C' ' 342' ' ' ARG . 0.0 OUTLIER -48.21 -32.5 7.2 Favored 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.186 -0.946 . . . . 3.42 109.813 -179.723 . . . . . . . . 3 3 . 1 . 032 nuclear orig core ' C' C ' 343' ' ' GLU . . . . . . . . . . . . . 10.0 tp10 -58.72 -55.52 33.97 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.149 -0.97 . . . . 2.14 109.458 -179.895 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' C' C ' 344' ' ' LEU . . . . . 0.475 ' O ' HD21 ' C' ' 348' ' ' LEU . 43.3 mt -62.16 -28.7 69.84 Favored 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.241 -0.912 . . . . 1.09 109.361 179.833 . . . . . . . . 2 2 . 1 . 032 nuclear orig core ' C' C ' 345' ' ' ASN . . . . . . . . . . . . . 15.8 t-20 -56.33 -56.56 19.5 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.247 -0.908 . . . . 1.38 109.53 -179.996 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' C' C ' 346' ' ' GLU . . . . . . . . . . . . . 61.6 tt0 -61.17 -30.66 70.53 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.227 -0.92 . . . . 2.21 109.592 -179.831 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' C' C ' 347' ' ' ALA . . . . . 0.434 ' HB2' ' HB3' ' D' ' 347' ' ' ALA . . . -59.82 -54.73 42.79 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.284 -0.885 . . . . 1.03 109.94 -179.726 . . . . . . . . 2 2 . 1 . 032 nuclear orig core ' C' C ' 348' ' ' LEU . . . . . 0.488 HD23 ' N ' ' C' ' 348' ' ' LEU . 3.3 mm? -62.31 -43.58 98.5 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.257 -0.902 . . . . 1.06 109.768 -179.664 . . . . . . . . 2 2 . 1 . 032 nuclear orig core ' C' C ' 349' ' ' GLU . . . . . . . . . . . . . 67.6 mm-40 -59.26 -32.71 70.26 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.192 -0.943 . . . . 2.19 110.386 -179.242 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' C' C ' 350' ' ' LEU . . . . . 0.491 ' CD1' HD21 ' D' ' 350' ' ' LEU . 6.1 tt -62.67 -49.57 74.62 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 120.953 -1.092 . . . . 1.2 109.562 -179.702 . . . . . . . . 2 2 . 1 . 032 nuclear orig core ' C' C ' 351' ' ' LYS . . . . . . . . . . . . . 73.2 tttt -57.83 -44.03 86.17 Favored 'General case' 0 C--N 1.303 -1.437 0 O-C-N 121.176 -0.953 . . . . 1.92 109.393 -179.777 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' C' C ' 352' ' ' ASP . . . . . . . . . . . . . 42.4 m-20 -58.36 -39.79 80.5 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.333 -0.855 . . . . 1.19 110.015 179.918 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' C' C ' 353' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 1.598 0 O-C-N 121.177 -0.952 . . . . 1.15 110.27 -179.246 . . . . . . . . 0 0 . 1 . 032 nuclear orig core ' D' D ' 326' ' ' GLU . . . . . 0.414 ' HB2' ' CE1' ' D' ' 328' ' ' PHE . 45.0 mt-10 . . . . . 0 N--CA 1.49 1.526 0 N-CA-C 109.356 -0.609 . . . . 2.13 109.356 . . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' D' D ' 327' ' ' TYR . . . . . . . . . . . . . 44.7 m-85 -149.24 109.1 4.05 Favored 'General case' 0 N--CA 1.488 1.43 0 O-C-N 121.358 -0.839 . . . . 1.0 109.276 179.925 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' D' D ' 328' ' ' PHE . . . . . 0.414 ' CE1' ' HB2' ' D' ' 326' ' ' GLU . 40.4 m-85 -113.58 -169.36 1.49 Allowed 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.236 -0.915 . . . . 0.34 109.533 -179.775 . . . . . . . . 2 2 . 1 . 032 nuclear orig core ' D' D ' 329' ' ' THR . . . . . 0.417 ' HA ' ' O ' ' B' ' 330' ' ' LEU . 6.7 p -153.38 168.52 25.81 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.314 -0.866 . . . . 1.05 109.181 -179.979 . . . . . . . . 2 2 . 1 . 032 nuclear orig core ' D' D ' 330' ' ' LEU . . . . . . . . . . . . . 19.9 tp -150.02 129.13 12.71 Favored 'General case' 0 N--CA 1.489 1.491 0 O-C-N 121.14 -0.975 . . . . 1.07 109.686 -179.868 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' D' D ' 331' ' ' GLN . . . . . . . . . . . . . 1.2 tp60 -87.96 113.21 23.39 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.299 -0.875 . . . . 0.93 109.382 179.747 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' D' D ' 332' ' ' ILE . . . . . 0.435 ' CG2' ' HA ' ' D' ' 338' ' ' PHE . 74.7 mt -103.41 104.96 17.46 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.538 0 O-C-N 121.235 -0.915 . . . . 1.07 109.51 -179.985 . . . . . . . . 2 2 . 1 . 032 nuclear orig core ' D' D ' 333' ' ' ARG . . . . . 0.477 ' HG2' ' NH1' ' D' ' 333' ' ' ARG . 0.0 OUTLIER -71.47 150.78 44.55 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.246 -0.909 . . . . 3.42 109.246 179.84 . . . . . . . . 3 3 . 1 . 032 nuclear orig core ' D' D ' 334' ' ' GLY . . . . . . . . . . . . . . . 76.18 126.81 0.24 Allowed Glycine 0 N--CA 1.491 2.304 0 N-CA-C 109.475 -1.45 . . . . 0.41 109.475 -179.996 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' D' D ' 335' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -74.05 -32.78 63.46 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.31 -1.112 . . . . 3.58 109.63 -179.859 . . . . . . . . 2 2 . 1 . 032 nuclear orig core ' D' D ' 336' ' ' GLU . . . . . . . . . . . . . 3.2 mt-10 -58.06 -61.53 2.48 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.221 -0.925 . . . . 2.26 109.795 -179.762 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' D' D ' 337' ' ' ARG . . . . . . . . . . . . . 22.3 mmm180 -59.84 -33.61 71.99 Favored 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.319 -0.863 . . . . 3.64 109.651 -179.678 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' D' D ' 338' ' ' PHE . . . . . 0.435 ' HA ' ' CG2' ' D' ' 332' ' ' ILE . 58.6 t80 -55.99 -55.03 37.69 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.217 -0.927 . . . . 0.4 109.916 -179.697 . . . . . . . . 2 2 . 1 . 032 nuclear orig core ' D' D ' 339' ' ' GLU . . . . . . . . . . . . . 44.7 mt-10 -50.8 -34.12 26.25 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.262 -0.899 . . . . 1.99 110.41 -179.411 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' D' D ' 340' ' ' MET . . . . . . . . . . . . . 23.9 ttp -64.14 -51.41 64.03 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.045 -1.035 . . . . 1.13 110.132 -179.413 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' D' D ' 341' ' ' PHE . . . . . . . . . . . . . 44.7 m-85 -61.93 -45.5 93.42 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.179 -0.951 . . . . 0.21 109.972 -179.462 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' D' D ' 342' ' ' ARG . . . . . 0.414 ' O ' ' HB3' ' D' ' 345' ' ' ASN . 41.5 ttt180 -50.64 -40.31 52.79 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.141 -0.974 . . . . 3.15 109.876 -179.751 . . . . . . . . 2 2 . 1 . 032 nuclear orig core ' D' D ' 343' ' ' GLU . . . . . . . . . . . . . 36.0 tp10 -58.36 -51.67 68.82 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.183 -0.948 . . . . 2.35 109.77 -179.673 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' D' D ' 344' ' ' LEU . . . . . 0.454 HD23 HD23 ' C' ' 344' ' ' LEU . 84.7 mt -60.91 -32.0 71.5 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.221 -0.925 . . . . 1.06 109.425 -179.952 . . . . . . . . 2 2 . 1 . 032 nuclear orig core ' D' D ' 345' ' ' ASN . . . . . 0.414 ' HB3' ' O ' ' D' ' 342' ' ' ARG . 9.1 t-20 -58.69 -55.2 38.09 Favored 'General case' 0 N--CA 1.489 1.487 0 O-C-N 121.351 -0.843 . . . . 1.35 109.303 179.867 . . . . . . . . 2 2 . 1 . 032 nuclear orig core ' D' D ' 346' ' ' GLU . . . . . . . . . . . . . 31.5 tp10 -61.4 -32.2 72.13 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.35 -0.844 . . . . 1.69 109.839 -179.85 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' D' D ' 347' ' ' ALA . . . . . 0.434 ' HB3' ' HB2' ' C' ' 347' ' ' ALA . . . -59.61 -56.94 15.63 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.128 -0.983 . . . . 1.03 109.78 -179.669 . . . . . . . . 2 2 . 1 . 032 nuclear orig core ' D' D ' 348' ' ' LEU . . . . . 0.513 ' N ' HD23 ' D' ' 348' ' ' LEU . 3.5 mm? -61.96 -38.79 89.84 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.195 -0.941 . . . . 1.04 109.625 -179.662 . . . . . . . . 2 2 . 1 . 032 nuclear orig core ' D' D ' 349' ' ' GLU . . . . . . . . . . . . . 1.8 mt-10 -58.83 -38.17 78.07 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.293 -0.879 . . . . 1.95 110.183 -179.514 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' D' D ' 350' ' ' LEU . . . . . 0.491 HD21 ' CD1' ' C' ' 350' ' ' LEU . 7.8 tt -63.96 -43.61 95.3 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.091 -1.006 . . . . 1.16 109.852 -179.505 . . . . . . . . 2 2 . 1 . 032 nuclear orig core ' D' D ' 351' ' ' LYS . . . . . . . . . . . . . 18.7 tttm -58.32 -42.03 85.85 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.305 -0.872 . . . . 1.97 109.561 -179.758 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' D' D ' 352' ' ' ASP . . . . . . . . . . . . . 49.0 m-20 -56.04 -41.57 75.22 Favored 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.203 -0.936 . . . . 1.17 109.579 179.972 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' D' D ' 353' ' ' ALA . . . . . . . . . . . . . . . -67.84 -25.72 65.69 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.204 -0.935 . . . . 1.21 109.513 -179.97 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' D' D ' 354' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.492 1.668 0 O-C-N 121.26 -0.9 . . . . 1.68 109.474 -179.971 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 326' ' ' GLU . . . . . . . . . . . . . 33.9 mm-40 . . . . . 0 N--CA 1.489 1.489 0 CA-C-O 121.381 0.61 . . . . 2.13 109.603 . . . . . . . . . 0 0 . 1 . 033 nuclear orig core ' A' A ' 327' ' ' TYR . . . . . . . . . . . . . 39.4 m-85 -149.83 105.81 3.45 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.256 -0.903 . . . . 1.0 109.638 179.928 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 328' ' ' PHE . . . . . 0.579 ' CZ ' ' HB2' ' C' ' 335' ' ' ARG . 24.7 m-85 -113.29 -166.51 1.09 Allowed 'General case' 0 N--CA 1.488 1.443 0 O-C-N 121.357 -0.84 . . . . 0.34 109.192 179.799 . . . . . . . . 2 2 . 1 . 033 nuclear orig core ' A' A ' 329' ' ' THR . . . . . 0.476 HG21 ' O ' ' A' ' 328' ' ' PHE . 71.2 p -153.94 173.99 15.23 Favored 'General case' 0 N--CA 1.495 1.814 0 O-C-N 121.395 -0.815 . . . . 1.05 109.18 179.559 . . . . . . . . 2 2 . 1 . 033 nuclear orig core ' A' A ' 330' ' ' LEU . . . . . . . . . . . . . 17.2 tp -150.41 131.0 13.93 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.314 -0.866 . . . . 1.07 109.394 179.845 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 331' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -87.48 112.26 22.02 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.362 -0.837 . . . . 0.91 109.124 179.793 . . . . . . . . 2 2 . 1 . 033 nuclear orig core ' A' A ' 332' ' ' ILE . . . . . 0.49 ' CG2' ' HA ' ' A' ' 338' ' ' PHE . 79.5 mt -103.47 105.79 18.98 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.477 0 O-C-N 121.075 -1.015 . . . . 1.09 109.736 -179.858 . . . . . . . . 2 2 . 1 . 033 nuclear orig core ' A' A ' 333' ' ' ARG . . . . . 0.621 ' HG2' ' CE2' ' C' ' 327' ' ' TYR . 25.9 mtt180 -72.38 148.26 45.42 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.44 -0.787 . . . . 3.41 109.871 179.914 . . . . . . . . 2 2 . 1 . 033 nuclear orig core ' A' A ' 334' ' ' GLY . . . . . . . . . . . . . . . 82.69 134.81 2.19 Favored Glycine 0 N--CA 1.491 2.322 0 N-CA-C 109.856 -1.297 . . . . 0.4 109.856 179.784 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 335' ' ' ARG . . . . . 0.46 ' HB2' ' CZ ' ' C' ' 328' ' ' PHE . 0.0 OUTLIER -80.37 -39.75 27.89 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.338 -1.095 . . . . 3.55 109.653 179.997 . . . . . . . . 3 3 . 1 . 033 nuclear orig core ' A' A ' 336' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -58.82 -61.48 2.59 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.14 -0.975 . . . . 2.29 109.891 -179.657 . . . . . . . . 2 2 . 1 . 033 nuclear orig core ' A' A ' 337' ' ' ARG . . . . . 0.448 ' NH1' ' CG ' ' A' ' 337' ' ' ARG . 0.0 OUTLIER -58.09 -30.92 66.62 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.19 -0.943 . . . . 3.64 109.529 -179.76 . . . . . . . . 3 3 . 1 . 033 nuclear orig core ' A' A ' 338' ' ' PHE . . . . . 0.49 ' HA ' ' CG2' ' A' ' 332' ' ' ILE . 50.4 t80 -55.78 -56.37 21.33 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.306 -0.871 . . . . 0.41 109.527 -179.872 . . . . . . . . 2 2 . 1 . 033 nuclear orig core ' A' A ' 339' ' ' GLU . . . . . . . . . . . . . 48.9 mt-10 -50.88 -33.27 23.32 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.231 -0.918 . . . . 1.97 109.875 -179.965 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 340' ' ' MET . . . . . . . . . . . . . 18.7 ttp -62.22 -53.3 57.14 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.29 -0.881 . . . . 1.14 110.008 -179.416 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 341' ' ' PHE . . . . . . . . . . . . . 36.9 m-85 -61.2 -49.32 77.62 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.206 -0.934 . . . . 0.21 110.202 -179.616 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 342' ' ' ARG . . . . . . . . . . . . . 4.2 ttt180 -47.43 -41.06 19.45 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.368 -0.832 . . . . 3.15 109.821 -179.972 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 343' ' ' GLU . . . . . . . . . . . . . 65.2 tt0 -59.26 -47.94 83.49 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.156 -0.965 . . . . 2.35 110.285 -179.586 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 344' ' ' LEU . . . . . . . . . . . . . 47.7 mt -63.16 -32.36 73.73 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.08 -1.013 . . . . 1.06 110.063 -179.431 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 345' ' ' ASN . . . . . . . . . . . . . 10.8 t-20 -57.96 -55.38 35.65 Favored 'General case' 0 N--CA 1.488 1.47 0 O-C-N 121.19 -0.944 . . . . 1.36 109.637 -179.756 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 346' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -61.55 -29.74 70.2 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.211 -0.93 . . . . 1.65 109.977 -179.844 . . . . . . . . 2 2 . 1 . 033 nuclear orig core ' A' A ' 347' ' ' ALA . . . . . . . . . . . . . . . -59.34 -58.93 6.47 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.278 -0.889 . . . . 1.03 110.237 -179.534 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 348' ' ' LEU . . . . . 0.469 ' N ' ' CD2' ' A' ' 348' ' ' LEU . 4.1 mm? -61.2 -42.7 99.05 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.162 -0.961 . . . . 1.04 110.005 -179.365 . . . . . . . . 2 2 . 1 . 033 nuclear orig core ' A' A ' 349' ' ' GLU . . . . . . . . . . . . . 16.2 mm-40 -57.87 -34.05 69.34 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.207 -0.933 . . . . 1.94 109.997 -179.493 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 350' ' ' LEU . . . . . 0.456 ' O ' HD22 ' A' ' 350' ' ' LEU . 6.2 tt -64.43 -44.3 91.64 Favored 'General case' 0 N--CA 1.495 1.783 0 O-C-N 121.194 -0.941 . . . . 1.17 109.651 -179.592 . . . . . . . . 2 2 . 1 . 033 nuclear orig core ' A' A ' 351' ' ' LYS . . . . . . . . . . . . . 43.8 tttt -60.46 -46.82 88.69 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.246 -0.909 . . . . 1.97 109.859 -179.694 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 352' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -54.86 -44.89 74.43 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.416 -0.803 . . . . 1.16 110.377 -179.288 . . . . . . . . 2 2 . 1 . 033 nuclear orig core ' A' A ' 353' ' ' ALA . . . . . . . . . . . . . . . -66.68 -26.98 67.29 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 120.95 -1.093 . . . . 1.22 109.608 -179.804 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 354' ' ' GLN . . . . . . . . . . . . . 8.8 tt0 . . . . . 0 N--CA 1.488 1.475 0 O-C-N 121.001 -1.062 . . . . 1.71 109.825 -179.749 . . . . . . . . 0 0 . 1 . 033 nuclear orig core ' B' B ' 326' ' ' GLU . . . . . . . . . . . . . 35.1 mm-40 . . . . . 0 N--CA 1.489 1.504 0 CA-C-O 121.466 0.651 . . . . 2.13 109.791 . . . . . . . . . 0 0 . 1 . 033 nuclear orig core ' B' B ' 327' ' ' TYR . . . . . 0.614 ' CE1' ' HG2' ' D' ' 333' ' ' ARG . 39.2 m-85 -150.02 104.38 3.28 Favored 'General case' 0 N--CA 1.489 1.487 0 O-C-N 121.325 -0.859 . . . . 0.99 109.678 -179.957 . . . . . . . . 2 2 . 1 . 033 nuclear orig core ' B' B ' 328' ' ' PHE . . . . . 0.462 ' O ' HG21 ' B' ' 329' ' ' THR . 18.4 m-85 -112.43 -163.86 0.88 Allowed 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.287 -0.883 . . . . 0.36 109.308 179.657 . . . . . . . . 2 2 . 1 . 033 nuclear orig core ' B' B ' 329' ' ' THR . . . . . 0.464 ' HA ' ' O ' ' D' ' 330' ' ' LEU . 67.1 p -154.76 176.3 12.63 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.28 -0.887 . . . . 1.05 109.36 179.452 . . . . . . . . 2 2 . 1 . 033 nuclear orig core ' B' B ' 330' ' ' LEU . . . . . 0.467 ' O ' ' HA ' ' D' ' 329' ' ' THR . 18.3 tp -151.9 130.32 12.13 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.183 -0.948 . . . . 1.07 109.138 179.653 . . . . . . . . 2 2 . 1 . 033 nuclear orig core ' B' B ' 331' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -87.38 111.95 21.62 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.221 -0.924 . . . . 0.91 109.144 179.72 . . . . . . . . 2 2 . 1 . 033 nuclear orig core ' B' B ' 332' ' ' ILE . . . . . 0.441 ' CG2' ' HA ' ' B' ' 338' ' ' PHE . 72.0 mt -103.52 107.32 21.93 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.531 0 O-C-N 120.886 -1.134 . . . . 1.08 109.659 -179.815 . . . . . . . . 2 2 . 1 . 033 nuclear orig core ' B' B ' 333' ' ' ARG . . . . . 0.615 ' HG2' ' CE1' ' D' ' 327' ' ' TYR . 27.2 mtt180 -73.9 147.96 42.69 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.356 -0.84 . . . . 3.42 109.824 -179.857 . . . . . . . . 2 2 . 1 . 033 nuclear orig core ' B' B ' 334' ' ' GLY . . . . . . . . . . . . . . . 82.47 135.97 2.35 Favored Glycine 0 N--CA 1.488 2.118 0 N-CA-C 109.643 -1.383 . . . . 0.4 109.643 179.799 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' B' B ' 335' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -80.68 -40.35 25.6 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.303 -1.116 . . . . 3.55 109.96 -179.964 . . . . . . . . 2 2 . 1 . 033 nuclear orig core ' B' B ' 336' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -58.61 -59.98 4.53 Favored 'General case' 0 N--CA 1.495 1.811 0 O-C-N 121.102 -0.999 . . . . 2.28 109.989 -179.638 . . . . . . . . 2 2 . 1 . 033 nuclear orig core ' B' B ' 337' ' ' ARG . . . . . 0.461 ' CG ' ' NH1' ' B' ' 337' ' ' ARG . 0.0 OUTLIER -59.23 -29.97 67.9 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.113 -0.992 . . . . 3.64 109.61 -179.674 . . . . . . . . 3 3 . 1 . 033 nuclear orig core ' B' B ' 338' ' ' PHE . . . . . 0.441 ' HA ' ' CG2' ' B' ' 332' ' ' ILE . 51.8 t80 -56.83 -57.06 14.14 Favored 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.509 -0.745 . . . . 0.39 109.402 179.837 . . . . . . . . 2 2 . 1 . 033 nuclear orig core ' B' B ' 339' ' ' GLU . . . . . . . . . . . . . 48.3 mt-10 -50.91 -31.72 18.46 Favored 'General case' 0 N--CA 1.493 1.722 0 O-C-N 121.293 -0.879 . . . . 1.98 109.875 -179.774 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' B' B ' 340' ' ' MET . . . . . . . . . . . . . 18.8 ttp -63.88 -53.55 48.74 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.286 -0.884 . . . . 1.14 110.04 -179.57 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' B' B ' 341' ' ' PHE . . . . . . . . . . . . . 37.5 m-85 -61.33 -49.0 78.76 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.232 -0.917 . . . . 0.22 109.866 -179.481 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' B' B ' 342' ' ' ARG . . . . . . . . . . . . . 4.6 ttt180 -47.45 -40.91 19.34 Favored 'General case' 0 N--CA 1.493 1.717 0 O-C-N 121.171 -0.955 . . . . 3.15 109.928 -179.756 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' B' B ' 343' ' ' GLU . . . . . . . . . . . . . 62.5 tt0 -59.42 -48.04 83.18 Favored 'General case' 0 N--CA 1.495 1.811 0 O-C-N 121.365 -0.835 . . . . 2.35 110.302 -179.316 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' B' B ' 344' ' ' LEU . . . . . . . . . . . . . 37.6 mt -62.44 -33.26 74.47 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.192 -0.942 . . . . 1.05 109.949 -179.485 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' B' B ' 345' ' ' ASN . . . . . 0.447 ' HB2' HD23 ' D' ' 330' ' ' LEU . 13.2 t-20 -56.92 -56.46 21.31 Favored 'General case' 0 C--N 1.299 -1.596 0 O-C-N 121.282 -0.886 . . . . 1.35 109.862 -179.773 . . . . . . . . 2 2 . 1 . 033 nuclear orig core ' B' B ' 346' ' ' GLU . . . . . . . . . . . . . 1.3 tt0 -61.0 -28.59 69.14 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.224 -0.923 . . . . 1.66 110.073 -179.627 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' B' B ' 347' ' ' ALA . . . . . . . . . . . . . . . -60.36 -57.69 11.68 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.118 -0.989 . . . . 1.02 110.111 -179.421 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' B' B ' 348' ' ' LEU . . . . . 0.436 ' CD2' ' N ' ' B' ' 348' ' ' LEU . 4.1 mm? -62.05 -42.88 99.65 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.149 -0.97 . . . . 1.05 110.159 -179.476 . . . . . . . . 2 2 . 1 . 033 nuclear orig core ' B' B ' 349' ' ' GLU . . . . . . . . . . . . . 13.7 mm-40 -57.91 -35.23 70.75 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.045 -1.034 . . . . 1.95 110.066 -179.488 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' B' B ' 350' ' ' LEU . . . . . 0.446 HD23 HD23 ' A' ' 350' ' ' LEU . 6.5 tt -62.74 -45.01 94.71 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.002 -1.061 . . . . 1.18 109.53 -179.652 . . . . . . . . 2 2 . 1 . 033 nuclear orig core ' B' B ' 351' ' ' LYS . . . . . . . . . . . . . 37.8 tttt -59.87 -47.17 86.82 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.37 -0.831 . . . . 1.96 109.764 -179.769 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' B' B ' 352' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -54.14 -44.86 71.74 Favored 'General case' 0 N--CA 1.488 1.449 0 O-C-N 121.341 -0.849 . . . . 1.16 110.252 -179.441 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' B' B ' 353' ' ' ALA . . . . . . . . . . . . . . . -66.61 -29.43 69.47 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.026 -1.046 . . . . 1.21 109.46 -179.848 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' B' B ' 354' ' ' GLN . . . . . . . . . . . . . 7.7 tt0 . . . . . 0 N--CA 1.492 1.656 0 O-C-N 121.107 -0.996 . . . . 1.69 109.962 -179.622 . . . . . . . . 0 0 . 1 . 033 nuclear orig core ' C' C ' 326' ' ' GLU . . . . . . . . . . . . . 2.7 mp0 . . . . . 0 N--CA 1.491 1.607 0 N-CA-C 109.608 -0.516 . . . . 2.17 109.608 . . . . . . . . . 0 0 . 1 . 033 nuclear orig core ' C' C ' 327' ' ' TYR . . . . . 0.621 ' CE2' ' HG2' ' A' ' 333' ' ' ARG . 46.3 m-85 -147.21 104.74 3.69 Favored 'General case' 0 N--CA 1.487 1.413 0 O-C-N 121.263 -0.898 . . . . 1.03 109.204 -179.959 . . . . . . . . 2 2 . 1 . 033 nuclear orig core ' C' C ' 328' ' ' PHE . . . . . 0.46 ' CZ ' ' HB2' ' A' ' 335' ' ' ARG . 67.7 m-85 -106.87 -168.8 1.46 Allowed 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.287 -0.883 . . . . 0.37 109.147 -179.915 . . . . . . . . 2 2 . 1 . 033 nuclear orig core ' C' C ' 329' ' ' THR . . . . . . . . . . . . . 18.0 p -150.97 167.03 28.85 Favored 'General case' 0 C--N 1.302 -1.498 0 O-C-N 121.472 -0.768 . . . . 1.04 108.978 -179.847 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' C' C ' 330' ' ' LEU . . . . . . . . . . . . . 47.0 tp -150.92 127.7 10.93 Favored 'General case' 0 C--N 1.302 -1.488 0 O-C-N 121.2 -0.937 . . . . 1.09 109.688 -179.491 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' C' C ' 331' ' ' GLN . . . . . . . . . . . . . 5.4 tp60 -86.71 113.41 22.54 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.375 -0.828 . . . . 1.48 109.488 179.903 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' C' C ' 332' ' ' ILE . . . . . 0.454 HD12 ' CD2' ' C' ' 341' ' ' PHE . 30.3 mt -105.2 109.49 27.88 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.51 0 O-C-N 121.547 -0.721 . . . . 1.08 109.883 -179.853 . . . . . . . . 2 2 . 1 . 033 nuclear orig core ' C' C ' 333' ' ' ARG . . . . . . . . . . . . . 79.3 mtt180 -74.23 147.65 42.27 Favored 'General case' 0 C--N 1.302 -1.472 0 O-C-N 121.306 -0.871 . . . . 3.36 109.635 179.781 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' C' C ' 334' ' ' GLY . . . . . . . . . . . . . . . 80.23 127.0 0.67 Allowed Glycine 0 N--CA 1.486 1.987 0 N-CA-C 109.361 -1.495 . . . . 0.35 109.361 -179.857 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' C' C ' 335' ' ' ARG . . . . . 0.579 ' HB2' ' CZ ' ' A' ' 328' ' ' PHE . 0.0 OUTLIER -78.35 -33.12 49.29 Favored 'General case' 0 N--CA 1.487 1.412 0 O-C-N 121.201 -1.176 . . . . 3.23 109.463 179.972 . . . . . . . . 3 3 . 1 . 033 nuclear orig core ' C' C ' 336' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -57.52 -62.56 1.7 Allowed 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.127 -0.983 . . . . 2.62 108.986 179.567 . . . . . . . . 2 2 . 1 . 033 nuclear orig core ' C' C ' 337' ' ' ARG . . . . . 0.545 ' HG2' ' NH1' ' C' ' 337' ' ' ARG . 0.2 OUTLIER -59.52 -31.61 69.55 Favored 'General case' 0 N--CA 1.489 1.483 0 O-C-N 121.745 -0.597 . . . . 3.61 109.656 -179.886 . . . . . . . . 3 3 . 1 . 033 nuclear orig core ' C' C ' 338' ' ' PHE . . . . . 0.427 ' HA ' HG23 ' C' ' 332' ' ' ILE . 46.3 t80 -54.52 -59.42 4.72 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.171 -0.956 . . . . 0.43 109.755 -179.466 . . . . . . . . 2 2 . 1 . 033 nuclear orig core ' C' C ' 339' ' ' GLU . . . . . . . . . . . . . 9.9 mm-40 -48.32 -32.65 7.71 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.434 -0.792 . . . . 2.05 110.247 -179.333 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' C' C ' 340' ' ' MET . . . . . . . . . . . . . 34.6 ttp -63.91 -50.88 66.96 Favored 'General case' 0 N--CA 1.494 1.742 0 O-C-N 121.251 -0.905 . . . . 1.1 109.818 -179.809 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' C' C ' 341' ' ' PHE . . . . . 0.454 ' CD2' HD12 ' C' ' 332' ' ' ILE . 49.7 m-85 -62.83 -52.91 61.3 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 120.959 -1.088 . . . . 0.21 109.762 -179.804 . . . . . . . . 2 2 . 1 . 033 nuclear orig core ' C' C ' 342' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -47.81 -39.96 19.76 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.442 -0.786 . . . . 3.42 110.005 -179.428 . . . . . . . . 2 2 . 1 . 033 nuclear orig core ' C' C ' 343' ' ' GLU . . . . . . . . . . . . . 4.5 tp10 -60.8 -44.88 96.27 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 120.974 -1.079 . . . . 2.14 109.461 -179.998 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' C' C ' 344' ' ' LEU . . . . . 0.471 HD23 ' CD2' ' D' ' 344' ' ' LEU . 27.0 mt -60.35 -41.02 92.8 Favored 'General case' 0 N--CA 1.487 1.395 0 O-C-N 121.294 -0.879 . . . . 1.09 109.593 -179.939 . . . . . . . . 2 2 . 1 . 033 nuclear orig core ' C' C ' 345' ' ' ASN . . . . . . . . . . . . . 48.9 t-20 -54.61 -53.7 51.24 Favored 'General case' 0 N--CA 1.489 1.488 0 O-C-N 121.313 -0.867 . . . . 1.38 109.818 -179.664 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' C' C ' 346' ' ' GLU . . . . . . . . . . . . . 2.9 tp10 -58.58 -29.84 66.72 Favored 'General case' 0 C--N 1.303 -1.449 0 O-C-N 121.108 -0.995 . . . . 2.21 109.362 -179.872 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' C' C ' 347' ' ' ALA . . . . . . . . . . . . . . . -63.12 -51.82 65.0 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.16 -0.962 . . . . 1.03 109.766 179.943 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' C' C ' 348' ' ' LEU . . . . . 0.462 HD21 ' O ' ' C' ' 344' ' ' LEU . 3.6 mm? -62.88 -43.6 98.35 Favored 'General case' 0 N--CA 1.494 1.743 0 O-C-N 121.04 -1.038 . . . . 1.06 109.773 -179.619 . . . . . . . . 2 2 . 1 . 033 nuclear orig core ' C' C ' 349' ' ' GLU . . . . . . . . . . . . . 3.1 mm-40 -59.25 -36.82 76.19 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.284 -0.885 . . . . 2.19 110.085 -179.376 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' C' C ' 350' ' ' LEU . . . . . 0.459 HD22 ' O ' ' C' ' 350' ' ' LEU . 5.5 tt -62.75 -48.91 77.13 Favored 'General case' 0 C--N 1.302 -1.466 0 O-C-N 121.12 -0.987 . . . . 1.2 109.29 -179.775 . . . . . . . . 2 2 . 1 . 033 nuclear orig core ' C' C ' 351' ' ' LYS . . . . . . . . . . . . . 27.4 tttm -58.23 -39.66 79.67 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.198 -0.939 . . . . 1.92 109.06 179.662 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' C' C ' 352' ' ' ASP . . . . . . . . . . . . . 96.2 m-20 -54.44 -31.7 55.96 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.334 -0.853 . . . . 1.19 109.579 179.888 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' C' C ' 353' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 1.615 0 O-C-N 121.42 -0.8 . . . . 1.15 109.631 -179.626 . . . . . . . . 0 0 . 1 . 033 nuclear orig core ' D' D ' 326' ' ' GLU . . . . . . . . . . . . . 41.3 mm-40 . . . . . 0 N--CA 1.489 1.511 0 CA-C-O 121.407 0.622 . . . . 2.13 109.65 . . . . . . . . . 0 0 . 1 . 033 nuclear orig core ' D' D ' 327' ' ' TYR . . . . . 0.615 ' CE1' ' HG2' ' B' ' 333' ' ' ARG . 41.0 m-85 -148.78 105.49 3.56 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.281 -0.887 . . . . 1.0 109.7 179.989 . . . . . . . . 2 2 . 1 . 033 nuclear orig core ' D' D ' 328' ' ' PHE . . . . . 0.476 ' O ' HG21 ' D' ' 329' ' ' THR . 22.1 m-85 -112.95 -165.44 0.99 Allowed 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.371 -0.83 . . . . 0.34 109.176 179.582 . . . . . . . . 2 2 . 1 . 033 nuclear orig core ' D' D ' 329' ' ' THR . . . . . 0.476 HG21 ' O ' ' D' ' 328' ' ' PHE . 78.3 p -154.02 173.87 15.42 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.194 -0.941 . . . . 1.05 109.257 179.783 . . . . . . . . 2 2 . 1 . 033 nuclear orig core ' D' D ' 330' ' ' LEU . . . . . 0.464 ' O ' ' HA ' ' B' ' 329' ' ' THR . 21.5 tp -150.58 129.81 12.78 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.265 -0.897 . . . . 1.07 109.212 179.639 . . . . . . . . 2 2 . 1 . 033 nuclear orig core ' D' D ' 331' ' ' GLN . . . . . . . . . . . . . 1.1 tt0 -86.98 112.83 22.21 Favored 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.165 -0.959 . . . . 0.93 109.331 179.756 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' D' D ' 332' ' ' ILE . . . . . 0.44 ' CG2' ' HA ' ' D' ' 338' ' ' PHE . 73.5 mt -103.94 107.56 22.58 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.505 0 O-C-N 121.108 -0.995 . . . . 1.07 109.671 -179.784 . . . . . . . . 2 2 . 1 . 033 nuclear orig core ' D' D ' 333' ' ' ARG . . . . . 0.614 ' HG2' ' CE1' ' B' ' 327' ' ' TYR . 32.2 mtt180 -74.1 148.27 41.99 Favored 'General case' 0 C--N 1.304 -1.37 0 O-C-N 121.413 -0.804 . . . . 3.42 109.672 -179.886 . . . . . . . . 2 2 . 1 . 033 nuclear orig core ' D' D ' 334' ' ' GLY . . . . . . . . . . . . . . . 82.84 134.48 2.17 Favored Glycine 0 N--CA 1.486 1.978 0 N-CA-C 109.598 -1.401 . . . . 0.41 109.598 179.988 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' D' D ' 335' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -79.88 -40.8 27.54 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.4 -1.059 . . . . 3.58 109.69 -179.795 . . . . . . . . 2 2 . 1 . 033 nuclear orig core ' D' D ' 336' ' ' GLU . . . . . . . . . . . . . 1.7 mt-10 -58.66 -59.12 5.9 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.221 -0.924 . . . . 2.26 110.044 -179.717 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' D' D ' 337' ' ' ARG . . . . . 0.443 ' NH1' ' CG ' ' D' ' 337' ' ' ARG . 0.0 OUTLIER -59.53 -31.91 69.83 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.142 -0.974 . . . . 3.64 109.756 -179.657 . . . . . . . . 3 3 . 1 . 033 nuclear orig core ' D' D ' 338' ' ' PHE . . . . . 0.44 ' HA ' ' CG2' ' D' ' 332' ' ' ILE . 46.7 t80 -55.66 -56.7 17.27 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.259 -0.901 . . . . 0.4 109.783 -179.957 . . . . . . . . 2 2 . 1 . 033 nuclear orig core ' D' D ' 339' ' ' GLU . . . . . . . . . . . . . 44.1 mt-10 -50.72 -32.75 20.45 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.059 -1.026 . . . . 1.99 109.735 -179.87 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' D' D ' 340' ' ' MET . . . . . . . . . . . . . 17.3 ttp -62.49 -52.66 62.61 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.187 -0.945 . . . . 1.13 109.99 -179.535 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' D' D ' 341' ' ' PHE . . . . . . . . . . . . . 40.2 m-85 -62.32 -51.14 68.85 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.184 -0.948 . . . . 0.21 109.773 -179.814 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' D' D ' 342' ' ' ARG . . . . . . . . . . . . . 4.1 ttt180 -45.17 -39.51 6.22 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.284 -0.885 . . . . 3.15 109.92 -179.76 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' D' D ' 343' ' ' GLU . . . . . . . . . . . . . 60.1 tt0 -60.96 -48.48 81.64 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.136 -0.977 . . . . 2.35 110.213 -179.675 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' D' D ' 344' ' ' LEU . . . . . 0.471 ' CD2' HD23 ' C' ' 344' ' ' LEU . 49.7 mt -62.13 -33.06 73.77 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.052 -1.03 . . . . 1.06 109.878 -179.459 . . . . . . . . 2 2 . 1 . 033 nuclear orig core ' D' D ' 345' ' ' ASN . . . . . 0.434 ' HB2' HD23 ' B' ' 330' ' ' LEU . 14.3 t-20 -56.96 -56.51 20.74 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.299 -0.875 . . . . 1.35 109.558 -179.582 . . . . . . . . 2 2 . 1 . 033 nuclear orig core ' D' D ' 346' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -60.85 -29.1 69.32 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.192 -0.942 . . . . 1.69 110.133 -179.716 . . . . . . . . 2 2 . 1 . 033 nuclear orig core ' D' D ' 347' ' ' ALA . . . . . . . . . . . . . . . -59.7 -58.53 8.17 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.152 -0.968 . . . . 1.03 110.254 -179.502 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' D' D ' 348' ' ' LEU . . . . . 0.449 ' CD2' ' N ' ' D' ' 348' ' ' LEU . 4.1 mm? -62.02 -42.18 98.88 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.157 -0.964 . . . . 1.04 110.069 -179.256 . . . . . . . . 2 2 . 1 . 033 nuclear orig core ' D' D ' 349' ' ' GLU . . . . . . . . . . . . . 9.1 mm-40 -58.6 -34.26 70.92 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.033 -1.042 . . . . 1.95 110.132 -179.349 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' D' D ' 350' ' ' LEU . . . . . 0.464 ' O ' HD22 ' D' ' 350' ' ' LEU . 6.4 tt -64.0 -45.15 90.24 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.248 -0.907 . . . . 1.16 109.499 -179.633 . . . . . . . . 2 2 . 1 . 033 nuclear orig core ' D' D ' 351' ' ' LYS . . . . . . . . . . . . . 48.2 tttt -59.5 -46.08 89.85 Favored 'General case' 0 N--CA 1.488 1.448 0 O-C-N 121.292 -0.88 . . . . 1.97 109.676 -179.825 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' D' D ' 352' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -55.27 -45.01 76.14 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.338 -0.851 . . . . 1.17 110.119 -179.419 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' D' D ' 353' ' ' ALA . . . . . . . . . . . . . . . -66.71 -29.41 69.39 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 120.794 -1.192 . . . . 1.21 109.576 -179.678 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' D' D ' 354' ' ' GLN . . . . . . . . . . . . . 8.0 tt0 . . . . . 0 N--CA 1.489 1.481 0 O-C-N 121.208 -0.933 . . . . 1.68 109.798 -179.769 . . . . . . . . 0 0 . 1 . 034 nuclear orig core ' A' A ' 326' ' ' GLU . . . . . . . . . . . . . 4.2 mt-10 . . . . . 0 N--CA 1.487 1.409 0 N-CA-C 109.404 -0.591 . . . . 2.13 109.404 . . . . . . . . . 0 0 . 1 . 034 nuclear orig core ' A' A ' 327' ' ' TYR . . . . . 0.53 ' CE1' ' CG ' ' C' ' 333' ' ' ARG . 39.0 m-85 -148.96 109.81 4.29 Favored 'General case' 0 N--CA 1.489 1.478 0 O-C-N 121.35 -0.844 . . . . 1.0 109.463 179.9 . . . . . . . . 2 2 . 1 . 034 nuclear orig core ' A' A ' 328' ' ' PHE . . . . . 0.407 ' CE2' ' HA ' ' C' ' 335' ' ' ARG . 88.0 m-85 -113.64 -169.41 1.5 Allowed 'General case' 0 C--N 1.302 -1.464 0 O-C-N 121.353 -0.842 . . . . 0.34 108.934 179.772 . . . . . . . . 2 2 . 1 . 034 nuclear orig core ' A' A ' 329' ' ' THR . . . . . . . . . . . . . 23.5 p -153.15 169.77 22.16 Favored 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.013 -1.055 . . . . 1.05 109.517 -179.97 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 330' ' ' LEU . . . . . 0.422 ' O ' ' HA ' ' C' ' 329' ' ' THR . 17.4 tp -150.83 127.2 10.68 Favored 'General case' 0 N--CA 1.488 1.46 0 O-C-N 121.288 -0.882 . . . . 1.07 109.529 -179.809 . . . . . . . . 2 2 . 1 . 034 nuclear orig core ' A' A ' 331' ' ' GLN . . . . . 0.449 ' OE1' ' O ' ' C' ' 328' ' ' PHE . 3.7 tp-100 -87.77 119.91 28.57 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.19 -0.944 . . . . 0.91 109.401 179.846 . . . . . . . . 2 2 . 1 . 034 nuclear orig core ' A' A ' 332' ' ' ILE . . . . . 0.431 HD11 ' HA ' ' A' ' 338' ' ' PHE . 97.9 mt -103.38 107.99 23.41 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.596 0 O-C-N 121.299 -0.875 . . . . 1.09 109.519 179.898 . . . . . . . . 2 2 . 1 . 034 nuclear orig core ' A' A ' 333' ' ' ARG . . . . . 0.494 ' HG2' ' CE2' ' C' ' 327' ' ' TYR . 1.4 mtt-85 -72.18 131.54 42.91 Favored 'General case' 0 N--CA 1.488 1.463 0 O-C-N 121.206 -0.934 . . . . 3.41 109.569 -179.988 . . . . . . . . 2 2 . 1 . 034 nuclear orig core ' A' A ' 334' ' ' GLY . . . . . . . . . . . . . . . 87.71 138.88 6.02 Favored Glycine 0 N--CA 1.49 2.298 0 N-CA-C 109.809 -1.316 . . . . 0.4 109.809 179.817 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 335' ' ' ARG . . . . . 0.416 ' O ' ' HB3' ' A' ' 338' ' ' PHE . 37.5 ttt180 -79.78 -29.04 40.27 Favored 'General case' 0 N--CA 1.489 1.488 0 O-C-N 121.316 -1.108 . . . . 3.55 109.676 -179.978 . . . . . . . . 2 2 . 1 . 034 nuclear orig core ' A' A ' 336' ' ' GLU . . . . . . . . . . . . . 38.7 mt-10 -56.45 -61.95 2.06 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.211 -0.93 . . . . 2.29 109.843 -179.732 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 337' ' ' ARG . . . . . 0.488 ' NH1' ' HG2' ' A' ' 337' ' ' ARG . 0.0 OUTLIER -60.52 -26.67 67.02 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.151 -0.968 . . . . 3.64 109.686 -179.776 . . . . . . . . 3 3 . 1 . 034 nuclear orig core ' A' A ' 338' ' ' PHE . . . . . 0.431 ' HA ' HD11 ' A' ' 332' ' ' ILE . 91.5 t80 -56.31 -53.58 55.57 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.163 -0.961 . . . . 0.41 110.01 -179.694 . . . . . . . . 2 2 . 1 . 034 nuclear orig core ' A' A ' 339' ' ' GLU . . . . . . . . . . . . . 6.8 mt-10 -54.6 -39.52 67.95 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.019 -1.05 . . . . 1.97 110.533 -179.369 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 340' ' ' MET . . . . . . . . . . . . . 30.9 ttp -64.37 -53.4 49.15 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.044 -1.035 . . . . 1.14 110.877 -178.788 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 341' ' ' PHE . . . . . 0.539 ' CZ ' ' HA ' ' C' ' 345' ' ' ASN . 56.7 m-85 -60.57 -48.71 80.58 Favored 'General case' 0 N--CA 1.494 1.761 0 O-C-N 120.91 -1.119 . . . . 0.21 110.291 -179.018 . . . . . . . . 2 2 . 1 . 034 nuclear orig core ' A' A ' 342' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -48.9 -44.4 40.09 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.075 -1.016 . . . . 3.15 110.136 -179.6 . . . . . . . . 2 2 . 1 . 034 nuclear orig core ' A' A ' 343' ' ' GLU . . . . . . . . . . . . . 2.1 tp10 -57.81 -41.99 83.33 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.102 -0.999 . . . . 2.35 109.745 -179.585 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 344' ' ' LEU . . . . . 0.463 ' O ' HD21 ' A' ' 348' ' ' LEU . 45.8 mt -63.63 -47.16 82.48 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.173 -0.955 . . . . 1.06 109.92 -179.828 . . . . . . . . 2 2 . 1 . 034 nuclear orig core ' A' A ' 345' ' ' ASN . . . . . . . . . . . . . 39.3 t-20 -54.83 -48.3 73.01 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.16 -0.962 . . . . 1.36 109.737 -179.616 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 346' ' ' GLU . . . . . . . . . . . . . 56.5 tt0 -61.83 -35.88 79.53 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.194 -0.941 . . . . 1.65 109.749 -179.882 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 347' ' ' ALA . . . . . . . . . . . . . . . -59.94 -55.83 29.26 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.249 -0.907 . . . . 1.03 110.049 -179.623 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 348' ' ' LEU . . . . . 0.463 HD21 ' O ' ' A' ' 344' ' ' LEU . 3.8 mm? -60.02 -41.72 92.79 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.199 -0.938 . . . . 1.04 109.655 -179.653 . . . . . . . . 2 2 . 1 . 034 nuclear orig core ' A' A ' 349' ' ' GLU . . . . . . . . . . . . . 88.3 mt-10 -58.6 -33.48 70.04 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.254 -0.903 . . . . 1.94 109.785 -179.694 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 350' ' ' LEU . . . . . 0.454 ' O ' HD22 ' A' ' 350' ' ' LEU . 5.3 tt -63.16 -49.13 75.54 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.201 -0.937 . . . . 1.17 109.162 179.944 . . . . . . . . 2 2 . 1 . 034 nuclear orig core ' A' A ' 351' ' ' LYS . . . . . . . . . . . . . 6.5 ttmm -58.49 -44.79 89.51 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.259 -0.901 . . . . 1.97 109.303 -179.989 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 352' ' ' ASP . . . . . . . . . . . . . 14.5 m-20 -57.04 -42.95 81.45 Favored 'General case' 0 N--CA 1.489 1.484 0 O-C-N 121.319 -0.863 . . . . 1.16 109.676 179.922 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 353' ' ' ALA . . . . . . . . . . . . . . . -67.35 -22.08 65.6 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.277 -0.889 . . . . 1.22 109.691 -179.787 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 354' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.488 1.475 0 O-C-N 121.237 -0.914 . . . . 1.71 109.274 179.944 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' B' B ' 326' ' ' GLU . . . . . . . . . . . . . 4.4 mt-10 . . . . . 0 N--CA 1.489 1.482 0 CA-C-O 121.345 0.593 . . . . 2.13 109.497 . . . . . . . . . 0 0 . 1 . 034 nuclear orig core ' B' B ' 327' ' ' TYR . . . . . . . . . . . . . 39.3 m-85 -148.92 109.73 4.28 Favored 'General case' 0 N--CA 1.489 1.49 0 O-C-N 121.353 -0.842 . . . . 0.99 109.51 179.854 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' B' B ' 328' ' ' PHE . . . . . . . . . . . . . 87.8 m-85 -113.61 -169.25 1.47 Allowed 'General case' 0 C--N 1.301 -1.522 0 O-C-N 121.305 -0.872 . . . . 0.36 108.965 179.748 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' B' B ' 329' ' ' THR . . . . . . . . . . . . . 23.8 p -153.37 169.1 23.94 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.072 -1.017 . . . . 1.05 109.728 -179.776 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' B' B ' 330' ' ' LEU . . . . . 0.431 ' O ' ' HA ' ' D' ' 329' ' ' THR . 17.2 tp -150.61 126.89 10.64 Favored 'General case' 0 N--CA 1.488 1.452 0 O-C-N 121.262 -0.899 . . . . 1.07 109.592 -179.768 . . . . . . . . 2 2 . 1 . 034 nuclear orig core ' B' B ' 331' ' ' GLN . . . . . 0.439 ' OE1' ' O ' ' D' ' 328' ' ' PHE . 3.7 tp-100 -87.2 120.07 28.1 Favored 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.253 -0.904 . . . . 0.91 109.378 179.876 . . . . . . . . 2 2 . 1 . 034 nuclear orig core ' B' B ' 332' ' ' ILE . . . . . 0.44 HD11 ' HA ' ' B' ' 338' ' ' PHE . 97.9 mt -103.56 107.92 23.31 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.564 0 O-C-N 121.136 -0.978 . . . . 1.08 109.433 179.867 . . . . . . . . 2 2 . 1 . 034 nuclear orig core ' B' B ' 333' ' ' ARG . . . . . 0.438 ' CG ' ' NH1' ' B' ' 333' ' ' ARG . 1.4 mtt-85 -72.2 131.67 43.07 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.267 -0.896 . . . . 3.42 109.439 -179.979 . . . . . . . . 2 2 . 1 . 034 nuclear orig core ' B' B ' 334' ' ' GLY . . . . . . . . . . . . . . . 88.18 138.58 6.17 Favored Glycine 0 N--CA 1.49 2.27 0 N-CA-C 109.749 -1.341 . . . . 0.4 109.749 179.704 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' B' B ' 335' ' ' ARG . . . . . 0.433 ' O ' ' HB3' ' B' ' 338' ' ' PHE . 39.1 ttt180 -79.88 -28.85 39.87 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.313 -1.11 . . . . 3.55 109.655 179.991 . . . . . . . . 2 2 . 1 . 034 nuclear orig core ' B' B ' 336' ' ' GLU . . . . . . . . . . . . . 39.3 mt-10 -56.74 -61.77 2.2 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.309 -0.869 . . . . 2.28 109.811 -179.67 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' B' B ' 337' ' ' ARG . . . . . 0.513 ' HG2' ' NH1' ' B' ' 337' ' ' ARG . 0.0 OUTLIER -60.54 -27.06 67.36 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.314 -0.866 . . . . 3.64 109.602 -179.8 . . . . . . . . 3 3 . 1 . 034 nuclear orig core ' B' B ' 338' ' ' PHE . . . . . 0.44 ' HA ' HD11 ' B' ' 332' ' ' ILE . 91.4 t80 -56.11 -53.64 54.61 Favored 'General case' 0 C--N 1.303 -1.418 0 O-C-N 121.199 -0.938 . . . . 0.39 110.045 -179.623 . . . . . . . . 2 2 . 1 . 034 nuclear orig core ' B' B ' 339' ' ' GLU . . . . . . . . . . . . . 7.0 mt-10 -54.75 -39.46 68.34 Favored 'General case' 0 N--CA 1.494 1.769 0 O-C-N 121.073 -1.017 . . . . 1.98 110.679 -179.459 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' B' B ' 340' ' ' MET . . . . . . . . . . . . . 30.5 ttp -64.12 -53.47 49.03 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 120.946 -1.096 . . . . 1.14 110.89 -178.845 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' B' B ' 341' ' ' PHE . . . . . 0.438 ' CZ ' ' HA ' ' D' ' 345' ' ' ASN . 56.2 m-85 -60.72 -48.15 83.1 Favored 'General case' 0 N--CA 1.494 1.725 0 O-C-N 120.96 -1.087 . . . . 0.22 110.412 -178.983 . . . . . . . . 2 2 . 1 . 034 nuclear orig core ' B' B ' 342' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -49.58 -43.85 46.48 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.137 -0.977 . . . . 3.15 110.124 -179.579 . . . . . . . . 2 2 . 1 . 034 nuclear orig core ' B' B ' 343' ' ' GLU . . . . . . . . . . . . . 2.1 tp10 -57.99 -42.46 85.19 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.178 -0.951 . . . . 2.35 109.607 -179.665 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' B' B ' 344' ' ' LEU . . . . . 0.461 ' O ' HD21 ' B' ' 348' ' ' LEU . 46.5 mt -63.5 -47.06 83.27 Favored 'General case' 0 N--CA 1.488 1.473 0 O-C-N 121.306 -0.871 . . . . 1.05 109.931 -179.722 . . . . . . . . 2 2 . 1 . 034 nuclear orig core ' B' B ' 345' ' ' ASN . . . . . 0.555 ' HA ' ' CZ ' ' D' ' 341' ' ' PHE . 40.2 t-20 -55.06 -47.95 74.14 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.123 -0.986 . . . . 1.35 109.679 -179.615 . . . . . . . . 2 2 . 1 . 034 nuclear orig core ' B' B ' 346' ' ' GLU . . . . . . . . . . . . . 56.3 tt0 -61.99 -35.86 79.77 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.118 -0.989 . . . . 1.66 109.661 -179.863 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' B' B ' 347' ' ' ALA . . . . . . . . . . . . . . . -59.93 -55.37 34.88 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.293 -0.879 . . . . 1.02 110.184 -179.478 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' B' B ' 348' ' ' LEU . . . . . 0.461 HD21 ' O ' ' B' ' 344' ' ' LEU . 3.8 mm? -60.72 -41.0 94.38 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.214 -0.929 . . . . 1.05 109.678 -179.595 . . . . . . . . 2 2 . 1 . 034 nuclear orig core ' B' B ' 349' ' ' GLU . . . . . . . . . . . . . 86.8 mt-10 -59.05 -33.07 70.34 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.269 -0.894 . . . . 1.95 109.75 -179.729 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' B' B ' 350' ' ' LEU . . . . . 0.466 HD22 ' O ' ' B' ' 350' ' ' LEU . 5.3 tt -63.67 -48.97 75.02 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.192 -0.942 . . . . 1.18 109.286 179.882 . . . . . . . . 2 2 . 1 . 034 nuclear orig core ' B' B ' 351' ' ' LYS . . . . . . . . . . . . . 6.2 ttmm -58.5 -44.76 89.56 Favored 'General case' 0 N--CA 1.489 1.483 0 O-C-N 121.309 -0.869 . . . . 1.96 109.254 179.894 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' B' B ' 352' ' ' ASP . . . . . . . . . . . . . 16.6 m-20 -57.18 -43.04 82.26 Favored 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.305 -0.872 . . . . 1.16 109.549 179.956 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' B' B ' 353' ' ' ALA . . . . . . . . . . . . . . . -67.32 -21.92 65.64 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.228 -0.92 . . . . 1.21 109.585 -179.776 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' B' B ' 354' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.488 1.471 0 O-C-N 121.246 -0.909 . . . . 1.69 109.52 179.913 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' C' C ' 326' ' ' GLU . . . . . . . . . . . . . 10.3 mt-10 . . . . . 0 N--CA 1.49 1.559 0 CA-C-O 121.41 0.624 . . . . 2.17 110.134 . . . . . . . . . 0 0 . 1 . 034 nuclear orig core ' C' C ' 327' ' ' TYR . . . . . 0.494 ' CE2' ' HG2' ' A' ' 333' ' ' ARG . 40.3 m-85 -148.03 116.5 6.61 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.482 -0.761 . . . . 1.03 109.248 -179.945 . . . . . . . . 2 2 . 1 . 034 nuclear orig core ' C' C ' 328' ' ' PHE . . . . . 0.46 ' O ' HG21 ' C' ' 329' ' ' THR . 72.1 m-85 -113.29 -170.15 1.63 Allowed 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.176 -0.952 . . . . 0.37 109.49 -179.889 . . . . . . . . 2 2 . 1 . 034 nuclear orig core ' C' C ' 329' ' ' THR . . . . . 0.46 HG21 ' O ' ' C' ' 328' ' ' PHE . 17.8 p -152.66 168.22 26.36 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.266 -0.896 . . . . 1.04 109.483 -179.913 . . . . . . . . 2 2 . 1 . 034 nuclear orig core ' C' C ' 330' ' ' LEU . . . . . . . . . . . . . 16.5 tp -150.99 125.42 9.49 Favored 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.25 -0.906 . . . . 1.09 109.567 -179.677 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' C' C ' 331' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -88.91 113.16 24.15 Favored 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.224 -0.923 . . . . 1.48 109.522 179.965 . . . . . . . . 2 2 . 1 . 034 nuclear orig core ' C' C ' 332' ' ' ILE . . . . . . . . . . . . . 42.0 mt -104.12 113.9 42.29 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.631 0 O-C-N 121.171 -0.955 . . . . 1.08 109.589 179.73 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' C' C ' 333' ' ' ARG . . . . . 0.53 ' CG ' ' CE1' ' A' ' 327' ' ' TYR . 0.1 OUTLIER -73.59 144.18 46.1 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.195 -0.941 . . . . 3.36 109.586 179.868 . . . . . . . . 3 3 . 1 . 034 nuclear orig core ' C' C ' 334' ' ' GLY . . . . . . . . . . . . . . . 88.11 135.74 5.07 Favored Glycine 0 N--CA 1.493 2.465 0 N-CA-C 110.033 -1.227 . . . . 0.35 110.033 179.629 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' C' C ' 335' ' ' ARG . . . . . 0.444 ' O ' ' HB3' ' C' ' 338' ' ' PHE . 13.2 ttm180 -80.44 -41.49 24.38 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.384 -1.068 . . . . 3.23 109.704 179.938 . . . . . . . . 2 2 . 1 . 034 nuclear orig core ' C' C ' 336' ' ' GLU . . . . . . . . . . . . . 4.2 mt-10 -56.46 -53.7 54.38 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.245 -0.91 . . . . 2.62 109.5 -179.778 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' C' C ' 337' ' ' ARG . . . . . 0.412 HH11 ' HG3' ' C' ' 337' ' ' ARG . 0.1 OUTLIER -60.24 -33.61 72.52 Favored 'General case' 0 N--CA 1.489 1.499 0 O-C-N 121.149 -0.969 . . . . 3.61 109.128 179.782 . . . . . . . . 3 3 . 1 . 034 nuclear orig core ' C' C ' 338' ' ' PHE . . . . . 0.444 ' HB3' ' O ' ' C' ' 335' ' ' ARG . 86.6 t80 -56.33 -55.39 34.04 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.418 -0.801 . . . . 0.43 109.768 179.839 . . . . . . . . 2 2 . 1 . 034 nuclear orig core ' C' C ' 339' ' ' GLU . . . . . . . . . . . . . 47.6 mt-10 -50.13 -35.99 28.07 Favored 'General case' 0 N--CA 1.494 1.748 0 O-C-N 121.255 -0.903 . . . . 2.05 110.131 -179.75 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' C' C ' 340' ' ' MET . . . . . . . . . . . . . 37.0 ttp -63.98 -52.41 59.75 Favored 'General case' 0 N--CA 1.493 1.717 0 O-C-N 121.199 -0.938 . . . . 1.1 110.608 -179.153 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' C' C ' 341' ' ' PHE . . . . . . . . . . . . . 50.3 m-85 -61.73 -44.38 97.02 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.216 -0.928 . . . . 0.21 110.509 -178.976 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' C' C ' 342' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -50.39 -43.25 54.46 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 120.99 -1.069 . . . . 3.42 110.285 -179.491 . . . . . . . . 2 2 . 1 . 034 nuclear orig core ' C' C ' 343' ' ' GLU . . . . . . . . . . . . . 80.1 tt0 -59.07 -45.55 90.54 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.121 -0.987 . . . . 2.14 110.057 -179.388 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' C' C ' 344' ' ' LEU . . . . . . . . . . . . . 65.2 mt -62.87 -43.97 97.38 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.155 -0.966 . . . . 1.09 110.125 -179.502 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' C' C ' 345' ' ' ASN . . . . . 0.539 ' HA ' ' CZ ' ' A' ' 341' ' ' PHE . 64.6 t-20 -57.03 -51.23 70.1 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.171 -0.956 . . . . 1.38 109.868 -179.518 . . . . . . . . 2 2 . 1 . 034 nuclear orig core ' C' C ' 346' ' ' GLU . . . . . . . . . . . . . 10.8 tt0 -60.53 -30.52 69.8 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.089 -1.007 . . . . 2.21 109.431 -179.875 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' C' C ' 347' ' ' ALA . . . . . . . . . . . . . . . -60.23 -58.07 10.1 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.282 -0.886 . . . . 1.03 109.981 -179.946 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' C' C ' 348' ' ' LEU . . . . . 0.472 ' N ' ' CD2' ' C' ' 348' ' ' LEU . 4.0 mm? -61.66 -40.86 96.44 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.21 -0.931 . . . . 1.06 109.659 -179.7 . . . . . . . . 2 2 . 1 . 034 nuclear orig core ' C' C ' 349' ' ' GLU . . . . . . . . . . . . . 53.3 mm-40 -56.99 -36.11 70.0 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.223 -0.923 . . . . 2.19 109.552 -179.878 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' C' C ' 350' ' ' LEU . . . . . 0.531 ' CD1' HD21 ' D' ' 350' ' ' LEU . 4.5 tt -63.05 -47.1 84.43 Favored 'General case' 0 N--CA 1.488 1.46 0 O-C-N 121.236 -0.915 . . . . 1.2 109.227 179.996 . . . . . . . . 2 2 . 1 . 034 nuclear orig core ' C' C ' 351' ' ' LYS . . . . . . . . . . . . . 16.8 tttm -59.66 -42.11 92.09 Favored 'General case' 0 N--CA 1.49 1.525 0 O-C-N 121.211 -0.93 . . . . 1.92 109.547 179.879 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' C' C ' 352' ' ' ASP . . . . . . . . . . . . . 86.2 m-20 -56.13 -38.34 70.68 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.272 -0.893 . . . . 1.19 109.655 -179.941 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' C' C ' 353' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 1.625 0 O-C-N 121.24 -0.912 . . . . 1.15 109.613 -179.645 . . . . . . . . 0 0 . 1 . 034 nuclear orig core ' D' D ' 326' ' ' GLU . . . . . . . . . . . . . 4.7 mt-10 . . . . . 0 N--CA 1.489 1.5 0 CA-C-O 121.339 0.59 . . . . 2.13 109.468 . . . . . . . . . 0 0 . 1 . 034 nuclear orig core ' D' D ' 327' ' ' TYR . . . . . . . . . . . . . 39.0 m-85 -148.75 109.66 4.29 Favored 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.406 -0.809 . . . . 1.0 109.612 179.919 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' D' D ' 328' ' ' PHE . . . . . 0.439 ' O ' ' OE1' ' B' ' 331' ' ' GLN . 88.1 m-85 -113.56 -169.77 1.57 Allowed 'General case' 0 N--CA 1.488 1.467 0 O-C-N 121.268 -0.895 . . . . 0.34 109.055 179.76 . . . . . . . . 2 2 . 1 . 034 nuclear orig core ' D' D ' 329' ' ' THR . . . . . 0.431 ' HA ' ' O ' ' B' ' 330' ' ' LEU . 23.8 p -153.0 169.2 23.48 Favored 'General case' 0 N--CA 1.489 1.486 0 O-C-N 121.122 -0.986 . . . . 1.05 109.555 -179.845 . . . . . . . . 2 2 . 1 . 034 nuclear orig core ' D' D ' 330' ' ' LEU . . . . . . . . . . . . . 17.4 tp -150.72 127.09 10.68 Favored 'General case' 0 N--CA 1.488 1.457 0 O-C-N 121.297 -0.877 . . . . 1.07 109.427 -179.737 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' D' D ' 331' ' ' GLN . . . . . . . . . . . . . 3.6 tp-100 -87.42 120.12 28.39 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.266 -0.897 . . . . 0.93 109.377 179.862 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' D' D ' 332' ' ' ILE . . . . . 0.438 HD11 ' HA ' ' D' ' 338' ' ' PHE . 97.9 mt -103.36 108.59 24.79 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.566 0 O-C-N 121.184 -0.947 . . . . 1.07 109.354 179.814 . . . . . . . . 2 2 . 1 . 034 nuclear orig core ' D' D ' 333' ' ' ARG . . . . . 0.429 ' CG ' ' NH1' ' D' ' 333' ' ' ARG . 1.5 mtt-85 -72.76 131.81 42.81 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.229 -0.919 . . . . 3.42 109.488 -179.953 . . . . . . . . 2 2 . 1 . 034 nuclear orig core ' D' D ' 334' ' ' GLY . . . . . . . . . . . . . . . 88.05 138.9 6.23 Favored Glycine 0 N--CA 1.491 2.314 0 N-CA-C 109.648 -1.381 . . . . 0.41 109.648 179.741 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' D' D ' 335' ' ' ARG . . . . . 0.433 ' O ' ' HB3' ' D' ' 338' ' ' PHE . 40.7 ttt180 -80.12 -29.08 38.89 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.284 -1.127 . . . . 3.58 109.594 -179.906 . . . . . . . . 2 2 . 1 . 034 nuclear orig core ' D' D ' 336' ' ' GLU . . . . . . . . . . . . . 41.1 mt-10 -56.41 -62.29 1.82 Allowed 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.306 -0.871 . . . . 2.26 109.78 -179.715 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' D' D ' 337' ' ' ARG . . . . . 0.482 ' NH1' ' HG2' ' D' ' 337' ' ' ARG . 0.0 OUTLIER -59.92 -27.23 66.59 Favored 'General case' 0 N--CA 1.489 1.501 0 O-C-N 121.238 -0.914 . . . . 3.64 109.68 -179.813 . . . . . . . . 3 3 . 1 . 034 nuclear orig core ' D' D ' 338' ' ' PHE . . . . . 0.438 ' HA ' HD11 ' D' ' 332' ' ' ILE . 91.5 t80 -55.81 -54.26 46.68 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.175 -0.953 . . . . 0.4 109.923 -179.749 . . . . . . . . 2 2 . 1 . 034 nuclear orig core ' D' D ' 339' ' ' GLU . . . . . . . . . . . . . 6.9 mt-10 -54.04 -39.6 66.35 Favored 'General case' 0 N--CA 1.494 1.759 0 O-C-N 121.095 -1.003 . . . . 1.99 110.68 -179.345 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' D' D ' 340' ' ' MET . . . . . . . . . . . . . 30.0 ttp -64.43 -53.16 52.8 Favored 'General case' 0 N--CA 1.495 1.785 0 O-C-N 121.061 -1.025 . . . . 1.13 110.862 -178.703 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' D' D ' 341' ' ' PHE . . . . . 0.555 ' CZ ' ' HA ' ' B' ' 345' ' ' ASN . 56.8 m-85 -60.83 -48.43 81.82 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 120.958 -1.089 . . . . 0.21 110.364 -179.084 . . . . . . . . 2 2 . 1 . 034 nuclear orig core ' D' D ' 342' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -49.28 -44.06 43.64 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.155 -0.965 . . . . 3.15 110.054 -179.58 . . . . . . . . 2 2 . 1 . 034 nuclear orig core ' D' D ' 343' ' ' GLU . . . . . . . . . . . . . 2.1 tp10 -57.88 -42.5 84.72 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.101 -0.999 . . . . 2.35 109.652 -179.657 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' D' D ' 344' ' ' LEU . . . . . 0.466 ' O ' HD21 ' D' ' 348' ' ' LEU . 46.4 mt -63.31 -46.97 84.23 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.199 -0.938 . . . . 1.06 109.984 -179.878 . . . . . . . . 2 2 . 1 . 034 nuclear orig core ' D' D ' 345' ' ' ASN . . . . . 0.438 ' HA ' ' CZ ' ' B' ' 341' ' ' PHE . 40.5 t-20 -55.14 -48.31 73.87 Favored 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.174 -0.954 . . . . 1.35 109.672 -179.48 . . . . . . . . 2 2 . 1 . 034 nuclear orig core ' D' D ' 346' ' ' GLU . . . . . . . . . . . . . 56.2 tt0 -61.69 -36.0 79.63 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.088 -1.007 . . . . 1.69 109.681 179.997 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' D' D ' 347' ' ' ALA . . . . . . . . . . . . . . . -59.84 -55.79 29.85 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.185 -0.947 . . . . 1.03 110.044 -179.499 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' D' D ' 348' ' ' LEU . . . . . 0.466 HD21 ' O ' ' D' ' 344' ' ' LEU . 3.8 mm? -60.1 -41.24 92.11 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.304 -0.873 . . . . 1.04 109.69 -179.645 . . . . . . . . 2 2 . 1 . 034 nuclear orig core ' D' D ' 349' ' ' GLU . . . . . . . . . . . . . 84.6 mt-10 -59.07 -32.99 70.28 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.178 -0.952 . . . . 1.95 109.877 -179.652 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' D' D ' 350' ' ' LEU . . . . . 0.531 HD21 ' CD1' ' C' ' 350' ' ' LEU . 5.2 tt -63.69 -48.86 75.42 Favored 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.148 -0.97 . . . . 1.16 109.184 179.875 . . . . . . . . 2 2 . 1 . 034 nuclear orig core ' D' D ' 351' ' ' LYS . . . . . . . . . . . . . 6.0 ttmm -58.67 -44.67 90.25 Favored 'General case' 0 N--CA 1.488 1.431 0 O-C-N 121.347 -0.846 . . . . 1.97 109.378 179.881 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' D' D ' 352' ' ' ASP . . . . . . . . . . . . . 20.0 m-20 -57.26 -42.81 82.26 Favored 'General case' 0 N--CA 1.488 1.438 0 O-C-N 121.293 -0.88 . . . . 1.17 109.566 179.859 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' D' D ' 353' ' ' ALA . . . . . . . . . . . . . . . -67.58 -21.49 65.43 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.28 -0.888 . . . . 1.21 109.768 -179.739 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' D' D ' 354' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.49 1.553 0 O-C-N 121.229 -0.919 . . . . 1.68 109.31 179.961 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 326' ' ' GLU . . . . . . . . . . . . . 2.1 mt-10 . . . . . 0 N--CA 1.489 1.5 0 N-CA-C 109.424 -0.584 . . . . 2.13 109.424 . . . . . . . . . 0 0 . 1 . 035 nuclear orig core ' A' A ' 327' ' ' TYR . . . . . . . . . . . . . 48.1 m-85 -148.87 109.06 4.11 Favored 'General case' 0 C--N 1.303 -1.415 0 O-C-N 121.259 -0.901 . . . . 1.0 109.413 179.989 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 328' ' ' PHE . . . . . 0.499 ' CZ ' ' HG3' ' C' ' 335' ' ' ARG . 88.4 m-85 -113.83 -169.01 1.43 Allowed 'General case' 0 N--CA 1.489 1.492 0 O-C-N 121.353 -0.842 . . . . 0.34 109.04 179.873 . . . . . . . . 2 2 . 1 . 035 nuclear orig core ' A' A ' 329' ' ' THR . . . . . . . . . . . . . 32.4 p -152.57 168.16 26.5 Favored 'General case' 0 C--N 1.302 -1.49 0 O-C-N 121.142 -0.973 . . . . 1.05 109.311 -179.925 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 330' ' ' LEU . . . . . . . . . . . . . 41.9 tp -149.72 127.69 11.89 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.196 -0.94 . . . . 1.07 109.694 -179.688 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 331' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -88.3 114.65 25.13 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.23 -0.919 . . . . 0.91 109.206 179.661 . . . . . . . . 2 2 . 1 . 035 nuclear orig core ' A' A ' 332' ' ' ILE . . . . . 0.432 HG23 ' HA ' ' A' ' 338' ' ' PHE . 23.0 mt -103.32 112.74 37.9 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.57 0 O-C-N 121.194 -0.941 . . . . 1.09 109.524 179.957 . . . . . . . . 2 2 . 1 . 035 nuclear orig core ' A' A ' 333' ' ' ARG . . . . . 0.432 ' HG2' ' CE1' ' C' ' 327' ' ' TYR . 2.4 mtt180 -72.5 145.24 47.65 Favored 'General case' 0 N--CA 1.488 1.459 0 O-C-N 121.332 -0.855 . . . . 3.41 109.31 179.918 . . . . . . . . 2 2 . 1 . 035 nuclear orig core ' A' A ' 334' ' ' GLY . . . . . . . . . . . . . . . 83.11 127.72 1.23 Allowed Glycine 0 N--CA 1.492 2.387 0 N-CA-C 109.567 -1.413 . . . . 0.4 109.567 179.936 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 335' ' ' ARG . . . . . 0.43 ' NH1' ' CG ' ' A' ' 335' ' ' ARG . 0.4 OUTLIER -75.01 -35.12 61.99 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.233 -1.157 . . . . 3.55 109.345 -179.965 . . . . . . . . 3 3 . 1 . 035 nuclear orig core ' A' A ' 336' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -58.06 -59.29 5.5 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.319 -0.863 . . . . 2.29 109.451 179.98 . . . . . . . . 2 2 . 1 . 035 nuclear orig core ' A' A ' 337' ' ' ARG . . . . . 0.5 ' NH2' HD11 ' C' ' 348' ' ' LEU . 6.0 mmt180 -60.72 -31.61 70.9 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.33 -0.856 . . . . 3.64 109.466 179.981 . . . . . . . . 2 2 . 1 . 035 nuclear orig core ' A' A ' 338' ' ' PHE . . . . . 0.432 ' HA ' HG23 ' A' ' 332' ' ' ILE . 52.5 t80 -55.43 -55.78 27.72 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.195 -0.94 . . . . 0.41 109.411 179.968 . . . . . . . . 2 2 . 1 . 035 nuclear orig core ' A' A ' 339' ' ' GLU . . . . . . . . . . . . . 4.9 mt-10 -52.07 -32.96 37.0 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.318 -0.864 . . . . 1.97 109.952 -179.812 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 340' ' ' MET . . . . . . . . . . . . . 21.8 ttp -63.52 -52.69 60.1 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.242 -0.911 . . . . 1.14 110.041 -179.519 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 341' ' ' PHE . . . . . . . . . . . . . 56.7 m-85 -62.22 -43.11 99.56 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.112 -0.993 . . . . 0.21 110.012 -179.384 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 342' ' ' ARG . . . . . 0.444 ' NH1' ' CG ' ' A' ' 342' ' ' ARG . 0.0 OUTLIER -50.8 -46.45 59.7 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.299 -0.876 . . . . 3.15 110.023 -179.655 . . . . . . . . 3 3 . 1 . 035 nuclear orig core ' A' A ' 343' ' ' GLU . . . . . . . . . . . . . 4.9 tt0 -59.29 -43.55 92.57 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.167 -0.958 . . . . 2.35 109.928 -179.562 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 344' ' ' LEU . . . . . . . . . . . . . 53.2 mt -62.19 -36.61 82.44 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.202 -0.936 . . . . 1.06 109.715 -179.793 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 345' ' ' ASN . . . . . 0.447 ' HA ' ' CZ ' ' C' ' 341' ' ' PHE . 56.7 t-20 -58.47 -55.59 33.1 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.284 -0.885 . . . . 1.36 109.612 -179.787 . . . . . . . . 2 2 . 1 . 035 nuclear orig core ' A' A ' 346' ' ' GLU . . . . . . . . . . . . . 3.5 tt0 -60.41 -29.42 68.97 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.281 -0.887 . . . . 1.65 109.575 -179.803 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 347' ' ' ALA . . . . . . . . . . . . . . . -60.77 -59.08 5.95 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.243 -0.911 . . . . 1.03 109.954 179.96 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 348' ' ' LEU . . . . . 0.433 ' N ' HD23 ' A' ' 348' ' ' LEU . 4.0 mm? -61.47 -45.44 94.26 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.265 -0.897 . . . . 1.04 110.026 -179.565 . . . . . . . . 2 2 . 1 . 035 nuclear orig core ' A' A ' 349' ' ' GLU . . . . . . . . . . . . . 3.8 mm-40 -55.78 -34.21 65.08 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.166 -0.959 . . . . 1.94 109.439 -179.623 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 350' ' ' LEU . . . . . 0.475 HD23 HD23 ' B' ' 350' ' ' LEU . 6.0 tt -63.36 -45.69 90.0 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.223 -0.923 . . . . 1.17 109.086 179.667 . . . . . . . . 2 2 . 1 . 035 nuclear orig core ' A' A ' 351' ' ' LYS . . . . . . . . . . . . . 30.4 tttt -59.72 -45.88 90.81 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.382 -0.824 . . . . 1.97 109.692 -179.943 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 352' ' ' ASP . . . . . . . . . . . . . 7.8 m-20 -54.81 -49.85 69.97 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.248 -0.908 . . . . 1.16 109.889 -179.717 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 353' ' ' ALA . . . . . . . . . . . . . . . -67.12 -23.85 65.86 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.192 -0.943 . . . . 1.22 109.681 -179.715 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 354' ' ' GLN . . . . . 0.409 ' NE2' ' CD1' ' B' ' 350' ' ' LEU . 1.2 tt0 . . . . . 0 N--CA 1.492 1.628 0 O-C-N 121.278 -0.889 . . . . 1.71 109.797 -179.932 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' B' B ' 326' ' ' GLU . . . . . . . . . . . . . 2.1 mt-10 . . . . . 0 N--CA 1.489 1.512 0 N-CA-C 109.366 -0.605 . . . . 2.13 109.366 . . . . . . . . . 0 0 . 1 . 035 nuclear orig core ' B' B ' 327' ' ' TYR . . . . . . . . . . . . . 47.9 m-85 -148.62 108.97 4.13 Favored 'General case' 0 N--CA 1.489 1.481 0 O-C-N 121.199 -0.938 . . . . 0.99 109.427 -179.974 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' B' B ' 328' ' ' PHE . . . . . 0.5 ' CZ ' ' HG3' ' D' ' 335' ' ' ARG . 88.5 m-85 -113.62 -169.07 1.43 Allowed 'General case' 0 N--CA 1.487 1.419 0 O-C-N 121.254 -0.904 . . . . 0.36 109.044 179.897 . . . . . . . . 2 2 . 1 . 035 nuclear orig core ' B' B ' 329' ' ' THR . . . . . . . . . . . . . 30.3 p -152.45 168.11 26.56 Favored 'General case' 0 N--CA 1.489 1.494 0 O-C-N 121.217 -0.927 . . . . 1.05 109.325 -179.965 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' B' B ' 330' ' ' LEU . . . . . . . . . . . . . 39.9 tp -149.78 127.7 11.84 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.24 -0.913 . . . . 1.07 109.656 -179.742 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' B' B ' 331' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -88.43 114.58 25.2 Favored 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.35 -0.844 . . . . 0.91 109.299 179.708 . . . . . . . . 2 2 . 1 . 035 nuclear orig core ' B' B ' 332' ' ' ILE . . . . . 0.442 HG23 ' HA ' ' B' ' 338' ' ' PHE . 22.2 mt -103.18 112.57 37.13 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.542 0 O-C-N 121.107 -0.995 . . . . 1.08 109.563 -179.923 . . . . . . . . 2 2 . 1 . 035 nuclear orig core ' B' B ' 333' ' ' ARG . . . . . 0.464 ' HG2' ' CE1' ' D' ' 327' ' ' TYR . 2.3 mtt180 -72.19 145.15 48.22 Favored 'General case' 0 N--CA 1.489 1.49 0 O-C-N 121.306 -0.871 . . . . 3.42 109.312 179.86 . . . . . . . . 2 2 . 1 . 035 nuclear orig core ' B' B ' 334' ' ' GLY . . . . . . . . . . . . . . . 83.08 127.87 1.24 Allowed Glycine 0 N--CA 1.49 2.269 0 N-CA-C 109.646 -1.382 . . . . 0.4 109.646 -179.999 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' B' B ' 335' ' ' ARG . . . . . 0.434 HH11 ' CG ' ' B' ' 335' ' ' ARG . 0.3 OUTLIER -75.16 -35.38 61.63 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.338 -1.095 . . . . 3.55 109.34 179.935 . . . . . . . . 3 3 . 1 . 035 nuclear orig core ' B' B ' 336' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -57.93 -59.15 5.69 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.296 -0.877 . . . . 2.28 109.403 179.941 . . . . . . . . 2 2 . 1 . 035 nuclear orig core ' B' B ' 337' ' ' ARG . . . . . . . . . . . . . 6.2 mmt180 -60.86 -31.86 71.3 Favored 'General case' 0 N--CA 1.489 1.495 0 O-C-N 121.337 -0.852 . . . . 3.64 109.434 -179.944 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' B' B ' 338' ' ' PHE . . . . . 0.442 ' HA ' HG23 ' B' ' 332' ' ' ILE . 52.7 t80 -55.14 -55.88 26.17 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.297 -0.877 . . . . 0.39 109.495 179.909 . . . . . . . . 2 2 . 1 . 035 nuclear orig core ' B' B ' 339' ' ' GLU . . . . . . . . . . . . . 4.9 mt-10 -51.77 -33.18 34.04 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.316 -0.865 . . . . 1.98 110.019 -179.865 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' B' B ' 340' ' ' MET . . . . . . . . . . . . . 20.9 ttp -63.45 -52.63 60.63 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.198 -0.939 . . . . 1.14 110.113 -179.428 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' B' B ' 341' ' ' PHE . . . . . 0.451 ' CZ ' ' HA ' ' D' ' 345' ' ' ASN . 56.2 m-85 -62.42 -42.99 99.86 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.171 -0.956 . . . . 0.22 109.988 -179.466 . . . . . . . . 2 2 . 1 . 035 nuclear orig core ' B' B ' 342' ' ' ARG . . . . . 0.448 ' NH1' ' CG ' ' B' ' 342' ' ' ARG . 0.0 OUTLIER -50.97 -46.51 61.24 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.315 -0.866 . . . . 3.15 110.049 -179.647 . . . . . . . . 3 3 . 1 . 035 nuclear orig core ' B' B ' 343' ' ' GLU . . . . . . . . . . . . . 5.1 tt0 -59.23 -43.39 92.35 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.121 -0.987 . . . . 2.35 109.953 -179.696 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' B' B ' 344' ' ' LEU . . . . . . . . . . . . . 55.7 mt -62.31 -36.56 82.51 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.184 -0.948 . . . . 1.05 109.75 -179.774 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' B' B ' 345' ' ' ASN . . . . . 0.56 ' HA ' ' CZ ' ' D' ' 341' ' ' PHE . 56.9 t-20 -58.61 -55.02 40.4 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.239 -0.913 . . . . 1.35 109.689 -179.838 . . . . . . . . 2 2 . 1 . 035 nuclear orig core ' B' B ' 346' ' ' GLU . . . . . . . . . . . . . 3.4 tt0 -60.77 -29.49 69.45 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.354 -0.841 . . . . 1.66 109.574 -179.815 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' B' B ' 347' ' ' ALA . . . . . . . . . . . . . . . -60.88 -58.91 6.43 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.292 -0.88 . . . . 1.02 109.924 -179.896 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' B' B ' 348' ' ' LEU . . . . . 0.511 HD11 ' NH2' ' D' ' 337' ' ' ARG . 4.0 mm? -61.45 -45.93 92.22 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.196 -0.94 . . . . 1.05 109.887 -179.622 . . . . . . . . 2 2 . 1 . 035 nuclear orig core ' B' B ' 349' ' ' GLU . . . . . . . . . . . . . 3.9 mm-40 -55.38 -34.23 64.14 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.17 -0.957 . . . . 1.95 109.534 -179.705 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' B' B ' 350' ' ' LEU . . . . . 0.475 HD23 HD23 ' A' ' 350' ' ' LEU . 6.1 tt -63.32 -45.77 89.78 Favored 'General case' 0 N--CA 1.488 1.457 0 O-C-N 121.205 -0.934 . . . . 1.18 109.173 179.69 . . . . . . . . 2 2 . 1 . 035 nuclear orig core ' B' B ' 351' ' ' LYS . . . . . . . . . . . . . 30.5 tttt -59.79 -45.87 90.98 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.442 -0.786 . . . . 1.96 109.713 -179.967 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' B' B ' 352' ' ' ASP . . . . . . . . . . . . . 7.8 m-20 -54.88 -49.58 70.84 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.22 -0.925 . . . . 1.16 109.84 -179.735 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' B' B ' 353' ' ' ALA . . . . . . . . . . . . . . . -67.32 -24.03 65.7 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.19 -0.943 . . . . 1.21 109.601 -179.749 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' B' B ' 354' ' ' GLN . . . . . . . . . . . . . 1.2 tt0 . . . . . 0 N--CA 1.491 1.592 0 O-C-N 121.233 -0.917 . . . . 1.69 109.779 -179.883 . . . . . . . . 0 0 . 1 . 035 nuclear orig core ' C' C ' 326' ' ' GLU . . . . . 0.464 ' HB3' ' CE1' ' C' ' 328' ' ' PHE . 60.7 mm-40 . . . . . 0 N--CA 1.488 1.451 0 N-CA-C 109.204 -0.665 . . . . 2.17 109.204 . . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' C' C ' 327' ' ' TYR . . . . . 0.432 ' CE1' ' HG2' ' A' ' 333' ' ' ARG . 37.0 m-85 -149.22 109.59 4.18 Favored 'General case' 0 C--N 1.302 -1.462 0 O-C-N 121.354 -0.841 . . . . 1.03 109.41 179.94 . . . . . . . . 2 2 . 1 . 035 nuclear orig core ' C' C ' 328' ' ' PHE . . . . . 0.464 ' CE1' ' HB3' ' C' ' 326' ' ' GLU . 65.2 m-85 -113.58 -167.72 1.24 Allowed 'General case' 0 N--CA 1.489 1.477 0 O-C-N 121.431 -0.793 . . . . 0.37 109.393 179.969 . . . . . . . . 2 2 . 1 . 035 nuclear orig core ' C' C ' 329' ' ' THR . . . . . . . . . . . . . 14.6 p -151.86 168.66 24.43 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.242 -0.911 . . . . 1.04 109.342 -179.865 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' C' C ' 330' ' ' LEU . . . . . . . . . . . . . 30.6 tp -149.48 127.02 11.58 Favored 'General case' 0 C--N 1.303 -1.453 0 O-C-N 121.201 -0.937 . . . . 1.09 109.505 -179.741 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' C' C ' 331' ' ' GLN . . . . . 0.536 ' CG ' ' NH2' ' C' ' 333' ' ' ARG . 6.9 tp-100 -87.23 114.22 23.65 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.312 -0.868 . . . . 1.48 109.46 179.941 . . . . . . . . 2 2 . 1 . 035 nuclear orig core ' C' C ' 332' ' ' ILE . . . . . 0.501 HD12 ' CB ' ' C' ' 341' ' ' PHE . 84.7 mt -103.7 110.99 31.7 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.548 0 O-C-N 121.297 -0.877 . . . . 1.08 109.687 179.925 . . . . . . . . 2 2 . 1 . 035 nuclear orig core ' C' C ' 333' ' ' ARG . . . . . 0.536 ' NH2' ' CG ' ' C' ' 331' ' ' GLN . 0.0 OUTLIER -72.92 147.3 45.42 Favored 'General case' 0 N--CA 1.488 1.439 0 O-C-N 121.156 -0.965 . . . . 3.36 109.277 179.711 . . . . . . . . 3 3 . 1 . 035 nuclear orig core ' C' C ' 334' ' ' GLY . . . . . . . . . . . . . . . 76.65 131.73 0.45 Allowed Glycine 0 N--CA 1.492 2.388 0 N-CA-C 109.632 -1.387 . . . . 0.35 109.632 179.815 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' C' C ' 335' ' ' ARG . . . . . 0.499 ' HG3' ' CZ ' ' A' ' 328' ' ' PHE . 1.1 tmt_? -76.84 -30.51 56.35 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.327 -1.102 . . . . 3.23 109.61 -179.994 . . . . . . . . 2 2 . 1 . 035 nuclear orig core ' C' C ' 336' ' ' GLU . . . . . . . . . . . . . 21.2 mt-10 -57.62 -60.08 4.21 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.345 -0.847 . . . . 2.62 109.729 -179.725 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' C' C ' 337' ' ' ARG . . . . . 0.511 ' HD2' ' N ' ' C' ' 337' ' ' ARG . 11.4 mmm180 -59.85 -31.52 69.83 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.305 -0.872 . . . . 3.61 109.609 -179.592 . . . . . . . . 2 2 . 1 . 035 nuclear orig core ' C' C ' 338' ' ' PHE . . . . . . . . . . . . . 61.3 t80 -56.12 -56.74 17.21 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.365 -0.834 . . . . 0.43 109.858 -179.724 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' C' C ' 339' ' ' GLU . . . . . . . . . . . . . 3.8 mt-10 -49.45 -38.38 29.45 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.254 -0.904 . . . . 2.05 110.302 -179.462 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' C' C ' 340' ' ' MET . . . . . . . . . . . . . 35.1 ttp -64.61 -47.15 79.68 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.11 -0.994 . . . . 1.1 110.279 -179.396 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' C' C ' 341' ' ' PHE . . . . . 0.501 ' CB ' HD12 ' C' ' 332' ' ' ILE . 38.0 m-85 -62.47 -52.87 61.82 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.173 -0.954 . . . . 0.21 110.139 -179.352 . . . . . . . . 2 2 . 1 . 035 nuclear orig core ' C' C ' 342' ' ' ARG . . . . . . . . . . . . . 7.4 tmm_? -46.51 -40.08 11.95 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.267 -0.896 . . . . 3.42 109.718 -179.751 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' C' C ' 343' ' ' GLU . . . . . . . . . . . . . 6.4 tp10 -59.06 -50.2 74.98 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.236 -0.915 . . . . 2.14 109.721 -179.956 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' C' C ' 344' ' ' LEU . . . . . . . . . . . . . 41.0 mt -61.91 -28.36 69.47 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.263 -0.898 . . . . 1.09 109.419 179.992 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' C' C ' 345' ' ' ASN . . . . . 0.5 ' ND2' ' OE2' ' C' ' 349' ' ' GLU . 13.9 t-20 -57.8 -59.64 4.91 Favored 'General case' 0 N--CA 1.489 1.484 0 O-C-N 121.243 -0.911 . . . . 1.38 109.45 179.929 . . . . . . . . 2 2 . 1 . 035 nuclear orig core ' C' C ' 346' ' ' GLU . . . . . . . . . . . . . 1.3 tt0 -61.74 -24.23 66.67 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.431 -0.793 . . . . 2.21 109.655 -179.954 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' C' C ' 347' ' ' ALA . . . . . . . . . . . . . . . -61.71 -62.8 1.55 Allowed 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.204 -0.935 . . . . 1.03 110.025 -179.76 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' C' C ' 348' ' ' LEU . . . . . 0.5 HD11 ' NH2' ' A' ' 337' ' ' ARG . 3.6 mm? -61.9 -45.0 95.64 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.19 -0.944 . . . . 1.06 110.018 -179.405 . . . . . . . . 2 2 . 1 . 035 nuclear orig core ' C' C ' 349' ' ' GLU . . . . . 0.5 ' OE2' ' ND2' ' C' ' 345' ' ' ASN . 3.6 mt-10 -56.37 -34.16 66.4 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.153 -0.967 . . . . 2.19 109.525 -179.629 . . . . . . . . 2 2 . 1 . 035 nuclear orig core ' C' C ' 350' ' ' LEU . . . . . 0.481 HD21 ' CD1' ' D' ' 350' ' ' LEU . 7.4 tt -65.0 -41.29 95.51 Favored 'General case' 0 N--CA 1.489 1.483 0 O-C-N 121.217 -0.927 . . . . 1.2 109.188 179.674 . . . . . . . . 2 2 . 1 . 035 nuclear orig core ' C' C ' 351' ' ' LYS . . . . . . . . . . . . . 13.7 tttt -60.3 -48.9 79.78 Favored 'General case' 0 N--CA 1.489 1.501 0 O-C-N 121.353 -0.842 . . . . 1.92 109.621 -179.919 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' C' C ' 352' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -57.23 -44.24 83.58 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.244 -0.91 . . . . 1.19 109.774 -179.902 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' C' C ' 353' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 1.606 0 O-C-N 121.296 -0.877 . . . . 1.15 109.764 -179.825 . . . . . . . . 0 0 . 1 . 035 nuclear orig core ' D' D ' 326' ' ' GLU . . . . . . . . . . . . . 2.1 mt-10 . . . . . 0 N--CA 1.489 1.515 0 N-CA-C 109.355 -0.609 . . . . 2.13 109.355 . . . . . . . . . 0 0 . 1 . 035 nuclear orig core ' D' D ' 327' ' ' TYR . . . . . 0.464 ' CE1' ' HG2' ' B' ' 333' ' ' ARG . 47.0 m-85 -148.91 108.65 4.02 Favored 'General case' 0 N--CA 1.488 1.444 0 O-C-N 121.318 -0.864 . . . . 1.0 109.453 -179.934 . . . . . . . . 2 2 . 1 . 035 nuclear orig core ' D' D ' 328' ' ' PHE . . . . . 0.425 ' CZ ' ' HG3' ' B' ' 335' ' ' ARG . 88.7 m-85 -113.47 -169.02 1.42 Allowed 'General case' 0 N--CA 1.489 1.481 0 O-C-N 121.356 -0.84 . . . . 0.34 109.103 179.936 . . . . . . . . 2 2 . 1 . 035 nuclear orig core ' D' D ' 329' ' ' THR . . . . . . . . . . . . . 31.1 p -152.44 168.18 26.32 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.208 -0.932 . . . . 1.05 109.336 -179.968 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' D' D ' 330' ' ' LEU . . . . . . . . . . . . . 38.5 tp -149.96 127.2 11.34 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.197 -0.94 . . . . 1.07 109.642 -179.667 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' D' D ' 331' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -87.83 114.56 24.55 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.312 -0.868 . . . . 0.93 109.299 179.604 . . . . . . . . 2 2 . 1 . 035 nuclear orig core ' D' D ' 332' ' ' ILE . . . . . 0.429 HG23 ' HA ' ' D' ' 338' ' ' PHE . 21.9 mt -103.29 112.88 38.41 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.55 0 O-C-N 121.121 -0.987 . . . . 1.07 109.493 179.925 . . . . . . . . 2 2 . 1 . 035 nuclear orig core ' D' D ' 333' ' ' ARG . . . . . . . . . . . . . 2.3 mtt180 -72.43 145.23 47.77 Favored 'General case' 0 N--CA 1.488 1.445 0 O-C-N 121.141 -0.974 . . . . 3.42 109.365 179.938 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' D' D ' 334' ' ' GLY . . . . . . . . . . . . . . . 83.08 127.57 1.2 Allowed Glycine 0 N--CA 1.49 2.271 0 N-CA-C 109.608 -1.397 . . . . 0.41 109.608 179.861 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' D' D ' 335' ' ' ARG . . . . . 0.5 ' HG3' ' CZ ' ' B' ' 328' ' ' PHE . 0.4 OUTLIER -74.75 -35.23 62.62 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.225 -1.162 . . . . 3.58 109.466 179.953 . . . . . . . . 3 3 . 1 . 035 nuclear orig core ' D' D ' 336' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -58.02 -59.29 5.5 Favored 'General case' 0 N--CA 1.489 1.484 0 O-C-N 121.253 -0.904 . . . . 2.26 109.522 179.956 . . . . . . . . 2 2 . 1 . 035 nuclear orig core ' D' D ' 337' ' ' ARG . . . . . 0.511 ' NH2' HD11 ' B' ' 348' ' ' LEU . 6.2 mmt180 -60.73 -31.77 71.06 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.317 -0.865 . . . . 3.64 109.426 -179.97 . . . . . . . . 2 2 . 1 . 035 nuclear orig core ' D' D ' 338' ' ' PHE . . . . . 0.429 ' HA ' HG23 ' D' ' 332' ' ' ILE . 52.9 t80 -55.19 -55.9 26.05 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.234 -0.916 . . . . 0.4 109.517 179.927 . . . . . . . . 2 2 . 1 . 035 nuclear orig core ' D' D ' 339' ' ' GLU . . . . . . . . . . . . . 5.0 mt-10 -51.94 -33.06 35.78 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.261 -0.899 . . . . 1.99 109.893 -179.755 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' D' D ' 340' ' ' MET . . . . . . . . . . . . . 21.1 ttp -63.53 -52.51 60.86 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.262 -0.898 . . . . 1.13 110.12 -179.422 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' D' D ' 341' ' ' PHE . . . . . 0.56 ' CZ ' ' HA ' ' B' ' 345' ' ' ASN . 57.0 m-85 -62.38 -43.17 99.45 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.137 -0.977 . . . . 0.21 110.016 -179.515 . . . . . . . . 2 2 . 1 . 035 nuclear orig core ' D' D ' 342' ' ' ARG . . . . . 0.447 ' NH1' ' CG ' ' D' ' 342' ' ' ARG . 0.0 OUTLIER -50.77 -46.47 59.49 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.229 -0.92 . . . . 3.15 110.017 -179.657 . . . . . . . . 3 3 . 1 . 035 nuclear orig core ' D' D ' 343' ' ' GLU . . . . . . . . . . . . . 4.7 tt0 -59.12 -43.71 91.96 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.181 -0.949 . . . . 2.35 109.887 -179.636 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' D' D ' 344' ' ' LEU . . . . . . . . . . . . . 54.4 mt -62.18 -36.54 82.19 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.175 -0.953 . . . . 1.06 109.783 -179.79 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' D' D ' 345' ' ' ASN . . . . . 0.451 ' HA ' ' CZ ' ' B' ' 341' ' ' PHE . 56.5 t-20 -58.61 -55.43 35.17 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.243 -0.911 . . . . 1.35 109.664 -179.824 . . . . . . . . 2 2 . 1 . 035 nuclear orig core ' D' D ' 346' ' ' GLU . . . . . . . . . . . . . 3.3 tt0 -60.52 -29.44 69.11 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.193 -0.942 . . . . 1.69 109.534 -179.777 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' D' D ' 347' ' ' ALA . . . . . . . . . . . . . . . -60.91 -58.84 6.74 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.154 -0.966 . . . . 1.03 109.885 -179.943 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' D' D ' 348' ' ' LEU . . . . . 0.434 ' N ' HD23 ' D' ' 348' ' ' LEU . 4.0 mm? -61.53 -45.82 92.55 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.212 -0.93 . . . . 1.04 109.9 -179.557 . . . . . . . . 2 2 . 1 . 035 nuclear orig core ' D' D ' 349' ' ' GLU . . . . . . . . . . . . . 3.9 mm-40 -55.51 -34.17 64.41 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.273 -0.892 . . . . 1.95 109.607 -179.622 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' D' D ' 350' ' ' LEU . . . . . 0.481 ' CD1' HD21 ' C' ' 350' ' ' LEU . 6.1 tt -63.44 -45.79 89.31 Favored 'General case' 0 N--CA 1.489 1.484 0 O-C-N 121.273 -0.892 . . . . 1.16 109.069 179.701 . . . . . . . . 2 2 . 1 . 035 nuclear orig core ' D' D ' 351' ' ' LYS . . . . . . . . . . . . . 30.2 tttt -59.77 -45.74 91.34 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.402 -0.811 . . . . 1.97 109.664 -179.942 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' D' D ' 352' ' ' ASP . . . . . . . . . . . . . 7.6 m-20 -54.91 -49.85 70.25 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.293 -0.879 . . . . 1.17 109.845 -179.766 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' D' D ' 353' ' ' ALA . . . . . . . . . . . . . . . -67.22 -23.88 65.77 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.198 -0.939 . . . . 1.21 109.651 -179.731 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' D' D ' 354' ' ' GLN . . . . . 0.469 ' NE2' HD12 ' C' ' 350' ' ' LEU . 1.2 tt0 . . . . . 0 N--CA 1.49 1.572 0 O-C-N 121.249 -0.907 . . . . 1.68 109.728 -179.889 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 319' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.49 1.533 0 CA-C-O 121.334 0.587 . . . . 7.95 109.504 . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 320' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER 54.96 -94.51 0.04 OUTLIER 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.183 -0.948 . . . . 6.71 109.556 -179.942 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 321' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -158.35 132.26 5.0 Favored Pre-proline 0 N--CA 1.49 1.546 0 O-C-N 121.129 -0.982 . . . . 6.5 109.419 179.91 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 322' ' ' PRO . . . . . . . . . . . . . 1.1 Cg_endo -64.13 -81.78 0.01 OUTLIER 'Trans proline' 0 C--N 1.312 -1.382 0 C-N-CA 122.045 1.83 . . . . 3.3 110.348 -179.868 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 323' ' ' LEU . . . . . . . . . . . . . 73.1 mt -81.99 114.92 20.9 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.155 -0.965 . . . . 3.16 109.622 -179.893 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 324' ' ' ASP . . . . . 0.484 ' N ' ' OD1' ' A' ' 324' ' ' ASP . 1.8 m-20 -79.67 142.75 35.25 Favored 'General case' 0 N--CA 1.488 1.455 0 O-C-N 121.299 -0.876 . . . . 1.53 108.955 179.631 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 325' ' ' GLY . . . . . . . . . . . . . . . -67.39 179.21 16.09 Favored Glycine 0 N--CA 1.488 2.129 0 N-CA-C 109.259 -1.537 . . . . 0.67 109.259 -179.884 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 326' ' ' GLU . . . . . . . . . . . . . 4.2 mm-40 -56.89 -179.75 0.04 OUTLIER 'General case' 0 N--CA 1.487 1.424 0 O-C-N 121.177 -1.19 . . . . 2.13 109.235 -179.878 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 327' ' ' TYR . . . . . . . . . . . . . 42.2 m-85 -147.31 96.28 2.68 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.248 -0.908 . . . . 1.0 109.437 -179.974 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 328' ' ' PHE . . . . . 0.572 ' CE2' ' HG3' ' C' ' 335' ' ' ARG . 56.8 m-85 -103.46 -160.34 0.77 Allowed 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.319 -0.863 . . . . 0.34 109.588 -179.759 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 329' ' ' THR . . . . . 0.447 ' HA ' ' O ' ' C' ' 330' ' ' LEU . 34.8 p -154.11 169.22 24.07 Favored 'General case' 0 N--CA 1.489 1.49 0 O-C-N 121.455 -0.778 . . . . 1.05 108.922 179.894 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 330' ' ' LEU . . . . . 0.469 ' O ' ' HA ' ' C' ' 329' ' ' THR . 24.4 tp -151.42 132.97 14.76 Favored 'General case' 0 N--CA 1.488 1.474 0 O-C-N 121.071 -1.018 . . . . 1.07 109.768 -179.717 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 331' ' ' GLN . . . . . . . . . . . . . 7.1 tp-100 -85.66 115.94 23.64 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.343 -0.848 . . . . 0.91 108.946 179.695 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 332' ' ' ILE . . . . . . . . . . . . . 75.0 mt -103.17 104.25 16.34 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.555 0 O-C-N 121.261 -0.899 . . . . 1.09 109.819 -179.714 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 333' ' ' ARG . . . . . 0.554 ' CG ' ' CE1' ' C' ' 327' ' ' TYR . 1.9 mpt_? -72.74 138.86 46.78 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.376 -0.828 . . . . 3.41 109.35 179.744 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 334' ' ' GLY . . . . . . . . . . . . . . . 91.25 130.21 4.69 Favored Glycine 0 N--CA 1.491 2.367 0 N-CA-C 109.573 -1.411 . . . . 0.4 109.573 179.868 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 335' ' ' ARG . . . . . 0.411 ' O ' ' HB3' ' A' ' 338' ' ' PHE . 57.5 ttt180 -79.36 -37.8 36.55 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.34 -1.094 . . . . 3.55 109.653 179.919 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 336' ' ' GLU . . . . . . . . . . . . . 5.0 mt-10 -58.0 -60.87 3.07 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.187 -0.946 . . . . 2.29 109.671 -179.863 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 337' ' ' ARG . . . . . . . . . . . . . 4.0 mtt180 -59.98 -28.58 67.8 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.232 -0.918 . . . . 3.64 109.603 -179.831 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 338' ' ' PHE . . . . . 0.411 ' HB3' ' O ' ' A' ' 335' ' ' ARG . 59.1 t80 -54.51 -60.24 3.62 Favored 'General case' 0 N--CA 1.489 1.494 0 O-C-N 121.175 -0.953 . . . . 0.41 109.477 -179.996 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 339' ' ' GLU . . . . . . . . . . . . . 5.8 mt-10 -51.36 -31.29 21.65 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.291 -0.881 . . . . 1.97 109.771 -179.917 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 340' ' ' MET . . . . . . . . . . . . . 27.7 ttp -64.19 -52.61 58.11 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.128 -0.982 . . . . 1.14 109.881 -179.703 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 341' ' ' PHE . . . . . . . . . . . . . 39.2 m-85 -61.79 -47.84 83.31 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.205 -0.935 . . . . 0.21 109.766 -179.623 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 342' ' ' ARG . . . . . . . . . . . . . 9.7 ttt180 -49.67 -40.21 39.16 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.21 -0.931 . . . . 3.15 109.779 -179.811 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 343' ' ' GLU . . . . . . . . . . . . . 4.3 tt0 -59.29 -49.7 76.84 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.196 -0.94 . . . . 2.35 109.8 -179.762 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 344' ' ' LEU . . . . . 0.427 HD21 ' CD2' ' B' ' 344' ' ' LEU . 45.4 mt -61.84 -31.47 71.73 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.148 -0.97 . . . . 1.06 109.569 -179.805 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 345' ' ' ASN . . . . . . . . . . . . . 15.9 t-20 -57.87 -57.87 10.87 Favored 'General case' 0 N--CA 1.489 1.477 0 O-C-N 121.229 -0.919 . . . . 1.36 109.53 -179.965 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 346' ' ' GLU . . . . . . . . . . . . . 37.3 tt0 -60.98 -29.06 69.46 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.296 -0.878 . . . . 1.65 109.628 -179.848 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 347' ' ' ALA . . . . . . . . . . . . . . . -59.45 -58.43 8.65 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.195 -0.941 . . . . 1.03 109.843 -179.83 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 348' ' ' LEU . . . . . 0.504 ' N ' HD23 ' A' ' 348' ' ' LEU . 4.2 mm? -61.52 -38.73 88.45 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.282 -0.887 . . . . 1.04 109.71 -179.671 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 349' ' ' GLU . . . . . . . . . . . . . 9.2 mt-10 -57.83 -38.31 75.41 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.337 -0.852 . . . . 1.94 110.063 -179.57 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 350' ' ' LEU . . . . . 0.527 ' CD1' HD21 ' B' ' 350' ' ' LEU . 6.1 tt -62.75 -48.74 77.88 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.165 -0.96 . . . . 1.17 109.73 -179.755 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 351' ' ' LYS . . . . . . . . . . . . . 5.8 tttt -59.33 -36.92 76.55 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.221 -0.924 . . . . 1.97 109.471 -179.808 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 352' ' ' ASP . . . . . 0.403 ' OD1' ' CZ ' ' C' ' 337' ' ' ARG . 55.3 m-20 -56.36 -42.3 77.57 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.254 -0.904 . . . . 1.16 109.709 -179.974 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 353' ' ' ALA . . . . . . . . . . . . . . . -67.62 -23.02 65.32 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.271 -0.893 . . . . 1.22 109.93 -179.573 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 354' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -83.48 -10.61 58.24 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.185 -0.947 . . . . 1.71 109.746 -179.736 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 355' ' ' ALA . . . . . . . . . . . . . . . -72.35 -2.41 19.1 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.173 -0.955 . . . . 1.3 109.813 179.945 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 356' ' ' GLY . . . . . . . . . . . . . . . -72.93 -60.83 3.73 Favored Glycine 0 N--CA 1.492 2.372 0 N-CA-C 109.878 -1.289 . . . . 1.3 109.878 -179.803 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 357' ' ' LYS . . . . . . . . . . . . . 25.3 mttt -84.87 143.05 29.29 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.212 -1.17 . . . . 4.46 109.696 -179.68 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 358' ' ' GLU . . . . . . . . . . . . . 5.3 mt-10 -50.04 159.77 0.75 Allowed Pre-proline 0 N--CA 1.49 1.54 0 O-C-N 121.249 -0.907 . . . . 5.75 109.503 179.926 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 359' ' ' PRO . . . . . . . . . . . . . 2.5 Cg_endo -62.46 134.87 50.28 Favored 'Trans proline' 0 C--N 1.309 -1.543 0 C-N-CA 122.277 1.984 . . . . 5.63 110.182 179.918 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 360' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.309 0 CA-C-O 117.988 -1.451 . . . . 6.97 109.544 179.953 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' B' B ' 319' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.489 1.495 0 N-CA-C 109.48 -0.563 . . . . 7.95 109.48 . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 320' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER 55.04 -94.45 0.04 OUTLIER 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.293 -0.879 . . . . 6.73 109.464 -179.983 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 321' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -158.43 132.24 4.96 Favored Pre-proline 0 N--CA 1.49 1.552 0 O-C-N 121.05 -1.031 . . . . 6.5 109.438 179.989 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 322' ' ' PRO . . . . . . . . . . . . . 1.1 Cg_endo -64.19 -81.83 0.01 OUTLIER 'Trans proline' 0 C--N 1.311 -1.414 0 C-N-CA 122.048 1.832 . . . . 3.29 110.272 -179.845 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 323' ' ' LEU . . . . . . . . . . . . . 73.0 mt -81.94 115.07 20.94 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.267 -0.895 . . . . 3.18 109.669 -179.872 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 324' ' ' ASP . . . . . 0.481 ' N ' ' OD1' ' B' ' 324' ' ' ASP . 1.8 m-20 -80.17 141.3 35.81 Favored 'General case' 0 N--CA 1.489 1.497 0 O-C-N 121.23 -0.919 . . . . 1.53 109.163 179.764 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 325' ' ' GLY . . . . . . . . . . . . . . . -65.26 179.17 9.27 Favored Glycine 0 N--CA 1.489 2.197 0 N-CA-C 109.374 -1.49 . . . . 0.65 109.374 179.968 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 326' ' ' GLU . . . . . . . . . . . . . 4.1 mm-40 -57.27 -179.34 0.04 OUTLIER 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.23 -1.159 . . . . 2.13 109.208 179.971 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 327' ' ' TYR . . . . . 0.588 ' CE2' ' CG ' ' D' ' 333' ' ' ARG . 42.3 m-85 -147.55 96.1 2.63 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.322 -0.861 . . . . 0.99 109.426 179.986 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 328' ' ' PHE . . . . . . . . . . . . . 58.1 m-85 -103.27 -160.2 0.76 Allowed 'General case' 0 N--CA 1.489 1.482 0 O-C-N 121.323 -0.861 . . . . 0.36 109.57 -179.841 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 329' ' ' THR . . . . . . . . . . . . . 35.4 p -154.18 169.2 24.17 Favored 'General case' 0 N--CA 1.489 1.482 0 O-C-N 121.354 -0.841 . . . . 1.05 108.987 179.825 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 330' ' ' LEU . . . . . . . . . . . . . 25.0 tp -151.34 133.04 14.89 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.084 -1.01 . . . . 1.07 109.735 -179.765 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 331' ' ' GLN . . . . . . . . . . . . . 7.1 tp-100 -85.65 116.1 23.73 Favored 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.283 -0.885 . . . . 0.91 108.999 179.546 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 332' ' ' ILE . . . . . . . . . . . . . 75.3 mt -103.44 104.3 16.46 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.523 0 O-C-N 121.258 -0.901 . . . . 1.08 109.761 -179.669 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 333' ' ' ARG . . . . . 0.527 ' CG ' ' CE2' ' D' ' 327' ' ' TYR . 1.9 mpt_? -72.87 139.05 46.66 Favored 'General case' 0 N--CA 1.489 1.493 0 O-C-N 121.271 -0.893 . . . . 3.42 109.352 179.737 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 334' ' ' GLY . . . . . . . . . . . . . . . 91.24 129.89 4.58 Favored Glycine 0 N--CA 1.489 2.206 0 N-CA-C 109.679 -1.369 . . . . 0.4 109.679 179.906 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 335' ' ' ARG . . . . . 0.406 ' O ' ' HB3' ' B' ' 338' ' ' PHE . 57.5 ttt180 -79.15 -37.88 37.37 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.34 -1.094 . . . . 3.55 109.581 -179.955 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 336' ' ' GLU . . . . . . . . . . . . . 5.0 mt-10 -57.95 -60.81 3.14 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.348 -0.845 . . . . 2.28 109.719 -179.823 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 337' ' ' ARG . . . . . 0.511 ' CZ ' ' OD1' ' D' ' 352' ' ' ASP . 4.0 mtt180 -60.02 -28.53 67.81 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.188 -0.945 . . . . 3.64 109.641 -179.806 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 338' ' ' PHE . . . . . 0.406 ' HB3' ' O ' ' B' ' 335' ' ' ARG . 59.4 t80 -54.42 -60.41 3.38 Favored 'General case' 0 N--CA 1.488 1.458 0 O-C-N 121.184 -0.948 . . . . 0.39 109.397 179.969 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 339' ' ' GLU . . . . . . . . . . . . . 5.7 mt-10 -51.31 -31.23 20.88 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.248 -0.907 . . . . 1.98 109.781 -179.88 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 340' ' ' MET . . . . . . . . . . . . . 27.5 ttp -64.19 -52.64 57.92 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.221 -0.924 . . . . 1.14 109.982 -179.711 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 341' ' ' PHE . . . . . . . . . . . . . 39.1 m-85 -61.72 -47.87 83.3 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.103 -0.998 . . . . 0.22 109.78 -179.694 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 342' ' ' ARG . . . . . . . . . . . . . 9.8 ttt180 -49.62 -40.16 38.28 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.294 -0.879 . . . . 3.15 109.828 -179.846 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 343' ' ' GLU . . . . . . . . . . . . . 4.2 tt0 -59.36 -49.64 77.04 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.227 -0.92 . . . . 2.35 109.742 -179.745 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 344' ' ' LEU . . . . . 0.427 ' CD2' HD21 ' A' ' 344' ' ' LEU . 45.4 mt -61.88 -31.56 71.85 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.234 -0.916 . . . . 1.05 109.597 -179.788 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 345' ' ' ASN . . . . . . . . . . . . . 16.7 t-20 -57.64 -58.0 10.26 Favored 'General case' 0 N--CA 1.489 1.483 0 O-C-N 121.235 -0.916 . . . . 1.35 109.571 179.956 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 346' ' ' GLU . . . . . . . . . . . . . 36.8 tt0 -60.84 -29.35 69.45 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.354 -0.841 . . . . 1.66 109.658 -179.901 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 347' ' ' ALA . . . . . . . . . . . . . . . -59.29 -58.41 8.76 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.24 -0.912 . . . . 1.02 109.891 -179.774 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 348' ' ' LEU . . . . . 0.511 ' N ' HD23 ' B' ' 348' ' ' LEU . 4.1 mm? -61.5 -38.68 88.22 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.19 -0.944 . . . . 1.05 109.737 -179.737 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 349' ' ' GLU . . . . . . . . . . . . . 9.3 mt-10 -57.86 -38.42 75.67 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.247 -0.908 . . . . 1.95 110.074 -179.539 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 350' ' ' LEU . . . . . 0.527 HD21 ' CD1' ' A' ' 350' ' ' LEU . 6.1 tt -62.69 -48.82 77.64 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.197 -0.94 . . . . 1.18 109.659 -179.705 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 351' ' ' LYS . . . . . . . . . . . . . 5.8 tttt -59.26 -36.92 76.38 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.115 -0.99 . . . . 1.96 109.525 -179.847 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 352' ' ' ASP . . . . . . . . . . . . . 55.4 m-20 -56.33 -42.34 77.53 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.26 -0.9 . . . . 1.16 109.668 -179.96 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 353' ' ' ALA . . . . . . . . . . . . . . . -67.6 -23.22 65.36 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.217 -0.927 . . . . 1.21 109.868 -179.504 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 354' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -83.24 -10.67 58.43 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.194 -0.941 . . . . 1.69 109.812 -179.86 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 355' ' ' ALA . . . . . . . . . . . . . . . -72.25 -2.23 18.16 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.156 -0.965 . . . . 1.3 109.771 179.924 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 356' ' ' GLY . . . . . . . . . . . . . . . -73.22 -60.88 3.63 Favored Glycine 0 N--CA 1.491 2.331 0 N-CA-C 109.797 -1.321 . . . . 1.29 109.797 -179.725 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 357' ' ' LYS . . . . . . . . . . . . . 25.5 mttt -84.82 143.2 29.24 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.199 -1.177 . . . . 4.45 109.73 -179.757 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 358' ' ' GLU . . . . . . . . . . . . . 5.2 mt-10 -50.18 159.69 0.78 Allowed Pre-proline 0 N--CA 1.49 1.538 0 O-C-N 121.324 -0.86 . . . . 5.72 109.417 179.997 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 359' ' ' PRO . . . . . . . . . . . . . 2.5 Cg_endo -62.42 135.0 51.11 Favored 'Trans proline' 0 C--N 1.31 -1.48 0 C-N-CA 122.132 1.888 . . . . 5.6 110.185 -179.997 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 360' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.318 0 CA-C-O 117.984 -1.453 . . . . 6.98 109.597 179.929 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' C' C ' 319' ' ' LYS . . . . . 0.465 ' O ' ' HB2' ' C' ' 320' ' ' LYS . 0.0 OUTLIER . . . . . 0 N--CA 1.489 1.514 0 N-CA-C 109.528 -0.545 . . . . 7.03 109.528 . . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' C' C ' 320' ' ' LYS . . . . . 0.465 ' HB2' ' O ' ' C' ' 319' ' ' LYS . 16.8 mtpp 61.08 100.65 0.03 OUTLIER 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.291 -0.881 . . . . 6.84 109.802 179.799 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' C' C ' 321' ' ' LYS . . . . . . . . . . . . . 8.9 mttm -82.96 153.24 66.84 Favored Pre-proline 0 N--CA 1.491 1.583 0 O-C-N 121.244 -0.91 . . . . 6.78 109.297 179.684 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 322' ' ' PRO . . . . . . . . . . . . . 2.0 Cg_endo -62.36 172.12 4.65 Favored 'Trans proline' 0 C--N 1.311 -1.439 0 C-N-CA 122.298 1.999 . . . . 3.98 110.702 -179.746 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 323' ' ' LEU . . . . . . . . . . . . . 28.7 mt -80.44 110.09 15.56 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.353 -0.842 . . . . 4.31 109.167 179.705 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 324' ' ' ASP . . . . . . . . . . . . . 23.0 m-20 -80.78 -151.97 0.08 Allowed 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.216 -0.928 . . . . 1.63 109.813 -179.667 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 325' ' ' GLY . . . . . . . . . . . . . . . -69.24 -168.23 5.69 Favored Glycine 0 N--CA 1.492 2.421 0 N-CA-C 109.781 -1.328 . . . . 0.82 109.781 -179.677 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 326' ' ' GLU . . . . . . . . . . . . . 3.2 mm-40 -57.48 -171.81 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.319 -1.106 . . . . 2.17 109.47 -179.975 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 327' ' ' TYR . . . . . 0.554 ' CE1' ' CG ' ' A' ' 333' ' ' ARG . 49.3 m-85 -149.05 101.71 3.18 Favored 'General case' 0 N--CA 1.488 1.46 0 O-C-N 121.333 -0.854 . . . . 1.03 109.505 179.891 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' C' C ' 328' ' ' PHE . . . . . . . . . . . . . 63.9 m-85 -103.15 -165.85 1.21 Allowed 'General case' 0 N--CA 1.488 1.472 0 O-C-N 121.381 -0.824 . . . . 0.37 109.129 179.985 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 329' ' ' THR . . . . . 0.469 ' HA ' ' O ' ' A' ' 330' ' ' LEU . 43.1 p -150.71 167.04 28.57 Favored 'General case' 0 N--CA 1.488 1.468 0 O-C-N 121.204 -0.935 . . . . 1.04 109.353 -179.952 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' C' C ' 330' ' ' LEU . . . . . 0.447 ' O ' ' HA ' ' A' ' 329' ' ' THR . 17.7 tp -150.67 125.94 10.03 Favored 'General case' 0 C--N 1.303 -1.451 0 O-C-N 121.184 -0.948 . . . . 1.09 109.939 -179.585 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' C' C ' 331' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -87.0 110.29 19.96 Favored 'General case' 0 N--CA 1.488 1.433 0 N-CA-C 108.554 -0.906 . . . . 1.48 108.554 179.236 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' C' C ' 332' ' ' ILE . . . . . 0.436 HD12 ' CD2' ' C' ' 341' ' ' PHE . 51.5 mt -100.87 111.44 30.56 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.521 0 O-C-N 121.232 -0.917 . . . . 1.08 109.622 -179.382 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' C' C ' 333' ' ' ARG . . . . . 0.493 ' NH1' ' HG2' ' C' ' 333' ' ' ARG . 0.0 OUTLIER -72.71 153.07 41.34 Favored 'General case' 0 C--N 1.304 -1.374 0 O-C-N 121.395 -0.815 . . . . 3.36 109.421 179.848 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' C' C ' 334' ' ' GLY . . . . . . . . . . . . . . . 73.97 118.67 0.08 OUTLIER Glycine 0 N--CA 1.491 2.323 0 N-CA-C 109.464 -1.455 . . . . 0.35 109.464 -179.933 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 335' ' ' ARG . . . . . 0.572 ' HG3' ' CE2' ' A' ' 328' ' ' PHE . 4.6 ttt-85 -69.76 -30.39 67.96 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.251 -1.147 . . . . 3.23 109.611 -179.826 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' C' C ' 336' ' ' GLU . . . . . . . . . . . . . 4.2 tt0 -57.89 -62.92 1.46 Allowed 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.134 -0.979 . . . . 2.62 109.552 -179.828 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 337' ' ' ARG . . . . . 0.403 ' CZ ' ' OD1' ' A' ' 352' ' ' ASP . 2.3 mpt_? -60.5 -27.1 67.32 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.217 -0.927 . . . . 3.61 109.588 -179.918 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' C' C ' 338' ' ' PHE . . . . . 0.452 ' HB3' ' O ' ' C' ' 335' ' ' ARG . 61.2 t80 -54.58 -59.33 4.84 Favored 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.259 -0.901 . . . . 0.43 109.536 -179.903 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' C' C ' 339' ' ' GLU . . . . . . . . . . . . . 1.5 mt-10 -52.56 -34.13 48.91 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.326 -0.859 . . . . 2.05 109.884 -179.917 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 340' ' ' MET . . . . . . . . . . . . . 38.5 ttp -62.85 -49.98 72.76 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.194 -0.942 . . . . 1.1 109.901 -179.558 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 341' ' ' PHE . . . . . 0.436 ' CD2' HD12 ' C' ' 332' ' ' ILE . 41.6 m-85 -62.59 -41.81 99.19 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.191 -0.943 . . . . 0.21 109.724 -179.826 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' C' C ' 342' ' ' ARG . . . . . 0.444 ' CG ' ' NH1' ' C' ' 342' ' ' ARG . 0.0 OUTLIER -50.94 -43.68 60.23 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.323 -0.861 . . . . 3.42 109.922 -179.83 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' C' C ' 343' ' ' GLU . . . . . . . . . . . . . 3.3 tp10 -58.53 -45.72 88.27 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.166 -0.959 . . . . 2.14 109.725 -179.599 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 344' ' ' LEU . . . . . 0.434 ' O ' HD21 ' C' ' 348' ' ' LEU . 81.0 mt -61.76 -37.63 85.01 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.18 -0.95 . . . . 1.09 109.499 -179.809 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' C' C ' 345' ' ' ASN . . . . . 0.425 ' O ' ' HG3' ' C' ' 349' ' ' GLU . 16.9 t-20 -58.74 -54.18 50.01 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.232 -0.917 . . . . 1.38 109.567 179.929 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' C' C ' 346' ' ' GLU . . . . . . . . . . . . . 1.3 tm-20 -60.3 -32.12 70.91 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.283 -0.886 . . . . 2.21 109.792 -179.661 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 347' ' ' ALA . . . . . . . . . . . . . . . -59.44 -60.55 3.68 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.142 -0.974 . . . . 1.03 109.828 -179.856 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 348' ' ' LEU . . . . . 0.483 ' N ' ' CD2' ' C' ' 348' ' ' LEU . 4.0 mm? -61.05 -31.57 71.22 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.2 -0.938 . . . . 1.06 109.453 -179.836 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' C' C ' 349' ' ' GLU . . . . . 0.425 ' HG3' ' O ' ' C' ' 345' ' ' ASN . 7.6 mt-10 -59.46 -48.4 81.8 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.247 -0.908 . . . . 2.19 110.013 -179.644 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' C' C ' 350' ' ' LEU . . . . . 0.534 HD21 ' CD1' ' D' ' 350' ' ' LEU . 6.6 tt -62.83 -38.56 91.25 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.069 -1.019 . . . . 1.2 109.73 -179.623 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' C' C ' 351' ' ' LYS . . . . . . . . . . . . . 20.8 ttmt -58.08 -46.7 85.04 Favored 'General case' 0 N--CA 1.487 1.42 0 O-C-N 121.138 -0.976 . . . . 1.92 109.204 179.921 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 352' ' ' ASP . . . . . . . . . . . . . 3.4 m-20 -56.71 -41.21 77.01 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.261 -0.899 . . . . 1.19 109.576 179.863 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 353' ' ' ALA . . . . . . . . . . . . . . . -67.43 -25.26 65.83 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.29 -0.881 . . . . 1.15 109.805 -179.647 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 354' ' ' GLN . . . . . . . . . . . . . 10.2 tt0 -81.52 -8.83 59.77 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.166 -0.959 . . . . 1.7 109.357 179.94 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 355' ' ' ALA . . . . . . . . . . . . . . . -70.77 -39.7 73.07 Favored 'General case' 0 N--CA 1.488 1.465 0 O-C-N 121.223 -0.923 . . . . 1.3 109.014 179.673 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 356' ' ' GLY . . . . . . . . . . . . . . . -80.23 1.82 79.14 Favored Glycine 0 N--CA 1.49 2.245 0 N-CA-C 109.663 -1.375 . . . . 1.33 109.663 179.82 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 357' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -84.74 170.36 13.32 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.146 -1.208 . . . . 4.39 109.501 -179.907 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' C' C ' 358' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -49.49 160.19 0.6 Allowed Pre-proline 0 N--CA 1.49 1.567 0 O-C-N 121.263 -0.898 . . . . 5.75 109.453 -179.903 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' C' C ' 359' ' ' PRO . . . . . . . . . . . . . 1.0 OUTLIER -65.8 -6.38 13.95 Favored 'Trans proline' 0 C--N 1.31 -1.457 0 C-N-CA 122.194 1.929 . . . . 5.54 110.406 179.904 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' C' C ' 360' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.302 0 N-CA-C 109.465 -1.454 . . . . 6.5 109.465 179.907 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' D' D ' 319' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.49 1.556 0 N-CA-C 109.5 -0.555 . . . . 7.93 109.5 . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' D' D ' 320' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER 55.07 -94.46 0.04 OUTLIER 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.281 -0.887 . . . . 6.7 109.488 -179.904 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' D' D ' 321' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -158.46 132.22 4.94 Favored Pre-proline 0 N--CA 1.491 1.579 0 O-C-N 121.161 -0.962 . . . . 6.49 109.392 179.939 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' D' D ' 322' ' ' PRO . . . . . . . . . . . . . 1.1 Cg_endo -64.15 -81.72 0.01 OUTLIER 'Trans proline' 0 C--N 1.312 -1.354 0 C-N-CA 121.984 1.789 . . . . 3.29 110.33 -179.87 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' D' D ' 323' ' ' LEU . . . . . . . . . . . . . 72.9 mt -82.01 115.01 20.97 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.202 -0.936 . . . . 3.16 109.625 -179.878 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' D' D ' 324' ' ' ASP . . . . . 0.47 ' OD1' ' N ' ' D' ' 324' ' ' ASP . 1.8 m-20 -79.81 142.33 35.42 Favored 'General case' 0 N--CA 1.488 1.452 0 O-C-N 121.262 -0.899 . . . . 1.54 109.049 179.659 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' D' D ' 325' ' ' GLY . . . . . . . . . . . . . . . -66.74 179.16 13.44 Favored Glycine 0 N--CA 1.489 2.22 0 N-CA-C 109.241 -1.544 . . . . 0.65 109.241 -179.948 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' D' D ' 326' ' ' GLU . . . . . . . . . . . . . 4.2 mm-40 -56.98 -179.6 0.04 OUTLIER 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.155 -1.203 . . . . 2.13 109.214 -179.961 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' D' D ' 327' ' ' TYR . . . . . 0.527 ' CE2' ' CG ' ' B' ' 333' ' ' ARG . 42.1 m-85 -147.38 96.04 2.64 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.299 -0.875 . . . . 1.0 109.396 -179.967 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' D' D ' 328' ' ' PHE . . . . . . . . . . . . . 58.1 m-85 -103.27 -160.35 0.77 Allowed 'General case' 0 N--CA 1.489 1.48 0 O-C-N 121.395 -0.816 . . . . 0.34 109.639 -179.842 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' D' D ' 329' ' ' THR . . . . . . . . . . . . . 35.7 p -154.1 169.24 24.02 Favored 'General case' 0 N--CA 1.489 1.477 0 O-C-N 121.355 -0.841 . . . . 1.05 108.95 179.869 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' D' D ' 330' ' ' LEU . . . . . . . . . . . . . 24.9 tp -151.4 133.09 14.87 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.206 -0.934 . . . . 1.07 109.796 -179.692 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' D' D ' 331' ' ' GLN . . . . . . . . . . . . . 7.1 tp-100 -85.82 115.96 23.78 Favored 'General case' 0 N--CA 1.489 1.494 0 O-C-N 121.325 -0.859 . . . . 0.93 109.037 179.646 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' D' D ' 332' ' ' ILE . . . . . . . . . . . . . 75.3 mt -103.35 104.42 16.62 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.558 0 O-C-N 121.166 -0.959 . . . . 1.07 109.8 -179.603 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' D' D ' 333' ' ' ARG . . . . . 0.588 ' CG ' ' CE2' ' B' ' 327' ' ' TYR . 2.0 mpt_? -72.73 138.82 46.78 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.294 -0.879 . . . . 3.42 109.36 179.738 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' D' D ' 334' ' ' GLY . . . . . . . . . . . . . . . 91.31 129.9 4.61 Favored Glycine 0 N--CA 1.491 2.313 0 N-CA-C 109.645 -1.382 . . . . 0.41 109.645 179.838 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' D' D ' 335' ' ' ARG . . . . . 0.4 ' O ' ' HB3' ' D' ' 338' ' ' PHE . 57.6 ttt180 -79.12 -37.9 37.48 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.36 -1.082 . . . . 3.58 109.57 -179.957 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' D' D ' 336' ' ' GLU . . . . . . . . . . . . . 5.1 mt-10 -57.9 -60.94 2.95 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.292 -0.88 . . . . 2.26 109.774 -179.86 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' D' D ' 337' ' ' ARG . . . . . . . . . . . . . 4.0 mtt180 -59.96 -28.43 67.64 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.15 -0.968 . . . . 3.64 109.693 -179.908 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' D' D ' 338' ' ' PHE . . . . . 0.4 ' HB3' ' O ' ' D' ' 335' ' ' ARG . 59.5 t80 -54.56 -60.19 3.69 Favored 'General case' 0 N--CA 1.488 1.464 0 O-C-N 121.244 -0.91 . . . . 0.4 109.486 179.991 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' D' D ' 339' ' ' GLU . . . . . . . . . . . . . 5.7 mt-10 -51.35 -31.27 21.46 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.191 -0.943 . . . . 1.99 109.76 -179.951 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' D' D ' 340' ' ' MET . . . . . . . . . . . . . 27.4 ttp -64.18 -52.69 57.72 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.286 -0.884 . . . . 1.13 109.964 -179.715 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' D' D ' 341' ' ' PHE . . . . . . . . . . . . . 38.9 m-85 -61.83 -47.72 83.8 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.138 -0.976 . . . . 0.21 109.794 -179.638 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' D' D ' 342' ' ' ARG . . . . . . . . . . . . . 9.8 ttt180 -49.7 -40.12 39.23 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.21 -0.931 . . . . 3.15 109.85 -179.864 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' D' D ' 343' ' ' GLU . . . . . . . . . . . . . 4.2 tt0 -59.32 -49.81 76.41 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.147 -0.971 . . . . 2.35 109.742 -179.76 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' D' D ' 344' ' ' LEU . . . . . 0.421 ' O ' HD21 ' D' ' 348' ' ' LEU . 45.2 mt -61.85 -31.34 71.59 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.276 -0.89 . . . . 1.06 109.616 -179.787 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' D' D ' 345' ' ' ASN . . . . . . . . . . . . . 16.3 t-20 -57.88 -57.81 11.14 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.279 -0.888 . . . . 1.35 109.526 -179.978 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' D' D ' 346' ' ' GLU . . . . . . . . . . . . . 36.6 tt0 -61.03 -29.2 69.58 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.43 -0.794 . . . . 1.69 109.682 -179.878 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' D' D ' 347' ' ' ALA . . . . . . . . . . . . . . . -59.36 -58.35 9.0 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.239 -0.913 . . . . 1.03 109.827 -179.827 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' D' D ' 348' ' ' LEU . . . . . 0.506 ' N ' HD23 ' D' ' 348' ' ' LEU . 4.1 mm? -61.65 -38.55 88.13 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.271 -0.893 . . . . 1.04 109.772 -179.656 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' D' D ' 349' ' ' GLU . . . . . . . . . . . . . 9.3 mt-10 -58.02 -38.33 76.0 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.228 -0.92 . . . . 1.95 110.013 -179.588 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' D' D ' 350' ' ' LEU . . . . . 0.534 ' CD1' HD21 ' C' ' 350' ' ' LEU . 6.1 tt -62.7 -48.83 77.57 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.11 -0.994 . . . . 1.16 109.697 -179.757 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' D' D ' 351' ' ' LYS . . . . . . . . . . . . . 5.9 tttt -59.21 -36.86 76.14 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.14 -0.975 . . . . 1.97 109.6 -179.895 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' D' D ' 352' ' ' ASP . . . . . 0.511 ' OD1' ' CZ ' ' B' ' 337' ' ' ARG . 55.5 m-20 -56.47 -42.33 78.05 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.332 -0.855 . . . . 1.17 109.664 -179.972 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' D' D ' 353' ' ' ALA . . . . . . . . . . . . . . . -67.59 -23.07 65.35 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.219 -0.925 . . . . 1.21 109.913 -179.598 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' D' D ' 354' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -83.29 -10.76 58.33 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.048 -1.033 . . . . 1.68 109.762 -179.844 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' D' D ' 355' ' ' ALA . . . . . . . . . . . . . . . -72.23 -2.41 18.78 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.262 -0.898 . . . . 1.29 109.913 179.959 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' D' D ' 356' ' ' GLY . . . . . . . . . . . . . . . -73.16 -60.67 3.73 Favored Glycine 0 N--CA 1.491 2.354 0 N-CA-C 109.825 -1.31 . . . . 1.28 109.825 -179.73 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' D' D ' 357' ' ' LYS . . . . . . . . . . . . . 25.8 mttt -84.91 143.13 29.2 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.154 -1.204 . . . . 4.45 109.663 -179.731 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' D' D ' 358' ' ' GLU . . . . . . . . . . . . . 5.2 mt-10 -50.16 159.67 0.78 Allowed Pre-proline 0 N--CA 1.491 1.587 0 O-C-N 121.298 -0.876 . . . . 5.71 109.423 179.941 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' D' D ' 359' ' ' PRO . . . . . . . . . . . . . 2.5 Cg_endo -62.47 134.89 50.34 Favored 'Trans proline' 0 C--N 1.31 -1.474 0 C-N-CA 122.233 1.955 . . . . 5.6 110.126 -179.981 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' D' D ' 360' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.323 0 N-CA-C 109.538 -1.425 . . . . 6.97 109.538 -179.988 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 319' ' ' LYS . . . . . . . . . . . . . 6.6 mttt . . . . . 0 N--CA 1.491 1.594 0 N-CA-C 109.268 -0.642 . . . . 7.95 109.268 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 320' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 61.54 84.88 0.13 Allowed 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.256 -0.903 . . . . 6.71 109.58 179.936 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 321' ' ' LYS . . . . . . . . . . . . . 13.2 mtpt -157.5 98.36 1.94 Allowed Pre-proline 0 N--CA 1.491 1.587 0 O-C-N 121.399 -0.813 . . . . 6.5 109.339 -179.954 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 322' ' ' PRO . . . . . . . . . . . . . 3.0 Cg_exo -61.22 -81.99 0.01 OUTLIER 'Trans proline' 0 C--N 1.311 -1.428 0 C-N-CA 122.021 1.814 . . . . 3.3 109.889 -179.881 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 323' ' ' LEU . . . . . . . . . . . . . 30.5 mt -81.47 111.86 18.19 Favored 'General case' 0 N--CA 1.488 1.467 0 O-C-N 121.264 -0.897 . . . . 3.16 109.307 179.634 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 324' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -80.03 -126.15 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.276 -0.89 . . . . 1.53 109.432 -179.784 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 325' ' ' GLY . . . . . 0.45 ' O ' ' CE1' ' A' ' 327' ' ' TYR . . . -69.18 -165.93 4.46 Favored Glycine 0 N--CA 1.491 2.35 0 N-CA-C 109.554 -1.418 . . . . 0.67 109.554 -179.99 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 326' ' ' GLU . . . . . 0.427 ' O ' ' CD1' ' A' ' 327' ' ' TYR . 70.0 mm-40 -59.14 -179.61 0.08 Allowed 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.413 -1.051 . . . . 2.13 109.579 179.785 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 327' ' ' TYR . . . . . 0.582 ' CE2' ' HG2' ' C' ' 333' ' ' ARG . 46.6 m-85 -149.54 110.15 4.26 Favored 'General case' 0 N--CA 1.487 1.42 0 O-C-N 121.484 -0.76 . . . . 1.0 109.0 179.573 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 328' ' ' PHE . . . . . 0.403 ' CZ ' ' HD3' ' C' ' 335' ' ' ARG . 54.8 m-85 -112.22 -167.99 1.26 Allowed 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.185 -0.947 . . . . 0.34 109.602 -179.696 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 329' ' ' THR . . . . . . . . . . . . . 53.3 p -152.06 164.81 36.46 Favored 'General case' 0 N--CA 1.488 1.457 0 O-C-N 121.416 -0.802 . . . . 1.05 108.973 -179.878 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 330' ' ' LEU . . . . . 0.428 ' O ' ' HA ' ' C' ' 329' ' ' THR . 19.1 tp -151.2 131.22 13.41 Favored 'General case' 0 C--N 1.301 -1.507 0 O-C-N 121.127 -0.983 . . . . 1.07 109.769 -179.606 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 331' ' ' GLN . . . . . . . . . . . . . 1.4 tt0 -85.37 116.49 23.73 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.223 -0.923 . . . . 0.91 108.989 179.524 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 332' ' ' ILE . . . . . . . . . . . . . 86.3 mt -101.52 103.44 14.91 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.53 0 O-C-N 121.281 -0.887 . . . . 1.09 109.742 -179.619 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 333' ' ' ARG . . . . . 0.577 ' HG3' ' CD1' ' C' ' 327' ' ' TYR . 3.7 mpt_? -70.27 149.42 47.44 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.238 -0.914 . . . . 3.41 109.199 179.632 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 334' ' ' GLY . . . . . . . . . . . . . . . 78.29 125.37 0.37 Allowed Glycine 0 N--CA 1.49 2.294 0 N-CA-C 109.6 -1.4 . . . . 0.4 109.6 -179.799 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 335' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -74.62 -36.02 62.93 Favored 'General case' 0 N--CA 1.489 1.494 0 O-C-N 121.36 -1.082 . . . . 3.55 109.546 179.956 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 336' ' ' GLU . . . . . . . . . . . . . 27.8 mt-10 -57.77 -58.95 6.1 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.149 -0.969 . . . . 2.29 109.739 -179.562 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 337' ' ' ARG . . . . . . . . . . . . . 15.8 mmt180 -60.77 -28.92 69.1 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.222 -0.924 . . . . 3.64 110.178 -179.573 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 338' ' ' PHE . . . . . . . . . . . . . 41.8 t80 -57.31 -58.88 6.33 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.087 -1.008 . . . . 0.41 110.126 -179.655 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 339' ' ' GLU . . . . . . . . . . . . . 3.5 mt-10 -52.07 -33.91 41.35 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.132 -0.98 . . . . 1.97 110.165 -179.399 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 340' ' ' MET . . . . . 0.4 ' HE2' ' HG ' ' C' ' 348' ' ' LEU . 32.8 ttp -63.72 -49.94 71.1 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.21 -0.931 . . . . 1.14 109.965 -179.577 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 341' ' ' PHE . . . . . 0.509 ' CZ ' ' HA ' ' C' ' 345' ' ' ASN . 35.6 m-85 -62.14 -44.1 97.37 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.117 -0.99 . . . . 0.21 110.038 -179.646 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 342' ' ' ARG . . . . . 0.495 ' HG2' ' NH1' ' A' ' 342' ' ' ARG . 0.1 OUTLIER -48.98 -45.48 42.29 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.236 -0.915 . . . . 3.15 110.118 -179.537 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 343' ' ' GLU . . . . . . . . . . . . . 5.4 tt0 -57.83 -47.9 81.3 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.28 -0.888 . . . . 2.35 109.977 -179.606 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 344' ' ' LEU . . . . . 0.453 ' O ' ' HB1' ' A' ' 347' ' ' ALA . 50.0 mt -61.36 -32.05 71.95 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.055 -1.028 . . . . 1.06 109.734 -179.715 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 345' ' ' ASN . . . . . 0.453 ' HA ' ' CZ ' ' C' ' 341' ' ' PHE . 17.0 t-20 -56.81 -60.73 3.13 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.326 -0.858 . . . . 1.36 109.752 -179.783 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 346' ' ' GLU . . . . . . . . . . . . . 4.3 tt0 -61.19 -24.41 66.3 Favored 'General case' 0 N--CA 1.488 1.438 0 O-C-N 121.269 -0.895 . . . . 1.65 109.785 -179.801 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 347' ' ' ALA . . . . . 0.457 ' HB2' ' HB2' ' B' ' 347' ' ' ALA . . . -60.34 -61.76 2.37 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.213 -0.929 . . . . 1.03 110.097 -179.728 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 348' ' ' LEU . . . . . 0.437 HD13 ' NH1' ' C' ' 337' ' ' ARG . 3.5 mm? -61.52 -47.43 85.63 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.165 -0.96 . . . . 1.04 109.857 -179.455 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 349' ' ' GLU . . . . . . . . . . . . . 3.3 mm-40 -56.21 -30.6 62.53 Favored 'General case' 0 C--N 1.301 -1.539 0 O-C-N 121.17 -0.956 . . . . 1.94 109.87 -179.307 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 350' ' ' LEU . . . . . 0.475 HD23 HD23 ' B' ' 350' ' ' LEU . 4.0 tt -65.1 -45.1 86.58 Favored 'General case' 0 N--CA 1.488 1.463 0 O-C-N 121.217 -0.927 . . . . 1.17 109.621 -179.743 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 351' ' ' LYS . . . . . . . . . . . . . 28.5 tttt -59.94 -50.72 72.64 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.263 -0.898 . . . . 1.97 109.587 -179.836 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 352' ' ' ASP . . . . . . . . . . . . . 66.0 m-20 -55.8 -37.56 68.77 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.153 -0.967 . . . . 1.16 109.689 -179.848 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 353' ' ' ALA . . . . . . . . . . . . . . . -65.36 -35.65 81.6 Favored 'General case' 0 N--CA 1.488 1.467 0 O-C-N 121.269 -0.894 . . . . 1.22 109.492 -179.834 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 354' ' ' GLN . . . . . . . . . . . . . 3.7 tt0 -82.92 -11.19 58.38 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.287 -0.883 . . . . 1.71 109.353 179.839 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 355' ' ' ALA . . . . . . . . . . . . . . . -72.78 -30.72 64.33 Favored 'General case' 0 N--CA 1.488 1.474 0 O-C-N 121.153 -0.967 . . . . 1.3 109.429 179.936 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 356' ' ' GLY . . . . . . . . . . . . . . . -79.78 -6.84 88.91 Favored Glycine 0 N--CA 1.489 2.211 0 N-CA-C 109.562 -1.415 . . . . 1.3 109.562 -179.902 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 357' ' ' LYS . . . . . . . . . . . . . 28.8 mtpt -92.13 -11.76 34.78 Favored 'General case' 0 N--CA 1.488 1.443 0 O-C-N 121.22 -1.165 . . . . 4.46 109.201 179.691 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 358' ' ' GLU . . . . . 0.416 ' HG2' ' HD2' ' A' ' 359' ' ' PRO . 0.3 OUTLIER -54.78 128.16 62.42 Favored Pre-proline 0 N--CA 1.49 1.569 0 O-C-N 121.309 -0.87 . . . . 5.75 109.636 -179.814 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 359' ' ' PRO . . . . . 0.416 ' HD2' ' HG2' ' A' ' 358' ' ' GLU . 1.9 Cg_endo -64.51 110.55 1.44 Allowed 'Trans proline' 0 C--N 1.313 -1.326 0 C-N-CA 121.802 1.668 . . . . 5.63 109.637 179.478 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 360' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.196 0 N-CA-C 109.49 -1.444 . . . . 6.97 109.49 -179.987 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' B' B ' 319' ' ' LYS . . . . . . . . . . . . . 7.2 mttt . . . . . 0 N--CA 1.491 1.614 0 CA-C-O 121.218 0.532 . . . . 7.95 109.604 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' B' B ' 320' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 61.95 85.18 0.13 Allowed 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.276 -0.89 . . . . 6.73 109.41 179.89 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 321' ' ' LYS . . . . . . . . . . . . . 10.7 mtpt -157.94 98.03 1.86 Allowed Pre-proline 0 N--CA 1.489 1.522 0 O-C-N 121.215 -0.928 . . . . 6.5 109.225 179.953 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 322' ' ' PRO . . . . . . . . . . . . . 2.6 Cg_endo -61.69 -81.1 0.01 OUTLIER 'Trans proline' 0 C--N 1.312 -1.348 0 C-N-CA 121.997 1.798 . . . . 3.29 110.005 -179.92 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 323' ' ' LEU . . . . . . . . . . . . . 27.8 mt -81.96 112.24 18.87 Favored 'General case' 0 C--N 1.303 -1.437 0 O-C-N 121.008 -1.058 . . . . 3.18 109.145 179.674 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 324' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -80.2 -126.03 0.02 OUTLIER 'General case' 0 C--N 1.304 -1.408 0 O-C-N 121.179 -0.951 . . . . 1.53 109.3 -179.882 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 325' ' ' GLY . . . . . 0.45 ' O ' ' CE1' ' B' ' 327' ' ' TYR . . . -69.54 -166.15 4.98 Favored Glycine 0 N--CA 1.49 2.285 0 N-CA-C 109.877 -1.289 . . . . 0.65 109.877 -179.841 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 326' ' ' GLU . . . . . 0.422 ' O ' ' CD1' ' B' ' 327' ' ' TYR . 70.8 mm-40 -59.19 -179.39 0.07 Allowed 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.255 -1.144 . . . . 2.13 109.535 -179.868 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 327' ' ' TYR . . . . . 0.566 ' CE2' ' HG3' ' D' ' 333' ' ' ARG . 45.8 m-85 -150.15 109.46 3.96 Favored 'General case' 0 N--CA 1.487 1.421 0 O-C-N 121.274 -0.891 . . . . 0.99 108.851 179.769 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 328' ' ' PHE . . . . . 0.423 ' HB2' ' CD1' ' D' ' 338' ' ' PHE . 53.0 m-85 -111.84 -167.44 1.18 Allowed 'General case' 0 N--CA 1.488 1.473 0 O-C-N 121.326 -0.859 . . . . 0.36 109.666 -179.635 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 329' ' ' THR . . . . . . . . . . . . . 59.1 p -152.28 163.64 39.04 Favored 'General case' 0 C--N 1.302 -1.477 0 O-C-N 121.389 -0.82 . . . . 1.05 109.144 -179.889 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 330' ' ' LEU . . . . . . . . . . . . . 17.3 tp -150.12 131.68 14.84 Favored 'General case' 0 N--CA 1.488 1.46 0 O-C-N 121.166 -0.958 . . . . 1.07 109.743 -179.84 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 331' ' ' GLN . . . . . . . . . . . . . 1.4 tt0 -85.77 116.78 24.24 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.373 -0.829 . . . . 0.91 108.906 179.587 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 332' ' ' ILE . . . . . . . . . . . . . 85.1 mt -101.97 104.04 15.83 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.489 0 O-C-N 121.207 -0.933 . . . . 1.08 109.513 -179.573 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 333' ' ' ARG . . . . . 0.508 ' CG ' ' CE2' ' D' ' 327' ' ' TYR . 4.1 mpt_? -71.21 150.48 45.27 Favored 'General case' 0 C--N 1.305 -1.365 0 O-C-N 121.255 -0.903 . . . . 3.42 109.011 179.746 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 334' ' ' GLY . . . . . . . . . . . . . . . 77.58 126.17 0.33 Allowed Glycine 0 N--CA 1.489 2.175 0 N-CA-C 109.388 -1.485 . . . . 0.4 109.388 -179.986 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 335' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -75.22 -36.91 61.32 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.413 -1.051 . . . . 3.55 109.608 -179.727 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 336' ' ' GLU . . . . . . . . . . . . . 38.7 mt-10 -56.96 -57.49 12.29 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.39 -0.819 . . . . 2.28 110.069 -179.593 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 337' ' ' ARG . . . . . . . . . . . . . 17.0 mmt180 -62.38 -29.24 70.34 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.229 -0.919 . . . . 3.64 109.877 -179.635 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 338' ' ' PHE . . . . . . . . . . . . . 44.5 t80 -56.57 -59.94 4.27 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.26 -0.9 . . . . 0.39 110.121 -179.692 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 339' ' ' GLU . . . . . . . . . . . . . 4.2 mt-10 -51.98 -33.44 38.0 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.238 -0.914 . . . . 1.98 110.102 -179.347 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 340' ' ' MET . . . . . . . . . . . . . 31.8 ttp -63.89 -49.68 71.74 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.066 -1.021 . . . . 1.14 109.822 -179.578 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 341' ' ' PHE . . . . . . . . . . . . . 35.4 m-85 -62.31 -44.28 96.87 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.163 -0.961 . . . . 0.22 110.04 -179.54 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 342' ' ' ARG . . . . . 0.491 ' NH1' ' HG2' ' B' ' 342' ' ' ARG . 0.1 OUTLIER -49.33 -44.62 44.58 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.283 -0.886 . . . . 3.15 110.096 -179.576 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' B' B ' 343' ' ' GLU . . . . . . . . . . . . . 4.6 tt0 -58.18 -47.27 83.92 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.196 -0.94 . . . . 2.35 109.914 -179.393 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 344' ' ' LEU . . . . . 0.435 ' O ' ' HB1' ' B' ' 347' ' ' ALA . 50.3 mt -62.11 -31.68 72.16 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.309 -0.87 . . . . 1.05 109.954 -179.825 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 345' ' ' ASN . . . . . 0.48 ' HA ' ' CZ ' ' D' ' 341' ' ' PHE . 17.0 t-20 -57.43 -60.48 3.58 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.232 -0.918 . . . . 1.35 109.849 -179.683 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 346' ' ' GLU . . . . . . . . . . . . . 4.0 tt0 -61.1 -24.61 66.37 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.304 -0.872 . . . . 1.66 109.791 -179.655 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 347' ' ' ALA . . . . . 0.457 ' HB2' ' HB2' ' A' ' 347' ' ' ALA . . . -60.18 -61.86 2.29 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.147 -0.971 . . . . 1.02 110.016 -179.7 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 348' ' ' LEU . . . . . 0.427 ' N ' HD23 ' B' ' 348' ' ' LEU . 3.5 mm? -61.3 -47.73 84.61 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.234 -0.916 . . . . 1.05 109.917 -179.418 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 349' ' ' GLU . . . . . . . . . . . . . 3.6 mm-40 -56.25 -30.3 62.21 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.174 -0.954 . . . . 1.95 109.825 -179.383 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 350' ' ' LEU . . . . . 0.475 HD23 HD23 ' A' ' 350' ' ' LEU . 4.2 tt -65.17 -45.95 82.79 Favored 'General case' 0 N--CA 1.489 1.492 0 O-C-N 121.116 -0.99 . . . . 1.18 109.328 179.912 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 351' ' ' LYS . . . . . . . . . . . . . 29.3 tttt -59.33 -51.5 69.69 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.233 -0.917 . . . . 1.96 109.646 -179.898 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 352' ' ' ASP . . . . . . . . . . . . . 67.3 m-20 -55.35 -37.62 67.72 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.236 -0.915 . . . . 1.16 109.748 -179.757 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 353' ' ' ALA . . . . . . . . . . . . . . . -65.68 -34.94 79.37 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.377 -0.827 . . . . 1.21 109.403 -179.581 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 354' ' ' GLN . . . . . . . . . . . . . 4.1 tt0 -83.46 -11.79 57.1 Favored 'General case' 0 N--CA 1.487 1.421 0 O-C-N 121.201 -0.937 . . . . 1.69 109.225 179.775 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 355' ' ' ALA . . . . . . . . . . . . . . . -72.03 -31.28 66.02 Favored 'General case' 0 N--CA 1.488 1.467 0 O-C-N 121.07 -1.019 . . . . 1.3 109.419 179.999 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 356' ' ' GLY . . . . . . . . . . . . . . . -79.22 -6.88 88.78 Favored Glycine 0 N--CA 1.49 2.263 0 N-CA-C 109.504 -1.438 . . . . 1.29 109.504 -179.97 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 357' ' ' LYS . . . . . . . . . . . . . 27.6 mtpt -90.66 -12.52 36.53 Favored 'General case' 0 N--CA 1.489 1.482 0 O-C-N 121.137 -1.213 . . . . 4.45 109.134 179.578 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 358' ' ' GLU . . . . . 0.421 ' HG2' ' HD2' ' B' ' 359' ' ' PRO . 0.3 OUTLIER -54.19 127.5 55.86 Favored Pre-proline 0 N--CA 1.49 1.556 0 O-C-N 121.372 -0.83 . . . . 5.72 109.787 -179.842 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' B' B ' 359' ' ' PRO . . . . . 0.421 ' HD2' ' HG2' ' B' ' 358' ' ' GLU . 1.7 Cg_endo -64.83 110.79 1.54 Allowed 'Trans proline' 0 C--N 1.312 -1.395 0 C-N-CA 122.123 1.882 . . . . 5.6 109.649 179.37 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 360' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.272 0 CA-C-O 117.873 -1.515 . . . . 6.98 109.571 -179.954 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' C' C ' 319' ' ' LYS . . . . . . . . . . . . . 6.4 mttm . . . . . 0 N--CA 1.493 1.677 0 N-CA-C 109.354 -0.61 . . . . 7.03 109.354 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' C' C ' 320' ' ' LYS . . . . . . . . . . . . . 1.5 tttt 67.72 94.62 0.07 Allowed 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.206 -0.934 . . . . 6.84 109.934 179.399 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 321' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -161.98 93.03 1.34 Allowed Pre-proline 0 N--CA 1.49 1.565 0 O-C-N 121.271 -0.893 . . . . 6.78 109.462 179.787 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' C' C ' 322' ' ' PRO . . . . . . . . . . . . . 3.5 Cg_exo -60.06 111.0 0.86 Allowed 'Trans proline' 0 C--N 1.309 -1.543 0 C-N-CA 122.034 1.823 . . . . 3.98 110.271 179.731 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 323' ' ' LEU . . . . . . . . . . . . . 45.1 mt -80.86 119.91 24.03 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.401 -0.812 . . . . 4.31 109.08 179.966 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 324' ' ' ASP . . . . . . . . . . . . . 15.6 m-20 -83.94 31.26 0.49 Allowed 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.196 -0.94 . . . . 1.63 110.034 -179.949 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 325' ' ' GLY . . . . . 0.579 ' O ' ' CD2' ' C' ' 327' ' ' TYR . . . -67.1 167.36 39.41 Favored Glycine 0 N--CA 1.487 2.074 0 N-CA-C 108.427 -1.869 . . . . 0.82 108.427 179.634 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' C' C ' 326' ' ' GLU . . . . . . . . . . . . . 3.0 mm-40 -56.71 162.17 2.44 Favored 'General case' 0 C--N 1.302 -1.488 0 O-C-N 120.885 -1.362 . . . . 2.17 108.972 -179.729 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 327' ' ' TYR . . . . . 0.579 ' CD2' ' O ' ' C' ' 325' ' ' GLY . 42.2 m-85 -146.82 100.54 3.33 Favored 'General case' 0 C--N 1.302 -1.5 0 O-C-N 121.238 -0.914 . . . . 1.03 108.973 -179.885 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' C' C ' 328' ' ' PHE . . . . . . . . . . . . . 87.6 m-85 -103.2 -166.41 1.27 Allowed 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.278 -0.889 . . . . 0.37 109.711 -179.449 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 329' ' ' THR . . . . . 0.428 ' HA ' ' O ' ' A' ' 330' ' ' LEU . 24.7 p -152.97 161.44 42.53 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.413 -0.804 . . . . 1.04 109.014 -179.865 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' C' C ' 330' ' ' LEU . . . . . . . . . . . . . 17.2 tp -149.95 133.42 16.57 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.158 -0.963 . . . . 1.09 109.508 -179.525 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 331' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -87.72 116.22 25.7 Favored 'General case' 0 N--CA 1.488 1.47 0 O-C-N 121.352 -0.843 . . . . 1.48 109.36 179.802 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' C' C ' 332' ' ' ILE . . . . . 0.477 HG23 ' HA ' ' C' ' 338' ' ' PHE . 15.1 mt -104.24 104.76 17.3 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.68 0 O-C-N 121.247 -0.908 . . . . 1.08 109.607 179.961 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' C' C ' 333' ' ' ARG . . . . . 0.582 ' HG2' ' CE2' ' A' ' 327' ' ' TYR . 0.7 OUTLIER -73.04 143.38 47.52 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.392 -0.817 . . . . 3.36 109.423 179.582 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' C' C ' 334' ' ' GLY . . . . . . . . . . . . . . . 80.63 131.61 1.06 Allowed Glycine 0 N--CA 1.495 2.623 0 N-CA-C 109.722 -1.351 . . . . 0.35 109.722 179.848 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 335' ' ' ARG . . . . . 0.535 ' HG2' ' NH1' ' C' ' 335' ' ' ARG . 0.0 OUTLIER -79.48 -32.75 42.58 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.241 -1.152 . . . . 3.23 109.725 179.975 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' C' C ' 336' ' ' GLU . . . . . . . . . . . . . 49.2 mt-10 -55.55 -61.97 2.0 Allowed 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.238 -0.914 . . . . 2.62 109.208 -179.737 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 337' ' ' ARG . . . . . 0.437 ' NH1' HD13 ' A' ' 348' ' ' LEU . 30.5 mmt180 -61.98 -28.56 69.65 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.192 -0.942 . . . . 3.61 109.493 179.737 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' C' C ' 338' ' ' PHE . . . . . 0.477 ' HA ' HG23 ' C' ' 332' ' ' ILE . 86.4 t80 -54.94 -61.22 2.46 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.361 -0.837 . . . . 0.43 110.135 -179.552 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' C' C ' 339' ' ' GLU . . . . . . . . . . . . . 50.1 mt-10 -51.2 -34.2 30.86 Favored 'General case' 0 N--CA 1.495 1.787 0 O-C-N 121.257 -0.902 . . . . 2.05 109.777 -179.836 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 340' ' ' MET . . . . . . . . . . . . . 33.0 ttp -62.66 -50.77 69.89 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.316 -0.865 . . . . 1.1 109.791 -179.492 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 341' ' ' PHE . . . . . 0.453 ' CZ ' ' HA ' ' A' ' 345' ' ' ASN . 50.7 m-85 -61.11 -42.52 98.67 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.025 -1.047 . . . . 0.21 109.89 -179.772 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' C' C ' 342' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -52.35 -46.11 65.99 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.025 -1.047 . . . . 3.42 109.782 179.984 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' C' C ' 343' ' ' GLU . . . . . . . . . . . . . 9.4 tt0 -57.12 -49.14 76.81 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.225 -0.922 . . . . 2.14 109.835 -179.528 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 344' ' ' LEU . . . . . 0.422 ' O ' HD21 ' C' ' 348' ' ' LEU . 85.4 mt -62.25 -28.06 69.44 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.292 -0.88 . . . . 1.09 109.552 179.945 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' C' C ' 345' ' ' ASN . . . . . 0.509 ' HA ' ' CZ ' ' A' ' 341' ' ' PHE . 24.8 t-20 -58.74 -63.21 1.37 Allowed 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.425 -0.797 . . . . 1.38 110.303 -179.422 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' C' C ' 346' ' ' GLU . . . . . 0.438 ' O ' ' HG2' ' C' ' 346' ' ' GLU . 17.9 tt0 -61.66 -21.77 64.71 Favored 'General case' 0 C--N 1.301 -1.509 0 O-C-N 121.3 -0.875 . . . . 2.21 109.948 -179.444 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' C' C ' 347' ' ' ALA . . . . . . . . . . . . . . . -61.67 -58.43 8.08 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.004 -1.06 . . . . 1.03 110.214 -179.617 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 348' ' ' LEU . . . . . 0.422 HD21 ' O ' ' C' ' 344' ' ' LEU . 3.4 mm? -63.47 -53.94 44.26 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.071 -1.018 . . . . 1.06 110.344 -179.214 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' C' C ' 349' ' ' GLU . . . . . . . . . . . . . 1.9 mp0 -57.22 -26.84 61.37 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.002 -1.061 . . . . 2.19 109.735 -179.472 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 350' ' ' LEU . . . . . 0.589 ' CD2' ' CD1' ' D' ' 350' ' ' LEU . 7.7 tt -65.12 -46.7 79.92 Favored 'General case' 0 N--CA 1.488 1.453 0 O-C-N 121.015 -1.053 . . . . 1.2 109.165 179.666 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' C' C ' 351' ' ' LYS . . . . . . . . . . . . . 42.1 tttt -61.19 -43.63 98.58 Favored 'General case' 0 N--CA 1.488 1.438 0 O-C-N 121.385 -0.822 . . . . 1.92 109.473 179.924 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 352' ' ' ASP . . . . . . . . . . . . . 2.9 m-20 -56.28 -47.79 77.9 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.264 -0.898 . . . . 1.19 109.655 -179.95 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 353' ' ' ALA . . . . . . . . . . . . . . . -67.6 -19.17 65.2 Favored 'General case' 0 N--CA 1.489 1.499 0 O-C-N 121.189 -0.944 . . . . 1.15 109.424 -179.934 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 354' ' ' GLN . . . . . . . . . . . . . 1.5 tt0 -83.26 -12.91 56.26 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.199 -0.938 . . . . 1.7 109.525 179.988 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 355' ' ' ALA . . . . . . . . . . . . . . . -71.38 -46.34 60.58 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.334 -0.854 . . . . 1.3 109.199 179.808 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 356' ' ' GLY . . . . . . . . . . . . . . . -80.99 -10.73 84.63 Favored Glycine 0 N--CA 1.486 2.011 0 N-CA-C 109.612 -1.395 . . . . 1.33 109.612 -179.895 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 357' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -87.93 87.57 7.39 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.178 -1.189 . . . . 4.39 108.834 179.668 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' C' C ' 358' ' ' GLU . . . . . . . . . . . . . 94.5 mt-10 -54.84 154.3 9.81 Favored Pre-proline 0 N--CA 1.487 1.387 0 O-C-N 121.503 -0.748 . . . . 5.75 109.786 -179.767 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 359' ' ' PRO . . . . . . . . . . . . . 2.1 Cg_endo -63.01 126.83 18.82 Favored 'Trans proline' 0 C--N 1.308 -1.596 0 C-N-CA 122.034 1.822 . . . . 5.54 110.037 179.65 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 360' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.223 0 CA-C-O 118.031 -1.427 . . . . 6.5 109.629 179.954 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' D' D ' 319' ' ' LYS . . . . . . . . . . . . . 7.8 mttt . . . . . 0 N--CA 1.491 1.604 0 CA-C-O 121.378 0.609 . . . . 7.93 109.422 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' D' D ' 320' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 60.43 85.44 0.11 Allowed 'General case' 0 N--CA 1.488 1.47 0 O-C-N 121.373 -0.83 . . . . 6.7 109.737 179.879 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' D' D ' 321' ' ' LYS . . . . . . . . . . . . . 8.5 mtpt -157.48 97.65 1.97 Allowed Pre-proline 0 N--CA 1.492 1.629 0 O-C-N 121.298 -0.876 . . . . 6.49 109.332 179.994 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' D' D ' 322' ' ' PRO . . . . . . . . . . . . . 2.5 Cg_endo -61.35 -81.59 0.01 OUTLIER 'Trans proline' 0 C--N 1.311 -1.436 0 C-N-CA 121.841 1.694 . . . . 3.29 109.877 -179.936 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' D' D ' 323' ' ' LEU . . . . . . . . . . . . . 28.0 mt -81.57 111.64 18.05 Favored 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.184 -0.947 . . . . 3.16 109.501 179.681 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' D' D ' 324' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -79.54 -126.89 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.32 -0.862 . . . . 1.54 109.652 -179.849 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' D' D ' 325' ' ' GLY . . . . . 0.451 ' O ' ' CE1' ' D' ' 327' ' ' TYR . . . -69.44 -166.47 5.03 Favored Glycine 0 N--CA 1.49 2.272 0 N-CA-C 109.648 -1.381 . . . . 0.65 109.648 -179.846 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' D' D ' 326' ' ' GLU . . . . . 0.433 ' O ' ' CD1' ' D' ' 327' ' ' TYR . 71.8 mm-40 -58.95 -179.45 0.07 Allowed 'General case' 0 N--CA 1.488 1.437 0 O-C-N 121.372 -1.076 . . . . 2.13 109.617 -179.863 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' D' D ' 327' ' ' TYR . . . . . 0.508 ' CE2' ' CG ' ' B' ' 333' ' ' ARG . 47.4 m-85 -150.12 109.49 3.98 Favored 'General case' 0 C--N 1.302 -1.5 0 O-C-N 121.276 -0.89 . . . . 1.0 109.082 179.817 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' D' D ' 328' ' ' PHE . . . . . . . . . . . . . 52.0 m-85 -111.35 -166.71 1.1 Allowed 'General case' 0 N--CA 1.488 1.472 0 O-C-N 121.398 -0.814 . . . . 0.34 109.623 -179.674 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' D' D ' 329' ' ' THR . . . . . . . . . . . . . 66.4 p -152.56 163.33 39.8 Favored 'General case' 0 N--CA 1.488 1.425 0 O-C-N 121.34 -0.85 . . . . 1.05 108.843 179.991 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' D' D ' 330' ' ' LEU . . . . . . . . . . . . . 17.7 tp -149.85 131.35 14.8 Favored 'General case' 0 C--N 1.301 -1.507 0 O-C-N 121.158 -0.964 . . . . 1.07 109.655 -179.702 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' D' D ' 331' ' ' GLN . . . . . . . . . . . . . 1.5 tt0 -86.0 116.66 24.36 Favored 'General case' 0 C--N 1.303 -1.433 0 O-C-N 121.347 -0.846 . . . . 0.93 108.804 179.593 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' D' D ' 332' ' ' ILE . . . . . . . . . . . . . 80.4 mt -102.4 103.68 15.36 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.452 0 O-C-N 121.344 -0.848 . . . . 1.07 109.572 -179.545 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' D' D ' 333' ' ' ARG . . . . . 0.566 ' HG3' ' CE2' ' B' ' 327' ' ' TYR . 4.5 mpt_? -70.64 151.22 45.2 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.282 -0.886 . . . . 3.42 109.294 179.731 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' D' D ' 334' ' ' GLY . . . . . . . . . . . . . . . 77.07 126.77 0.29 Allowed Glycine 0 N--CA 1.489 2.199 0 N-CA-C 109.389 -1.485 . . . . 0.41 109.389 -179.953 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' D' D ' 335' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -75.68 -36.83 59.96 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.426 -1.043 . . . . 3.58 109.56 -179.815 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' D' D ' 336' ' ' GLU . . . . . . . . . . . . . 43.8 mt-10 -56.8 -58.77 6.67 Favored 'General case' 0 C--N 1.301 -1.505 0 O-C-N 121.281 -0.887 . . . . 2.26 109.778 -179.633 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' D' D ' 337' ' ' ARG . . . . . . . . . . . . . 16.9 mmt180 -60.94 -28.94 69.33 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.195 -0.941 . . . . 3.64 110.196 -179.578 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' D' D ' 338' ' ' PHE . . . . . 0.423 ' CD1' ' HB2' ' B' ' 328' ' ' PHE . 40.5 t80 -57.22 -60.29 3.83 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.261 -0.899 . . . . 0.4 110.081 -179.45 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' D' D ' 339' ' ' GLU . . . . . . . . . . . . . 5.3 mt-10 -51.89 -33.0 34.8 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.328 -0.858 . . . . 1.99 110.218 -179.203 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' D' D ' 340' ' ' MET . . . . . . . . . . . . . 30.2 ttp -63.96 -49.94 70.6 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.065 -1.022 . . . . 1.13 109.755 -179.659 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' D' D ' 341' ' ' PHE . . . . . 0.48 ' CZ ' ' HA ' ' B' ' 345' ' ' ASN . 36.2 m-85 -61.97 -43.96 97.74 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.314 -0.866 . . . . 0.21 110.106 -179.721 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' D' D ' 342' ' ' ARG . . . . . 0.508 ' NH1' ' HG2' ' D' ' 342' ' ' ARG . 0.1 OUTLIER -49.32 -44.54 44.49 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.401 -0.812 . . . . 3.15 110.042 -179.54 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' D' D ' 343' ' ' GLU . . . . . . . . . . . . . 4.4 tt0 -58.49 -47.85 82.73 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.247 -0.908 . . . . 2.35 109.949 -179.448 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' D' D ' 344' ' ' LEU . . . . . 0.452 ' O ' ' HB1' ' D' ' 347' ' ' ALA . 47.3 mt -61.58 -32.03 72.11 Favored 'General case' 0 N--CA 1.489 1.493 0 O-C-N 121.065 -1.022 . . . . 1.06 109.979 -179.66 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' D' D ' 345' ' ' ASN . . . . . . . . . . . . . 16.3 t-20 -57.09 -60.39 3.66 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.23 -0.919 . . . . 1.35 109.85 -179.538 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' D' D ' 346' ' ' GLU . . . . . . . . . . . . . 3.9 tt0 -61.09 -24.71 66.44 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.391 -0.818 . . . . 1.69 109.699 -179.549 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' D' D ' 347' ' ' ALA . . . . . 0.452 ' HB1' ' O ' ' D' ' 344' ' ' LEU . . . -60.15 -61.7 2.41 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.162 -0.961 . . . . 1.03 110.058 -179.719 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' D' D ' 348' ' ' LEU . . . . . 0.448 ' N ' HD23 ' D' ' 348' ' ' LEU . 3.5 mm? -61.4 -47.72 84.52 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.144 -0.972 . . . . 1.04 110.219 -179.616 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' D' D ' 349' ' ' GLU . . . . . . . . . . . . . 3.5 mm-40 -56.71 -29.81 62.84 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.131 -0.981 . . . . 1.95 109.723 -179.327 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' D' D ' 350' ' ' LEU . . . . . 0.589 ' CD1' ' CD2' ' C' ' 350' ' ' LEU . 4.3 tt -64.95 -45.92 83.75 Favored 'General case' 0 N--CA 1.488 1.469 0 O-C-N 121.252 -0.905 . . . . 1.16 109.368 179.947 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' D' D ' 351' ' ' LYS . . . . . . . . . . . . . 29.3 tttt -60.04 -51.62 68.85 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.504 -0.748 . . . . 1.97 109.584 179.959 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' D' D ' 352' ' ' ASP . . . . . . . . . . . . . 69.3 m-20 -55.3 -38.04 68.13 Favored 'General case' 0 N--CA 1.489 1.48 0 O-C-N 121.343 -0.848 . . . . 1.17 109.382 -179.916 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' D' D ' 353' ' ' ALA . . . . . . . . . . . . . . . -65.17 -35.17 80.24 Favored 'General case' 0 N--CA 1.489 1.489 0 O-C-N 121.146 -0.971 . . . . 1.21 109.552 -179.998 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' D' D ' 354' ' ' GLN . . . . . . . . . . . . . 4.1 tt0 -83.51 -11.24 57.68 Favored 'General case' 0 N--CA 1.488 1.457 0 O-C-N 121.151 -0.968 . . . . 1.68 109.557 -179.944 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' D' D ' 355' ' ' ALA . . . . . . . . . . . . . . . -72.08 -31.99 66.61 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.261 -0.9 . . . . 1.29 109.479 179.832 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' D' D ' 356' ' ' GLY . . . . . . . . . . . . . . . -78.71 -7.31 88.25 Favored Glycine 0 N--CA 1.49 2.293 0 N-CA-C 109.588 -1.405 . . . . 1.28 109.588 -179.93 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' D' D ' 357' ' ' LYS . . . . . . . . . . . . . 27.0 mtpt -90.66 -11.74 38.91 Favored 'General case' 0 N--CA 1.489 1.499 0 O-C-N 121.234 -1.157 . . . . 4.45 108.98 179.465 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' D' D ' 358' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -54.92 126.38 59.05 Favored Pre-proline 0 N--CA 1.488 1.466 0 O-C-N 121.299 -0.876 . . . . 5.71 109.535 -179.99 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' D' D ' 359' ' ' PRO . . . . . . . . . . . . . 1.7 Cg_endo -64.13 111.55 1.62 Allowed 'Trans proline' 0 C--N 1.313 -1.307 0 C-N-CA 121.967 1.778 . . . . 5.6 109.666 179.567 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' D' D ' 360' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.19 0 CA-C-O 118.038 -1.423 . . . . 6.97 109.746 -179.92 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 319' ' ' LYS . . . . . 0.428 ' O ' ' HB2' ' A' ' 320' ' ' LYS . 0.9 OUTLIER . . . . . 0 N--CA 1.488 1.461 0 N-CA-C 109.454 -0.573 . . . . 7.95 109.454 . . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 320' ' ' LYS . . . . . 0.428 ' HB2' ' O ' ' A' ' 319' ' ' LYS . 35.2 mttp 60.47 -88.72 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.277 -0.89 . . . . 6.71 109.752 179.757 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 321' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -156.83 76.58 4.24 Favored Pre-proline 0 N--CA 1.492 1.669 0 O-C-N 121.121 -0.987 . . . . 6.5 109.389 179.854 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 322' ' ' PRO . . . . . . . . . . . . . 2.9 Cg_endo -62.33 110.41 1.04 Allowed 'Trans proline' 0 C--N 1.309 -1.526 0 C-N-CA 122.335 2.023 . . . . 3.3 110.319 -179.779 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 323' ' ' LEU . . . . . . . . . . . . . 36.4 mt -82.64 111.82 18.96 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.314 -0.866 . . . . 3.16 109.317 179.841 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 324' ' ' ASP . . . . . . . . . . . . . 32.5 m-20 -80.46 107.56 13.36 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.087 -1.008 . . . . 1.53 109.41 179.856 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 325' ' ' GLY . . . . . 0.552 ' O ' ' CD2' ' A' ' 327' ' ' TYR . . . -68.11 -169.41 5.01 Favored Glycine 0 N--CA 1.49 2.299 0 N-CA-C 109.512 -1.435 . . . . 0.67 109.512 -179.961 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 326' ' ' GLU . . . . . 0.431 ' HB3' ' CE2' ' A' ' 328' ' ' PHE . 43.5 mm-40 -59.18 163.93 3.44 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.261 -1.14 . . . . 2.13 109.093 179.941 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 327' ' ' TYR . . . . . 0.588 ' CE1' ' HG2' ' C' ' 333' ' ' ARG . 41.2 m-85 -149.69 104.83 3.37 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.169 -0.957 . . . . 1.0 109.428 -179.894 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 328' ' ' PHE . . . . . 0.431 ' CE2' ' HB3' ' A' ' 326' ' ' GLU . 88.9 m-85 -111.46 -166.19 1.06 Allowed 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.419 -0.801 . . . . 0.34 109.576 -179.72 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 329' ' ' THR . . . . . . . . . . . . . 33.5 p -153.61 160.92 42.56 Favored 'General case' 0 N--CA 1.488 1.435 0 O-C-N 121.451 -0.781 . . . . 1.05 108.923 -179.826 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 330' ' ' LEU . . . . . . . . . . . . . 25.9 tp -150.78 129.84 12.62 Favored 'General case' 0 N--CA 1.488 1.465 0 O-C-N 121.167 -0.958 . . . . 1.07 109.738 -179.611 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 331' ' ' GLN . . . . . . . . . . . . . 1.3 tt0 -88.82 113.81 24.77 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.22 -0.925 . . . . 0.91 109.189 179.732 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 332' ' ' ILE . . . . . 0.408 HG23 ' HA ' ' A' ' 338' ' ' PHE . 38.5 mt -103.41 111.76 34.35 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.505 0 O-C-N 121.08 -1.013 . . . . 1.09 109.911 -179.864 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 333' ' ' ARG . . . . . 0.594 ' CG ' ' CE1' ' C' ' 327' ' ' TYR . 0.0 OUTLIER -73.12 149.28 43.17 Favored 'General case' 0 C--N 1.302 -1.47 0 O-C-N 121.27 -0.894 . . . . 3.41 109.488 179.725 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 334' ' ' GLY . . . . . . . . . . . . . . . 84.77 132.57 2.53 Favored Glycine 0 N--CA 1.49 2.259 0 N-CA-C 109.514 -1.434 . . . . 0.4 109.514 -179.917 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 335' ' ' ARG . . . . . . . . . . . . . 36.0 ttt180 -78.92 -42.48 26.98 Favored 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.199 -1.177 . . . . 3.55 109.59 -179.83 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 336' ' ' GLU . . . . . . . . . . . . . 3.5 pt-20 -57.22 -53.08 62.14 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.232 -0.917 . . . . 2.29 110.115 -179.589 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 337' ' ' ARG . . . . . . . . . . . . . 12.6 mmt180 -61.97 -34.81 76.82 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 120.97 -1.081 . . . . 3.64 109.809 -179.754 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 338' ' ' PHE . . . . . 0.408 ' HA ' HG23 ' A' ' 332' ' ' ILE . 80.8 t80 -55.32 -57.55 11.36 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.173 -0.955 . . . . 0.41 109.802 -179.711 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 339' ' ' GLU . . . . . . . . . . . . . 44.1 mt-10 -51.43 -36.09 42.29 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.224 -0.923 . . . . 1.97 110.425 -179.681 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 340' ' ' MET . . . . . . . . . . . . . 47.1 ttp -62.44 -48.57 79.08 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.119 -0.988 . . . . 1.14 109.808 -179.448 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 341' ' ' PHE . . . . . 0.424 ' CZ ' ' HA ' ' C' ' 345' ' ' ASN . 43.3 m-85 -62.55 -47.81 82.24 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.128 -0.982 . . . . 0.21 109.982 -179.614 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 342' ' ' ARG . . . . . . . . . . . . . 19.7 ttt180 -49.23 -42.32 40.18 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.316 -0.865 . . . . 3.15 110.21 -179.496 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 343' ' ' GLU . . . . . . . . . . . . . 4.2 tp10 -58.89 -49.05 79.24 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.143 -0.973 . . . . 2.35 109.921 -179.611 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 344' ' ' LEU . . . . . 0.499 HD21 ' CD2' ' B' ' 344' ' ' LEU . 37.1 mt -61.34 -31.56 71.43 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.217 -0.927 . . . . 1.06 109.76 -179.568 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 345' ' ' ASN . . . . . . . . . . . . . 62.4 t-20 -57.36 -54.3 48.4 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.295 -0.878 . . . . 1.36 109.698 -179.717 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 346' ' ' GLU . . . . . . . . . . . . . 6.0 tp10 -62.62 -27.74 69.41 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.331 -0.855 . . . . 1.65 110.097 -179.661 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 347' ' ' ALA . . . . . . . . . . . . . . . -61.85 -58.82 6.5 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.217 -0.927 . . . . 1.03 110.025 -179.609 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 348' ' ' LEU . . . . . 0.46 ' N ' HD23 ' A' ' 348' ' ' LEU . 3.8 mm? -60.72 -48.53 81.37 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.119 -0.988 . . . . 1.04 110.053 -179.304 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 349' ' ' GLU . . . . . 0.452 ' OE1' ' NH1' ' C' ' 333' ' ' ARG . 43.4 mt-10 -56.98 -33.13 66.79 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.155 -0.966 . . . . 1.94 109.533 -179.47 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 350' ' ' LEU . . . . . 0.477 HD23 HD23 ' B' ' 350' ' ' LEU . 3.9 tt -63.96 -45.34 89.59 Favored 'General case' 0 C--N 1.302 -1.469 0 O-C-N 121.269 -0.895 . . . . 1.17 109.182 179.887 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 351' ' ' LYS . . . . . . . . . . . . . 9.5 tttp -60.5 -45.33 94.19 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.279 -0.888 . . . . 1.97 109.624 179.858 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 352' ' ' ASP . . . . . 0.411 ' O ' ' HB1' ' A' ' 355' ' ' ALA . 7.0 m-20 -55.19 -37.56 67.23 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.233 -0.917 . . . . 1.16 109.633 -179.844 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 353' ' ' ALA . . . . . . . . . . . . . . . -66.08 -30.29 70.78 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.228 -0.92 . . . . 1.22 109.702 -179.795 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 354' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -82.73 -5.61 58.98 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.239 -0.913 . . . . 1.71 109.727 -179.954 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 355' ' ' ALA . . . . . 0.411 ' HB1' ' O ' ' A' ' 352' ' ' ASP . . . -71.45 -5.69 34.77 Favored 'General case' 0 N--CA 1.488 1.465 0 O-C-N 121.251 -0.905 . . . . 1.3 109.605 -179.887 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 356' ' ' GLY . . . . . . . . . . . . . . . -79.95 2.06 76.61 Favored Glycine 0 N--CA 1.492 2.377 0 N-CA-C 109.682 -1.367 . . . . 1.3 109.682 179.936 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 357' ' ' LYS . . . . . . . . . . . . . 1.5 mtpp -86.25 103.81 15.2 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.146 -1.208 . . . . 4.46 109.635 -179.823 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 358' ' ' GLU . . . . . 0.557 ' N ' ' HD2' ' A' ' 359' ' ' PRO . 3.6 tt0 -50.84 -53.56 46.04 Favored Pre-proline 0 N--CA 1.491 1.6 0 O-C-N 121.385 -0.822 . . . . 5.75 109.787 179.855 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 359' ' ' PRO . . . . . 0.557 ' HD2' ' N ' ' A' ' 358' ' ' GLU . 2.8 Cg_endo -61.1 -48.29 10.49 Favored 'Trans proline' 0 C--N 1.313 -1.304 0 C-N-CA 121.586 1.524 . . . . 5.63 110.108 -179.879 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 360' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.228 0 N-CA-C 109.527 -1.429 . . . . 6.97 109.527 -179.901 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' B' B ' 319' ' ' LYS . . . . . 0.413 ' O ' ' HB2' ' B' ' 320' ' ' LYS . 1.0 OUTLIER . . . . . 0 N--CA 1.49 1.557 0 N-CA-C 109.422 -0.584 . . . . 7.95 109.422 . . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 320' ' ' LYS . . . . . 0.413 ' HB2' ' O ' ' B' ' 319' ' ' LYS . 33.6 mttp 60.33 -89.14 0.03 OUTLIER 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.256 -0.903 . . . . 6.73 109.715 179.937 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 321' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -156.83 76.97 4.18 Favored Pre-proline 0 N--CA 1.49 1.537 0 O-C-N 121.352 -0.842 . . . . 6.5 109.4 179.981 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 322' ' ' PRO . . . . . . . . . . . . . 2.3 Cg_endo -62.71 110.0 1.01 Allowed 'Trans proline' 0 C--N 1.311 -1.404 0 C-N-CA 122.353 2.035 . . . . 3.29 110.423 -179.775 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 323' ' ' LEU . . . . . . . . . . . . . 38.8 mt -82.04 112.0 18.71 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.261 -0.899 . . . . 3.18 109.32 179.824 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 324' ' ' ASP . . . . . . . . . . . . . 27.5 m-20 -80.77 108.21 14.23 Favored 'General case' 0 N--CA 1.488 1.47 0 O-C-N 121.058 -1.026 . . . . 1.53 109.275 179.777 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 325' ' ' GLY . . . . . 0.572 ' O ' ' CD2' ' B' ' 327' ' ' TYR . . . -68.74 -169.71 5.88 Favored Glycine 0 N--CA 1.489 2.176 0 N-CA-C 109.415 -1.474 . . . . 0.65 109.415 -179.968 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 326' ' ' GLU . . . . . 0.43 ' HB3' ' CE2' ' B' ' 328' ' ' PHE . 45.1 mm-40 -58.74 163.63 3.22 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.195 -1.18 . . . . 2.13 109.205 179.783 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 327' ' ' TYR . . . . . 0.622 ' CE1' ' CG ' ' D' ' 333' ' ' ARG . 42.9 m-85 -149.16 106.36 3.61 Favored 'General case' 0 C--N 1.301 -1.516 0 O-C-N 121.177 -0.952 . . . . 0.99 109.199 179.974 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 328' ' ' PHE . . . . . 0.522 ' CE2' ' HA ' ' D' ' 335' ' ' ARG . 89.3 m-85 -113.57 -167.07 1.15 Allowed 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.331 -0.856 . . . . 0.36 109.458 -179.563 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 329' ' ' THR . . . . . . . . . . . . . 33.9 p -152.74 161.32 42.72 Favored 'General case' 0 N--CA 1.488 1.459 0 O-C-N 121.314 -0.866 . . . . 1.05 109.08 -179.912 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 330' ' ' LEU . . . . . . . . . . . . . 25.4 tp -151.19 129.09 11.69 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 120.966 -1.084 . . . . 1.07 109.779 -179.637 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 331' ' ' GLN . . . . . . . . . . . . . 1.3 tt0 -87.96 114.91 25.03 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.201 -0.937 . . . . 0.91 109.185 179.623 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 332' ' ' ILE . . . . . 0.41 HG23 ' HA ' ' B' ' 338' ' ' PHE . 39.1 mt -103.89 111.81 34.97 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.594 0 O-C-N 121.09 -1.006 . . . . 1.08 109.718 -179.871 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 333' ' ' ARG . . . . . 0.597 ' CG ' ' CE1' ' D' ' 327' ' ' TYR . 0.0 OUTLIER -73.34 149.21 42.77 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.231 -0.918 . . . . 3.42 109.587 179.755 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' B' B ' 334' ' ' GLY . . . . . . . . . . . . . . . 84.23 132.36 2.29 Favored Glycine 0 N--CA 1.492 2.391 0 N-CA-C 109.437 -1.465 . . . . 0.4 109.437 -179.834 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 335' ' ' ARG . . . . . 0.491 ' HA ' ' CE2' ' D' ' 328' ' ' PHE . 38.4 ttt180 -78.62 -41.96 30.15 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.332 -1.099 . . . . 3.55 109.737 -179.768 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 336' ' ' GLU . . . . . . . . . . . . . 3.7 pt-20 -57.16 -53.2 60.84 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.224 -0.922 . . . . 2.28 110.09 -179.677 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 337' ' ' ARG . . . . . . . . . . . . . 13.0 mmt180 -62.05 -34.9 77.12 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.044 -1.035 . . . . 3.64 109.929 -179.75 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 338' ' ' PHE . . . . . 0.41 ' HA ' HG23 ' B' ' 332' ' ' ILE . 80.3 t80 -55.61 -56.71 17.2 Favored 'General case' 0 C--N 1.303 -1.455 0 O-C-N 121.211 -0.931 . . . . 0.39 109.88 -179.618 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 339' ' ' GLU . . . . . . . . . . . . . 44.0 mt-10 -52.4 -35.2 51.13 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.222 -0.923 . . . . 1.98 110.337 -179.489 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 340' ' ' MET . . . . . . . . . . . . . 47.4 ttp -63.27 -48.27 78.85 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.135 -0.978 . . . . 1.14 109.755 -179.405 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 341' ' ' PHE . . . . . . . . . . . . . 43.9 m-85 -62.49 -47.94 81.74 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.204 -0.935 . . . . 0.22 109.848 -179.886 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 342' ' ' ARG . . . . . . . . . . . . . 17.2 ttt180 -49.24 -41.98 39.25 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.246 -0.909 . . . . 3.15 110.162 -179.55 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 343' ' ' GLU . . . . . . . . . . . . . 4.3 tp10 -59.16 -48.72 80.57 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.026 -1.046 . . . . 2.35 109.839 -179.53 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 344' ' ' LEU . . . . . 0.499 ' CD2' HD21 ' A' ' 344' ' ' LEU . 38.0 mt -61.76 -31.3 71.48 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.207 -0.933 . . . . 1.05 109.865 -179.609 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 345' ' ' ASN . . . . . . . . . . . . . 63.0 t-20 -57.64 -54.65 44.42 Favored 'General case' 0 C--N 1.302 -1.465 0 O-C-N 121.175 -0.953 . . . . 1.35 109.641 -179.714 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 346' ' ' GLU . . . . . . . . . . . . . 6.3 tp10 -62.0 -28.06 69.3 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.29 -0.881 . . . . 1.66 110.047 -179.659 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 347' ' ' ALA . . . . . . . . . . . . . . . -61.62 -58.32 8.55 Favored 'General case' 0 N--CA 1.495 1.795 0 O-C-N 121.138 -0.976 . . . . 1.02 110.238 -179.732 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 348' ' ' LEU . . . . . 0.453 ' N ' HD23 ' B' ' 348' ' ' LEU . 3.8 mm? -61.09 -49.54 76.88 Favored 'General case' 0 N--CA 1.493 1.692 0 O-C-N 121.287 -0.883 . . . . 1.05 109.869 -179.283 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 349' ' ' GLU . . . . . . . . . . . . . 44.0 mt-10 -56.1 -32.9 64.6 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.047 -1.033 . . . . 1.95 109.617 -179.624 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 350' ' ' LEU . . . . . 0.477 HD23 HD23 ' A' ' 350' ' ' LEU . 4.0 tt -64.46 -44.38 91.26 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.245 -0.909 . . . . 1.18 109.399 179.929 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 351' ' ' LYS . . . . . . . . . . . . . 9.9 tttp -61.56 -45.32 94.65 Favored 'General case' 0 N--CA 1.488 1.45 0 O-C-N 121.337 -0.852 . . . . 1.96 109.619 179.872 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 352' ' ' ASP . . . . . 0.406 ' O ' ' HB1' ' B' ' 355' ' ' ALA . 6.3 m-20 -55.23 -37.21 66.86 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.201 -0.937 . . . . 1.16 109.602 -179.995 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 353' ' ' ALA . . . . . . . . . . . . . . . -66.44 -30.97 71.44 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.164 -0.96 . . . . 1.21 109.548 -179.75 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 354' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -82.19 -5.09 58.24 Favored 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.109 -0.994 . . . . 1.69 109.552 -179.962 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 355' ' ' ALA . . . . . 0.406 ' HB1' ' O ' ' B' ' 352' ' ' ASP . . . -71.43 -5.9 36.32 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.134 -0.979 . . . . 1.3 109.575 179.926 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 356' ' ' GLY . . . . . . . . . . . . . . . -80.28 3.28 73.08 Favored Glycine 0 N--CA 1.489 2.192 0 N-CA-C 109.813 -1.315 . . . . 1.29 109.813 -179.945 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 357' ' ' LYS . . . . . . . . . . . . . 1.7 mtpp -86.91 104.01 15.84 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.051 -1.264 . . . . 4.45 109.471 179.985 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 358' ' ' GLU . . . . . 0.569 ' N ' ' HD2' ' B' ' 359' ' ' PRO . 3.4 tt0 -51.13 -53.08 52.5 Favored Pre-proline 0 C--N 1.302 -1.488 0 O-C-N 121.191 -0.943 . . . . 5.72 109.834 179.979 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 359' ' ' PRO . . . . . 0.569 ' HD2' ' N ' ' B' ' 358' ' ' GLU . 2.7 Cg_endo -61.32 -47.39 12.13 Favored 'Trans proline' 0 C--N 1.311 -1.396 0 C-N-CA 121.859 1.706 . . . . 5.6 110.135 -179.795 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 360' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.234 0 N-CA-C 109.326 -1.51 . . . . 6.98 109.326 -179.947 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' C' C ' 319' ' ' LYS . . . . . 0.463 ' O ' ' O ' ' C' ' 320' ' ' LYS . 0.0 OUTLIER . . . . . 0 N--CA 1.489 1.52 0 N-CA-C 109.332 -0.618 . . . . 7.03 109.332 . . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' C' C ' 320' ' ' LYS . . . . . 0.463 ' O ' ' O ' ' C' ' 319' ' ' LYS . 0.0 OUTLIER 61.0 130.4 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.483 0 O-C-N 121.198 -0.939 . . . . 6.84 109.635 179.82 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' C' C ' 321' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -157.58 79.54 3.41 Favored Pre-proline 0 N--CA 1.489 1.478 0 O-C-N 121.238 -0.914 . . . . 6.78 109.335 179.977 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' C' C ' 322' ' ' PRO . . . . . . . . . . . . . 5.4 Cg_exo -58.32 174.75 0.65 Allowed 'Trans proline' 0 C--N 1.308 -1.567 0 C-N-CA 121.96 1.774 . . . . 3.98 109.98 179.964 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 323' ' ' LEU . . . . . . . . . . . . . 87.0 mt -78.66 142.43 37.17 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.131 -0.98 . . . . 4.31 109.415 -179.844 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 324' ' ' ASP . . . . . 0.424 ' HB3' ' OH ' ' C' ' 327' ' ' TYR . 1.6 m-20 -79.82 149.33 31.06 Favored 'General case' 0 N--CA 1.489 1.5 0 O-C-N 121.343 -0.848 . . . . 1.63 109.299 179.99 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' C' C ' 325' ' ' GLY . . . . . . . . . . . . . . . -68.75 -173.28 8.28 Favored Glycine 0 N--CA 1.49 2.242 0 N-CA-C 109.876 -1.29 . . . . 0.82 109.876 -179.557 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 326' ' ' GLU . . . . . . . . . . . . . 3.1 mt-10 -58.1 -179.56 0.06 Allowed 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.255 -1.144 . . . . 2.17 109.635 -179.968 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 327' ' ' TYR . . . . . 0.594 ' CE1' ' CG ' ' A' ' 333' ' ' ARG . 38.2 m-85 -149.14 111.45 4.69 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.412 -0.805 . . . . 1.03 109.512 179.823 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' C' C ' 328' ' ' PHE . . . . . . . . . . . . . 93.8 m-85 -113.47 -170.17 1.64 Allowed 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.2 -0.938 . . . . 0.37 109.578 -179.941 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 329' ' ' THR . . . . . . . . . . . . . 6.3 p -153.28 161.78 42.01 Favored 'General case' 0 N--CA 1.491 1.609 0 N-CA-C 108.807 -0.812 . . . . 1.04 108.807 179.84 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 330' ' ' LEU . . . . . . . . . . . . . 15.7 tp -150.46 130.01 13.05 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.0 -1.063 . . . . 1.09 110.609 -179.027 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 331' ' ' GLN . . . . . . . . . . . . . 1.8 tp60 -89.32 116.0 27.21 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.394 -0.816 . . . . 1.48 108.938 178.885 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 332' ' ' ILE . . . . . 0.419 HG22 ' CD2' ' C' ' 341' ' ' PHE . 58.5 mt -103.7 115.04 44.91 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.695 0 O-C-N 121.011 -1.056 . . . . 1.08 109.984 -179.569 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' C' C ' 333' ' ' ARG . . . . . 0.588 ' HG2' ' CE1' ' A' ' 327' ' ' TYR . 0.7 OUTLIER -72.61 146.64 46.5 Favored 'General case' 0 N--CA 1.489 1.494 0 O-C-N 121.319 -0.863 . . . . 3.36 109.223 179.58 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' C' C ' 334' ' ' GLY . . . . . . . . . . . . . . . 84.43 127.79 1.6 Allowed Glycine 0 N--CA 1.49 2.272 0 N-CA-C 109.896 -1.282 . . . . 0.35 109.896 179.759 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 335' ' ' ARG . . . . . 0.405 ' O ' ' HB3' ' C' ' 338' ' ' PHE . 62.4 ttt180 -78.5 -32.97 48.4 Favored 'General case' 0 C--N 1.301 -1.501 0 O-C-N 121.331 -1.099 . . . . 3.23 109.271 179.634 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' C' C ' 336' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -57.74 -62.03 2.09 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.355 -0.841 . . . . 2.62 110.027 -179.702 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' C' C ' 337' ' ' ARG . . . . . . . . . . . . . 1.1 mpt_? -60.43 -26.54 66.8 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.287 -0.883 . . . . 3.61 109.905 -179.427 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 338' ' ' PHE . . . . . 0.405 ' HB3' ' O ' ' C' ' 335' ' ' ARG . 76.1 t80 -55.89 -58.95 5.71 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.236 -0.915 . . . . 0.43 109.855 -179.899 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' C' C ' 339' ' ' GLU . . . . . . . . . . . . . 10.2 mm-40 -51.64 -34.51 38.21 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.309 -0.87 . . . . 2.05 109.884 -179.537 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 340' ' ' MET . . . . . . . . . . . . . 33.4 ttp -64.43 -49.53 71.11 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.22 -0.925 . . . . 1.1 109.898 -179.665 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 341' ' ' PHE . . . . . 0.419 ' CD2' HG22 ' C' ' 332' ' ' ILE . 41.2 m-85 -60.78 -39.54 89.19 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.177 -0.952 . . . . 0.21 109.848 -179.505 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' C' C ' 342' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -51.77 -45.83 63.9 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.119 -0.988 . . . . 3.42 109.835 179.879 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' C' C ' 343' ' ' GLU . . . . . . . . . . . . . 2.3 tp10 -59.17 -47.77 84.09 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.309 -0.869 . . . . 2.14 110.486 -179.267 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 344' ' ' LEU . . . . . . . . . . . . . 30.2 mt -61.62 -35.0 76.65 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.034 -1.041 . . . . 1.09 110.159 -179.376 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 345' ' ' ASN . . . . . 0.424 ' HA ' ' CZ ' ' A' ' 341' ' ' PHE . 50.4 t-20 -58.17 -59.76 4.8 Favored 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.245 -0.91 . . . . 1.38 110.217 -179.506 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' C' C ' 346' ' ' GLU . . . . . . . . . . . . . 2.6 tt0 -60.55 -22.95 64.22 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.183 -0.948 . . . . 2.21 110.168 -179.375 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 347' ' ' ALA . . . . . . . . . . . . . . . -61.52 -57.47 12.0 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.124 -0.985 . . . . 1.03 110.159 -179.657 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 348' ' ' LEU . . . . . 0.432 HD23 ' N ' ' C' ' 348' ' ' LEU . 4.2 mm? -61.83 -52.92 62.19 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.267 -0.896 . . . . 1.06 110.272 -179.165 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' C' C ' 349' ' ' GLU . . . . . . . . . . . . . 21.4 mm-40 -55.75 -31.29 62.42 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.157 -0.964 . . . . 2.19 109.995 -179.195 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 350' ' ' LEU . . . . . 0.586 ' CD1' ' CD1' ' D' ' 350' ' ' LEU . 0.3 OUTLIER -65.22 -49.24 70.46 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.126 -0.984 . . . . 1.2 109.342 -179.91 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' C' C ' 351' ' ' LYS . . . . . 0.437 ' N ' ' CD1' ' C' ' 350' ' ' LEU . 9.6 tttt -61.4 -44.19 97.57 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.322 -0.861 . . . . 1.92 109.744 179.696 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' C' C ' 352' ' ' ASP . . . . . . . . . . . . . 77.8 m-20 -55.98 -31.48 63.06 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.47 -0.769 . . . . 1.19 110.182 -179.53 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 353' ' ' ALA . . . . . . . . . . . . . . . -64.68 -40.41 95.35 Favored 'General case' 0 N--CA 1.489 1.493 0 O-C-N 121.066 -1.021 . . . . 1.15 109.441 -179.676 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 354' ' ' GLN . . . . . 0.497 ' NE2' HD12 ' D' ' 350' ' ' LEU . 24.9 mt-30 -83.5 -4.49 58.57 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.049 -1.032 . . . . 1.7 110.085 -179.943 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' C' C ' 355' ' ' ALA . . . . . . . . . . . . . . . -72.59 -4.8 32.99 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.152 -0.968 . . . . 1.3 110.027 -179.815 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 356' ' ' GLY . . . . . . . . . . . . . . . -77.84 -77.58 0.83 Allowed Glycine 0 N--CA 1.493 2.448 0 N-CA-C 109.951 -1.26 . . . . 1.33 109.951 -179.645 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 357' ' ' LYS . . . . . . . . . . . . . 51.4 pttt -85.18 27.08 0.82 Allowed 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.293 -1.122 . . . . 4.39 109.956 -179.641 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 358' ' ' GLU . . . . . . . . . . . . . 6.9 tm-20 -47.95 112.78 2.35 Favored Pre-proline 0 N--CA 1.49 1.556 0 O-C-N 121.092 -1.005 . . . . 5.75 109.426 179.86 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 359' ' ' PRO . . . . . . . . . . . . . 2.3 Cg_endo -62.43 112.29 1.54 Allowed 'Trans proline' 0 C--N 1.313 -1.316 0 C-N-CA 122.053 1.835 . . . . 5.54 110.137 -179.786 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 360' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.336 0 CA-C-O 117.966 -1.463 . . . . 6.5 109.647 -179.929 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' D' D ' 319' ' ' LYS . . . . . 0.421 ' O ' ' HB2' ' D' ' 320' ' ' LYS . 1.1 mmpt? . . . . . 0 N--CA 1.492 1.652 0 N-CA-C 109.337 -0.616 . . . . 7.93 109.337 . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' D' D ' 320' ' ' LYS . . . . . 0.421 ' HB2' ' O ' ' D' ' 319' ' ' LYS . 31.7 mttp 59.87 -89.17 0.02 OUTLIER 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.223 -0.923 . . . . 6.7 109.692 179.894 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' D' D ' 321' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -156.51 76.94 4.35 Favored Pre-proline 0 N--CA 1.493 1.717 0 O-C-N 121.149 -0.969 . . . . 6.49 109.364 179.974 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' D' D ' 322' ' ' PRO . . . . . . . . . . . . . 2.5 Cg_endo -62.49 109.41 0.86 Allowed 'Trans proline' 0 C--N 1.312 -1.372 0 C-N-CA 122.248 1.966 . . . . 3.29 110.768 -179.864 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' D' D ' 323' ' ' LEU . . . . . . . . . . . . . 34.3 mt -81.33 112.61 18.78 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.137 -0.977 . . . . 3.16 109.383 179.689 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' D' D ' 324' ' ' ASP . . . . . . . . . . . . . 25.2 m-20 -81.35 107.52 14.2 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.124 -0.985 . . . . 1.54 109.218 179.854 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' D' D ' 325' ' ' GLY . . . . . 0.571 ' O ' ' CD2' ' D' ' 327' ' ' TYR . . . -68.15 -169.3 5.0 Favored Glycine 0 N--CA 1.491 2.331 0 N-CA-C 109.484 -1.446 . . . . 0.65 109.484 -179.915 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' D' D ' 326' ' ' GLU . . . . . 0.437 ' HB3' ' CE2' ' D' ' 328' ' ' PHE . 48.1 mm-40 -58.93 163.51 3.43 Favored 'General case' 0 N--CA 1.487 1.399 0 O-C-N 121.235 -1.156 . . . . 2.13 109.123 179.824 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' D' D ' 327' ' ' TYR . . . . . 0.597 ' CE1' ' CG ' ' B' ' 333' ' ' ARG . 41.8 m-85 -149.16 106.21 3.59 Favored 'General case' 0 C--N 1.302 -1.467 0 O-C-N 121.203 -0.935 . . . . 1.0 109.385 179.814 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' D' D ' 328' ' ' PHE . . . . . 0.491 ' CE2' ' HA ' ' B' ' 335' ' ' ARG . 87.8 m-85 -113.09 -166.39 1.08 Allowed 'General case' 0 N--CA 1.488 1.456 0 O-C-N 121.298 -0.876 . . . . 0.34 109.623 -179.557 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' D' D ' 329' ' ' THR . . . . . . . . . . . . . 35.2 p -153.51 160.32 42.48 Favored 'General case' 0 N--CA 1.488 1.464 0 O-C-N 121.345 -0.847 . . . . 1.05 109.012 -179.544 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' D' D ' 330' ' ' LEU . . . . . . . . . . . . . 23.4 tp -151.05 129.6 12.2 Favored 'General case' 0 N--CA 1.488 1.475 0 O-C-N 121.152 -0.968 . . . . 1.07 109.639 -179.677 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' D' D ' 331' ' ' GLN . . . . . . . . . . . . . 1.3 tt0 -88.44 114.54 25.16 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.367 -0.833 . . . . 0.93 109.271 179.865 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' D' D ' 332' ' ' ILE . . . . . . . . . . . . . 38.5 mt -103.52 111.7 34.24 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.447 0 O-C-N 121.094 -1.004 . . . . 1.07 109.849 -179.604 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' D' D ' 333' ' ' ARG . . . . . 0.622 ' CG ' ' CE1' ' B' ' 327' ' ' TYR . 0.0 OUTLIER -73.11 148.9 43.52 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.291 -0.88 . . . . 3.42 109.527 179.803 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' D' D ' 334' ' ' GLY . . . . . . . . . . . . . . . 84.97 131.94 2.48 Favored Glycine 0 N--CA 1.492 2.37 0 N-CA-C 109.567 -1.413 . . . . 0.41 109.567 179.988 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' D' D ' 335' ' ' ARG . . . . . 0.522 ' HA ' ' CE2' ' B' ' 328' ' ' PHE . 39.7 ttt180 -78.75 -40.66 32.78 Favored 'General case' 0 N--CA 1.49 1.525 0 O-C-N 121.158 -1.201 . . . . 3.58 109.558 -179.821 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' D' D ' 336' ' ' GLU . . . . . . . . . . . . . 3.7 pt-20 -58.18 -53.28 60.02 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.173 -0.955 . . . . 2.26 110.001 -179.566 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' D' D ' 337' ' ' ARG . . . . . . . . . . . . . 12.9 mmt180 -61.79 -35.98 79.76 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.182 -0.949 . . . . 3.64 109.795 -179.719 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' D' D ' 338' ' ' PHE . . . . . . . . . . . . . 80.5 t80 -54.73 -56.66 16.9 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.145 -0.972 . . . . 0.4 110.054 -179.65 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' D' D ' 339' ' ' GLU . . . . . . . . . . . . . 43.4 mt-10 -52.26 -35.9 51.19 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.214 -0.929 . . . . 1.99 110.337 -179.565 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' D' D ' 340' ' ' MET . . . . . . . . . . . . . 46.9 ttp -62.97 -48.03 80.62 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 120.989 -1.069 . . . . 1.13 109.83 -179.454 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' D' D ' 341' ' ' PHE . . . . . . . . . . . . . 44.5 m-85 -62.83 -47.9 81.39 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.207 -0.933 . . . . 0.21 109.859 -179.752 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' D' D ' 342' ' ' ARG . . . . . . . . . . . . . 16.7 ttt180 -48.98 -42.26 37.05 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.374 -0.829 . . . . 3.15 110.104 -179.544 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' D' D ' 343' ' ' GLU . . . . . . . . . . . . . 4.2 tp10 -59.12 -48.95 79.73 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.037 -1.039 . . . . 2.35 109.845 -179.692 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' D' D ' 344' ' ' LEU . . . . . . . . . . . . . 39.0 mt -60.95 -33.03 72.56 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.097 -1.002 . . . . 1.06 109.741 -179.68 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' D' D ' 345' ' ' ASN . . . . . . . . . . . . . 63.2 t-20 -56.2 -54.6 43.31 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.223 -0.923 . . . . 1.35 109.739 -179.928 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' D' D ' 346' ' ' GLU . . . . . . . . . . . . . 6.6 tp10 -62.46 -27.48 69.15 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.124 -0.985 . . . . 1.69 110.101 -179.589 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' D' D ' 347' ' ' ALA . . . . . . . . . . . . . . . -62.16 -58.48 7.63 Favored 'General case' 0 N--CA 1.493 1.725 0 O-C-N 121.051 -1.03 . . . . 1.03 110.221 -179.573 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' D' D ' 348' ' ' LEU . . . . . 0.469 ' N ' HD23 ' D' ' 348' ' ' LEU . 3.8 mm? -60.8 -48.81 80.09 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.26 -0.9 . . . . 1.04 110.017 -179.321 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' D' D ' 349' ' ' GLU . . . . . . . . . . . . . 43.4 mt-10 -56.83 -33.31 66.62 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.073 -1.017 . . . . 1.95 109.594 -179.591 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' D' D ' 350' ' ' LEU . . . . . 0.586 ' CD1' ' CD1' ' C' ' 350' ' ' LEU . 4.2 tt -64.16 -44.4 92.21 Favored 'General case' 0 N--CA 1.489 1.479 0 O-C-N 121.374 -0.829 . . . . 1.16 109.243 179.968 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' D' D ' 351' ' ' LYS . . . . . . . . . . . . . 10.1 tttp -61.51 -44.78 96.45 Favored 'General case' 0 N--CA 1.489 1.486 0 O-C-N 121.393 -0.817 . . . . 1.97 109.677 -179.943 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' D' D ' 352' ' ' ASP . . . . . 0.421 ' O ' ' HB1' ' D' ' 355' ' ' ALA . 6.0 m-20 -55.96 -37.1 68.57 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.352 -0.842 . . . . 1.17 109.701 -179.795 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' D' D ' 353' ' ' ALA . . . . . . . . . . . . . . . -66.44 -30.51 70.88 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.278 -0.889 . . . . 1.21 109.722 -179.767 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' D' D ' 354' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -82.68 -5.23 58.75 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.269 -0.894 . . . . 1.68 109.603 -179.947 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' D' D ' 355' ' ' ALA . . . . . 0.421 ' HB1' ' O ' ' D' ' 352' ' ' ASP . . . -71.42 -6.04 37.33 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.153 -0.967 . . . . 1.29 109.593 179.938 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' D' D ' 356' ' ' GLY . . . . . . . . . . . . . . . -80.25 3.18 73.32 Favored Glycine 0 N--CA 1.49 2.295 0 N-CA-C 109.632 -1.387 . . . . 1.28 109.632 179.941 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' D' D ' 357' ' ' LYS . . . . . . . . . . . . . 2.0 mtpp -86.47 104.0 15.53 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.215 -1.168 . . . . 4.45 109.462 179.942 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' D' D ' 358' ' ' GLU . . . . . 0.576 ' N ' ' HD2' ' D' ' 359' ' ' PRO . 3.4 tt0 -51.22 -53.08 52.82 Favored Pre-proline 0 N--CA 1.489 1.48 0 O-C-N 121.248 -0.908 . . . . 5.71 109.811 179.8 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' D' D ' 359' ' ' PRO . . . . . 0.576 ' HD2' ' N ' ' D' ' 358' ' ' GLU . 2.5 Cg_endo -61.52 -47.92 10.52 Favored 'Trans proline' 0 C--N 1.311 -1.432 0 C-N-CA 121.791 1.661 . . . . 5.6 110.077 -179.847 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' D' D ' 360' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.488 2.145 0 CA-C-O 117.964 -1.464 . . . . 6.97 109.496 179.97 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 319' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 N--CA 1.488 1.438 0 N-CA-C 109.468 -0.567 . . . . 7.95 109.468 . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 320' ' ' LYS . . . . . 0.483 ' O ' ' CG ' ' A' ' 321' ' ' LYS . 0.1 OUTLIER 63.62 -142.44 0.33 Allowed 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.305 -0.872 . . . . 6.71 109.406 179.874 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 321' ' ' LYS . . . . . 0.483 ' CG ' ' O ' ' A' ' 320' ' ' LYS . 0.9 OUTLIER -157.76 87.75 2.51 Favored Pre-proline 0 N--CA 1.491 1.592 0 O-C-N 121.176 -0.953 . . . . 6.5 109.722 -179.611 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 322' ' ' PRO . . . . . . . . . . . . . 4.8 Cg_endo -69.29 -3.92 12.67 Favored 'Trans proline' 0 C--N 1.311 -1.416 0 C-N-CA 122.208 1.939 . . . . 3.3 110.455 179.993 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 323' ' ' LEU . . . . . . . . . . . . . 36.1 mt -79.03 100.94 7.55 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.171 -0.956 . . . . 3.16 109.331 -179.887 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 324' ' ' ASP . . . . . . . . . . . . . 10.8 m-20 -79.63 176.79 9.39 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.085 -1.009 . . . . 1.53 109.615 -179.867 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 325' ' ' GLY . . . . . . . . . . . . . . . -69.06 -176.73 13.54 Favored Glycine 0 N--CA 1.492 2.367 0 N-CA-C 109.211 -1.556 . . . . 0.67 109.211 179.654 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 326' ' ' GLU . . . . . . . . . . . . . 3.5 mt-10 -57.82 -175.82 0.02 OUTLIER 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.319 -1.107 . . . . 2.13 109.716 -179.876 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 327' ' ' TYR . . . . . 0.584 ' CE1' ' HG2' ' C' ' 333' ' ' ARG . 39.1 m-85 -149.44 109.66 4.16 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.471 -0.768 . . . . 1.0 109.613 -179.877 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 328' ' ' PHE . . . . . 0.45 ' O ' ' OE1' ' C' ' 331' ' ' GLN . 81.2 m-85 -113.01 -166.6 1.09 Allowed 'General case' 0 N--CA 1.489 1.487 0 O-C-N 121.439 -0.788 . . . . 0.34 109.293 179.658 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 329' ' ' THR . . . . . 0.435 ' HA ' ' O ' ' C' ' 330' ' ' LEU . 15.2 p -153.77 167.14 30.63 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.305 -0.872 . . . . 1.05 109.216 179.985 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 330' ' ' LEU . . . . . . . . . . . . . 15.1 tp -152.79 131.55 12.39 Favored 'General case' 0 C--N 1.303 -1.415 0 O-C-N 121.278 -0.889 . . . . 1.07 109.876 -179.698 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 331' ' ' GLN . . . . . 0.406 ' O ' ' NH2' ' A' ' 333' ' ' ARG . 1.5 tt0 -86.4 117.42 25.19 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.29 -0.881 . . . . 0.91 108.87 179.635 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 332' ' ' ILE . . . . . . . . . . . . . 61.1 mt -102.91 103.55 15.24 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.526 0 O-C-N 121.042 -1.036 . . . . 1.09 109.725 -179.796 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 333' ' ' ARG . . . . . 0.462 ' NH1' ' CG ' ' A' ' 333' ' ' ARG . 0.0 OUTLIER -69.96 145.86 51.56 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.372 -0.83 . . . . 3.41 109.123 179.659 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 334' ' ' GLY . . . . . . . . . . . . . . . 82.5 126.86 1.02 Allowed Glycine 0 N--CA 1.492 2.421 0 N-CA-C 109.654 -1.378 . . . . 0.4 109.654 -179.801 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 335' ' ' ARG . . . . . 0.451 ' O ' ' HB3' ' A' ' 338' ' ' PHE . 10.2 ttm180 -74.6 -38.5 62.59 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.387 -1.066 . . . . 3.55 109.334 179.881 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 336' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -55.54 -54.94 37.73 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.416 -0.802 . . . . 2.29 109.792 -179.555 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 337' ' ' ARG . . . . . . . . . . . . . 17.8 mtp180 -62.81 -28.65 70.15 Favored 'General case' 0 N--CA 1.496 1.835 0 O-C-N 121.381 -0.824 . . . . 3.64 109.87 179.803 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 338' ' ' PHE . . . . . 0.451 ' HB3' ' O ' ' A' ' 335' ' ' ARG . 77.9 t80 -55.05 -61.5 2.27 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.035 -1.04 . . . . 0.41 109.833 -179.453 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 339' ' ' GLU . . . . . . . . . . . . . 43.1 mt-10 -50.58 -31.75 16.69 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 120.935 -1.103 . . . . 1.97 109.769 -179.748 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 340' ' ' MET . . . . . . . . . . . . . 27.2 ttp -63.8 -55.06 25.82 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 120.991 -1.068 . . . . 1.14 110.153 -179.519 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 341' ' ' PHE . . . . . . . . . . . . . 43.5 m-85 -61.37 -53.72 53.03 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.346 -0.846 . . . . 0.21 109.647 -179.502 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 342' ' ' ARG . . . . . . . . . . . . . 5.4 ttp180 -44.52 -40.57 5.75 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.466 -0.771 . . . . 3.15 109.596 -179.866 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 343' ' ' GLU . . . . . . . . . . . . . 21.6 tt0 -58.68 -46.69 86.66 Favored 'General case' 0 N--CA 1.489 1.5 0 O-C-N 121.18 -0.95 . . . . 2.35 109.866 -179.689 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 344' ' ' LEU . . . . . 0.44 ' O ' HD21 ' A' ' 348' ' ' LEU . 49.3 mt -63.36 -45.16 92.46 Favored 'General case' 0 C--N 1.3 -1.552 0 O-C-N 121.269 -0.895 . . . . 1.06 109.988 -179.628 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 345' ' ' ASN . . . . . . . . . . . . . 34.5 t-20 -53.02 -48.93 67.18 Favored 'General case' 0 C--N 1.302 -1.478 0 O-C-N 121.247 -0.908 . . . . 1.36 109.595 -179.613 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 346' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -59.61 -36.34 76.12 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.178 -0.951 . . . . 1.65 109.514 -179.922 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 347' ' ' ALA . . . . . . . . . . . . . . . -61.05 -49.44 77.35 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.239 -0.913 . . . . 1.03 109.854 -179.924 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 348' ' ' LEU . . . . . 0.492 ' N ' ' CD2' ' A' ' 348' ' ' LEU . 4.0 mm? -61.84 -41.6 98.0 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 120.949 -1.094 . . . . 1.04 109.739 -179.729 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 349' ' ' GLU . . . . . . . . . . . . . 61.5 mt-10 -58.06 -41.02 82.47 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.231 -0.918 . . . . 1.94 110.117 -179.441 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 350' ' ' LEU . . . . . 0.526 HD21 ' CD1' ' B' ' 350' ' ' LEU . 7.7 tt -62.9 -41.43 99.44 Favored 'General case' 0 N--CA 1.488 1.461 0 O-C-N 121.109 -0.995 . . . . 1.17 109.86 -179.52 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 351' ' ' LYS . . . . . . . . . . . . . 10.5 tttt -58.04 -46.7 84.91 Favored 'General case' 0 N--CA 1.494 1.751 0 O-C-N 121.0 -1.063 . . . . 1.97 109.387 -179.741 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 352' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -55.8 -51.88 65.91 Favored 'General case' 0 N--CA 1.487 1.389 0 O-C-N 121.481 -0.762 . . . . 1.16 109.778 -179.951 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 353' ' ' ALA . . . . . . . . . . . . . . . -68.65 -14.76 63.23 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 120.964 -1.085 . . . . 1.22 109.574 -179.829 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 354' ' ' GLN . . . . . 0.529 ' NE2' ' CD1' ' B' ' 350' ' ' LEU . 0.7 OUTLIER -82.19 -1.83 50.32 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.279 -0.888 . . . . 1.71 109.611 -179.893 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 355' ' ' ALA . . . . . . . . . . . . . . . -69.82 -89.19 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.18 -0.95 . . . . 1.3 109.802 -179.92 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 356' ' ' GLY . . . . . . . . . . . . . . . -67.43 100.67 0.61 Allowed Glycine 0 N--CA 1.493 2.433 0 N-CA-C 109.656 -1.378 . . . . 1.3 109.656 -179.915 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 357' ' ' LYS . . . . . 0.432 ' O ' ' HD3' ' A' ' 359' ' ' PRO . 0.9 OUTLIER -89.44 128.17 35.92 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.177 -1.19 . . . . 4.46 109.564 179.948 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 358' ' ' GLU . . . . . . . . . . . . . 11.2 tt0 -48.27 107.66 0.79 Allowed Pre-proline 0 N--CA 1.488 1.45 0 O-C-N 121.335 -0.853 . . . . 5.75 109.04 179.337 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 359' ' ' PRO . . . . . 0.432 ' HD3' ' O ' ' A' ' 357' ' ' LYS . 1.8 Cg_endo -62.31 125.56 16.57 Favored 'Trans proline' 0 C--N 1.315 -1.204 0 C-N-CA 122.186 1.924 . . . . 5.63 109.888 179.88 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 360' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.281 0 N-CA-C 109.136 -1.586 . . . . 6.97 109.136 -179.933 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' B' B ' 319' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 N--CA 1.49 1.534 0 N-CA-C 109.536 -0.542 . . . . 7.95 109.536 . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 320' ' ' LYS . . . . . 0.451 ' O ' ' CG ' ' B' ' 321' ' ' LYS . 0.1 OUTLIER 64.13 -144.24 0.29 Allowed 'General case' 0 N--CA 1.487 1.416 0 O-C-N 121.335 -0.853 . . . . 6.73 109.456 179.942 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' B' B ' 321' ' ' LYS . . . . . 0.451 ' CG ' ' O ' ' B' ' 320' ' ' LYS . 0.8 OUTLIER -156.83 88.01 2.73 Favored Pre-proline 0 N--CA 1.492 1.657 0 O-C-N 121.234 -0.916 . . . . 6.5 109.636 -179.802 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' B' B ' 322' ' ' PRO . . . . . . . . . . . . . 4.2 Cg_endo -69.72 -1.85 9.14 Favored 'Trans proline' 0 C--N 1.31 -1.473 0 C-N-CA 122.25 1.966 . . . . 3.29 110.357 -179.888 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 323' ' ' LEU . . . . . . . . . . . . . 40.0 mt -80.17 99.92 8.02 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.109 -0.994 . . . . 3.18 109.54 -179.777 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 324' ' ' ASP . . . . . . . . . . . . . 13.1 m-20 -78.74 174.71 11.15 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.207 -0.933 . . . . 1.53 109.779 -179.835 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 325' ' ' GLY . . . . . . . . . . . . . . . -66.88 -174.75 6.58 Favored Glycine 0 N--CA 1.489 2.226 0 N-CA-C 109.533 -1.427 . . . . 0.65 109.533 179.865 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 326' ' ' GLU . . . . . . . . . . . . . 3.4 mt-10 -59.19 -174.18 0.02 OUTLIER 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.44 -1.036 . . . . 2.13 109.391 -179.902 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 327' ' ' TYR . . . . . 0.434 ' CE1' ' HG2' ' D' ' 333' ' ' ARG . 41.1 m-85 -150.35 109.72 3.98 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.444 -0.785 . . . . 0.99 109.556 179.902 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 328' ' ' PHE . . . . . . . . . . . . . 91.1 m-85 -113.41 -167.05 1.14 Allowed 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.363 -0.835 . . . . 0.36 109.399 179.999 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 329' ' ' THR . . . . . 0.439 ' HA ' ' O ' ' D' ' 330' ' ' LEU . 18.0 p -153.53 165.64 35.24 Favored 'General case' 0 N--CA 1.487 1.41 0 O-C-N 121.122 -0.987 . . . . 1.05 109.351 179.836 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 330' ' ' LEU . . . . . . . . . . . . . 14.9 tp -151.19 132.8 14.83 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.206 -0.934 . . . . 1.07 110.102 -179.685 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 331' ' ' GLN . . . . . . . . . . . . . 1.4 tt0 -87.06 117.95 26.13 Favored 'General case' 0 C--N 1.301 -1.528 0 O-C-N 121.296 -0.877 . . . . 0.91 109.067 179.496 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 332' ' ' ILE . . . . . . . . . . . . . 56.4 mt -103.02 104.89 17.29 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.5 0 O-C-N 121.14 -0.975 . . . . 1.08 109.664 179.813 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 333' ' ' ARG . . . . . 0.468 ' CG ' ' NH1' ' B' ' 333' ' ' ARG . 0.0 OUTLIER -70.76 145.44 50.43 Favored 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.385 -0.822 . . . . 3.42 108.927 179.602 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' B' B ' 334' ' ' GLY . . . . . . . . . . . . . . . 81.62 131.18 1.27 Allowed Glycine 0 N--CA 1.491 2.303 0 N-CA-C 109.264 -1.534 . . . . 0.4 109.264 -179.685 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 335' ' ' ARG . . . . . 0.462 ' O ' ' HB3' ' B' ' 338' ' ' PHE . 9.9 ttm180 -77.5 -38.14 49.62 Favored 'General case' 0 N--CA 1.489 1.48 0 O-C-N 121.283 -1.128 . . . . 3.55 109.472 -179.931 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 336' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -56.38 -54.48 45.11 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.362 -0.837 . . . . 2.28 109.382 -179.924 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 337' ' ' ARG . . . . . . . . . . . . . 18.6 mtp180 -62.19 -28.49 69.71 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.189 -0.944 . . . . 3.64 109.944 -179.987 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 338' ' ' PHE . . . . . 0.462 ' HB3' ' O ' ' B' ' 335' ' ' ARG . 80.2 t80 -55.85 -61.18 2.54 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 120.985 -1.072 . . . . 0.39 109.848 -179.617 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 339' ' ' GLU . . . . . . . . . . . . . 35.8 mt-10 -50.44 -32.84 18.96 Favored 'General case' 0 N--CA 1.494 1.77 0 O-C-N 121.241 -0.912 . . . . 1.98 109.846 -179.6 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 340' ' ' MET . . . . . . . . . . . . . 27.0 ttp -63.08 -54.42 38.33 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.265 -0.897 . . . . 1.14 109.921 -179.725 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 341' ' ' PHE . . . . . 0.416 ' O ' ' C ' ' B' ' 342' ' ' ARG . 45.0 m-85 -62.28 -54.06 46.1 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.464 -0.772 . . . . 0.22 109.826 -179.721 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 342' ' ' ARG . . . . . 0.416 ' C ' ' O ' ' B' ' 341' ' ' PHE . 4.4 ttp180 -45.0 -39.14 5.31 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 120.926 -1.108 . . . . 3.15 109.768 -179.954 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 343' ' ' GLU . . . . . . . . . . . . . 20.1 tt0 -58.68 -47.6 83.94 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.111 -0.993 . . . . 2.35 109.568 -179.911 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 344' ' ' LEU . . . . . 0.439 ' O ' HD21 ' B' ' 348' ' ' LEU . 48.0 mt -63.27 -45.25 92.33 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.047 -1.033 . . . . 1.05 110.244 -179.628 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 345' ' ' ASN . . . . . . . . . . . . . 36.8 t-20 -52.79 -48.12 67.09 Favored 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.28 -0.887 . . . . 1.35 109.666 -179.316 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 346' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -60.48 -35.64 76.39 Favored 'General case' 0 N--CA 1.488 1.447 0 O-C-N 121.021 -1.049 . . . . 1.66 109.465 179.882 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 347' ' ' ALA . . . . . . . . . . . . . . . -61.72 -48.88 78.75 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.145 -0.972 . . . . 1.02 110.406 -179.732 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 348' ' ' LEU . . . . . 0.511 ' CD2' ' N ' ' B' ' 348' ' ' LEU . 3.8 mm? -63.0 -40.85 99.0 Favored 'General case' 0 N--CA 1.495 1.818 0 O-C-N 121.263 -0.898 . . . . 1.05 109.661 -179.647 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 349' ' ' GLU . . . . . . . . . . . . . 64.5 mt-10 -58.32 -41.54 84.79 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.264 -0.898 . . . . 1.95 110.254 -179.863 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 350' ' ' LEU . . . . . 0.529 ' CD1' ' NE2' ' A' ' 354' ' ' GLN . 8.6 tt -61.93 -41.65 98.2 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.067 -1.021 . . . . 1.18 109.969 -179.428 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 351' ' ' LYS . . . . . . . . . . . . . 10.9 tttt -57.9 -47.02 84.03 Favored 'General case' 0 C--N 1.3 -1.577 0 O-C-N 121.084 -1.01 . . . . 1.96 109.425 179.952 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 352' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -55.28 -50.62 69.06 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 120.917 -1.114 . . . . 1.16 109.835 -179.9 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 353' ' ' ALA . . . . . . . . . . . . . . . -69.26 -16.0 63.49 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 121.284 -0.885 . . . . 1.21 109.667 -179.853 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 354' ' ' GLN . . . . . 0.42 ' NE2' ' CD1' ' A' ' 350' ' ' LEU . 1.0 OUTLIER -81.94 -2.71 52.29 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.263 -0.898 . . . . 1.69 109.892 -179.808 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' B' B ' 355' ' ' ALA . . . . . . . . . . . . . . . -69.31 -89.46 0.01 OUTLIER 'General case' 0 N--CA 1.493 1.717 0 O-C-N 121.321 -0.862 . . . . 1.3 109.818 -179.568 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 356' ' ' GLY . . . . . . . . . . . . . . . -67.1 100.3 0.57 Allowed Glycine 0 N--CA 1.492 2.39 0 N-CA-C 109.686 -1.366 . . . . 1.29 109.686 -179.79 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 357' ' ' LYS . . . . . 0.455 ' O ' ' HD3' ' B' ' 359' ' ' PRO . 0.5 OUTLIER -88.94 127.34 35.65 Favored 'General case' 0 N--CA 1.494 1.731 0 O-C-N 121.4 -1.059 . . . . 4.45 109.685 -179.989 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' B' B ' 358' ' ' GLU . . . . . . . . . . . . . 10.9 tt0 -48.17 106.78 0.64 Allowed Pre-proline 0 N--CA 1.49 1.541 0 O-C-N 121.518 -0.739 . . . . 5.72 109.029 179.687 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 359' ' ' PRO . . . . . 0.455 ' HD3' ' O ' ' B' ' 357' ' ' LYS . 2.2 Cg_endo -60.9 124.89 15.84 Favored 'Trans proline' 0 C--N 1.314 -1.276 0 C-N-CA 122.067 1.845 . . . . 5.6 110.292 -179.83 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 360' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.17 0 CA-C-O 118.084 -1.398 . . . . 6.98 109.643 -179.91 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' C' C ' 319' ' ' LYS . . . . . . . . . . . . . 11.5 mmtp . . . . . 0 N--CA 1.489 1.496 0 N-CA-C 109.437 -0.579 . . . . 7.03 109.437 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' C' C ' 320' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 60.12 -88.84 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.174 -0.953 . . . . 6.84 109.674 179.934 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' C' C ' 321' ' ' LYS . . . . . . . . . . . . . 1.9 mttp -161.06 86.21 1.75 Allowed Pre-proline 0 N--CA 1.491 1.596 0 O-C-N 121.304 -0.873 . . . . 6.78 110.163 -179.665 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 322' ' ' PRO . . . . . . . . . . . . . 3.9 Cg_exo -61.08 -152.69 0.01 OUTLIER 'Trans proline' 0 C--N 1.311 -1.438 0 C-N-CA 122.247 1.965 . . . . 3.98 110.135 179.665 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 323' ' ' LEU . . . . . . . . . . . . . 95.1 mt -77.57 107.66 10.19 Favored 'General case' 0 N--CA 1.489 1.492 0 O-C-N 121.295 -0.878 . . . . 4.31 109.168 179.898 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 324' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -80.39 128.99 34.21 Favored 'General case' 0 N--CA 1.488 1.439 0 O-C-N 121.33 -0.856 . . . . 1.63 109.537 -179.745 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 325' ' ' GLY . . . . . 0.561 ' O ' ' CE2' ' C' ' 327' ' ' TYR . . . -66.72 178.59 14.81 Favored Glycine 0 N--CA 1.491 2.326 0 N-CA-C 108.952 -1.659 . . . . 0.82 108.952 179.781 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' C' C ' 326' ' ' GLU . . . . . . . . . . . . . 8.0 mm-40 -56.88 179.05 0.05 OUTLIER 'General case' 0 C--N 1.303 -1.445 0 O-C-N 120.717 -1.46 . . . . 2.17 108.938 179.893 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 327' ' ' TYR . . . . . 0.561 ' CE2' ' O ' ' C' ' 325' ' ' GLY . 47.9 m-85 -149.78 109.46 4.04 Favored 'General case' 0 C--N 1.3 -1.561 0 O-C-N 121.014 -1.054 . . . . 1.03 110.139 -179.804 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' C' C ' 328' ' ' PHE . . . . . . . . . . . . . 77.4 m-85 -110.72 -167.79 1.23 Allowed 'General case' 0 N--CA 1.491 1.59 0 N-CA-C 108.886 -0.783 . . . . 0.37 108.886 179.742 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 329' ' ' THR . . . . . . . . . . . . . 6.4 p -151.77 160.12 43.69 Favored 'General case' 0 C--N 1.302 -1.486 0 O-C-N 121.052 -1.03 . . . . 1.04 109.312 -179.779 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 330' ' ' LEU . . . . . 0.435 ' O ' ' HA ' ' A' ' 329' ' ' THR . 21.8 tp -149.32 126.87 11.61 Favored 'General case' 0 N--CA 1.494 1.771 0 O-C-N 121.083 -1.01 . . . . 1.09 109.833 -179.674 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' C' C ' 331' ' ' GLN . . . . . 0.45 ' OE1' ' O ' ' A' ' 328' ' ' PHE . 0.7 OUTLIER -87.14 120.99 28.99 Favored 'General case' 0 N--CA 1.496 1.851 0 O-C-N 121.437 -0.79 . . . . 1.48 109.578 179.904 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' C' C ' 332' ' ' ILE . . . . . 0.468 HG23 ' HA ' ' C' ' 338' ' ' PHE . 15.2 mt -103.88 111.1 32.25 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.854 0 O-C-N 121.023 -1.048 . . . . 1.08 109.843 179.762 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' C' C ' 333' ' ' ARG . . . . . 0.584 ' HG2' ' CE1' ' A' ' 327' ' ' TYR . 4.4 mtp180 -72.06 137.66 47.29 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.351 -0.843 . . . . 3.36 109.332 179.709 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' C' C ' 334' ' ' GLY . . . . . . . . . . . . . . . 90.94 137.0 7.01 Favored Glycine 0 N--CA 1.491 2.303 0 N-CA-C 109.82 -1.312 . . . . 0.35 109.82 179.709 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 335' ' ' ARG . . . . . 0.407 ' HA ' ' CE1' ' A' ' 328' ' ' PHE . 3.1 ttt180 -80.09 -38.9 30.76 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.272 -1.134 . . . . 3.23 109.31 179.929 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' C' C ' 336' ' ' GLU . . . . . 0.411 ' HA ' ' OE1' ' C' ' 339' ' ' GLU . 1.7 tm-20 -58.91 -52.8 64.18 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.569 -0.707 . . . . 2.62 109.391 179.992 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' C' C ' 337' ' ' ARG . . . . . . . . . . . . . 34.9 mtp180 -60.91 -34.66 75.02 Favored 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.33 -0.856 . . . . 3.61 109.324 179.975 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 338' ' ' PHE . . . . . 0.468 ' HA ' HG23 ' C' ' 332' ' ' ILE . 57.5 t80 -53.57 -65.21 0.6 Allowed 'General case' 0 N--CA 1.487 1.403 0 O-C-N 121.264 -0.898 . . . . 0.43 109.745 -179.735 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' C' C ' 339' ' ' GLU . . . . . 0.411 ' OE1' ' HA ' ' C' ' 336' ' ' GLU . 3.2 mp0 -47.13 -34.84 6.46 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.249 -0.907 . . . . 2.05 110.375 -179.217 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' C' C ' 340' ' ' MET . . . . . . . . . . . . . 15.2 ttp -63.92 -53.4 50.98 Favored 'General case' 0 C--N 1.301 -1.51 0 O-C-N 120.841 -1.162 . . . . 1.1 110.034 -179.208 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 341' ' ' PHE . . . . . 0.427 ' CB ' HD12 ' C' ' 332' ' ' ILE . 40.6 m-85 -61.29 -44.92 96.42 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.032 -1.043 . . . . 0.21 109.614 -179.581 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' C' C ' 342' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -50.5 -45.52 56.51 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.213 -0.929 . . . . 3.42 110.41 -179.699 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' C' C ' 343' ' ' GLU . . . . . . . . . . . . . 5.1 tt0 -57.34 -43.58 83.52 Favored 'General case' 0 N--CA 1.489 1.497 0 O-C-N 121.331 -0.856 . . . . 2.14 109.786 -179.431 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 344' ' ' LEU . . . . . 0.454 ' O ' HD21 ' C' ' 348' ' ' LEU . 41.3 mt -62.64 -46.93 85.95 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.192 -0.942 . . . . 1.09 109.779 179.945 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' C' C ' 345' ' ' ASN . . . . . . . . . . . . . 31.2 t-20 -55.22 -49.48 71.87 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.287 -0.883 . . . . 1.38 109.896 -179.499 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 346' ' ' GLU . . . . . . . . . . . . . 13.6 tp10 -58.18 -35.95 72.35 Favored 'General case' 0 N--CA 1.489 1.5 0 O-C-N 121.098 -1.001 . . . . 2.21 109.713 -179.556 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 347' ' ' ALA . . . . . . . . . . . . . . . -61.49 -47.0 87.61 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.03 -1.044 . . . . 1.03 109.802 -179.931 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 348' ' ' LEU . . . . . 0.471 ' N ' ' CD2' ' C' ' 348' ' ' LEU . 4.2 mm? -62.83 -48.44 79.08 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.104 -0.998 . . . . 1.06 110.401 -179.552 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' C' C ' 349' ' ' GLU . . . . . . . . . . . . . 33.4 mt-10 -57.7 -36.53 72.1 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.151 -0.968 . . . . 2.19 109.878 -179.176 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 350' ' ' LEU . . . . . 0.497 HD22 ' CD1' ' D' ' 350' ' ' LEU . 3.9 tt -62.05 -40.07 94.53 Favored 'General case' 0 N--CA 1.489 1.482 0 O-C-N 121.312 -0.867 . . . . 1.2 109.424 -179.87 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' C' C ' 351' ' ' LYS . . . . . 0.418 ' N ' HD21 ' C' ' 350' ' ' LEU . 12.3 tttt -58.72 -37.83 77.0 Favored 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.147 -0.97 . . . . 1.92 109.084 -179.929 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' C' C ' 352' ' ' ASP . . . . . . . . . . . . . 49.0 m-20 -55.1 -54.97 36.41 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.29 -0.881 . . . . 1.19 109.556 179.519 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 353' ' ' ALA . . . . . . . . . . . . . . . -68.55 -12.71 61.65 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.351 -0.843 . . . . 1.15 109.544 -179.85 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 354' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -81.36 -6.86 59.35 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.222 -0.924 . . . . 1.7 109.611 -179.853 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' C' C ' 355' ' ' ALA . . . . . . . . . . . . . . . -66.74 -86.51 0.02 OUTLIER 'General case' 0 C--N 1.302 -1.461 0 O-C-N 121.243 -0.911 . . . . 1.3 109.429 179.886 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 356' ' ' GLY . . . . . . . . . . . . . . . -77.07 104.12 1.88 Allowed Glycine 0 N--CA 1.491 2.355 0 N-CA-C 109.399 -1.48 . . . . 1.33 109.399 -179.907 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 357' ' ' LYS . . . . . . . . . . . . . 14.9 mttt -87.7 103.92 16.05 Favored 'General case' 0 N--CA 1.487 1.419 0 O-C-N 121.223 -1.163 . . . . 4.39 109.003 179.824 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 358' ' ' GLU . . . . . 0.573 ' CB ' ' HD3' ' C' ' 359' ' ' PRO . 3.7 mt-10 -50.02 -60.11 5.74 Favored Pre-proline 0 N--CA 1.492 1.66 0 O-C-N 121.414 -0.804 . . . . 5.75 109.767 -179.61 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' C' C ' 359' ' ' PRO . . . . . 0.573 ' HD3' ' CB ' ' C' ' 358' ' ' GLU . 5.3 Cg_exo -59.01 -154.06 0.01 OUTLIER 'Trans proline' 0 C--N 1.312 -1.393 0 C-N-CA 121.977 1.785 . . . . 5.54 110.377 179.821 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' C' C ' 360' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.364 0 CA-C-O 117.955 -1.47 . . . . 6.5 109.428 179.878 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' D' D ' 319' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 N--CA 1.491 1.587 0 CA-C-O 121.143 0.497 . . . . 7.93 109.679 . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' D' D ' 320' ' ' LYS . . . . . 0.52 ' O ' ' CG ' ' D' ' 321' ' ' LYS . 0.1 OUTLIER 62.98 -144.39 0.36 Allowed 'General case' 0 C--N 1.301 -1.513 0 O-C-N 121.094 -1.004 . . . . 6.7 109.718 179.524 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' D' D ' 321' ' ' LYS . . . . . 0.52 ' CG ' ' O ' ' D' ' 320' ' ' LYS . 0.3 OUTLIER -158.74 88.77 2.19 Favored Pre-proline 0 N--CA 1.488 1.436 0 O-C-N 121.106 -0.996 . . . . 6.49 109.458 -179.657 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' D' D ' 322' ' ' PRO . . . . . . . . . . . . . 2.5 Cg_endo -69.45 -1.54 8.4 Favored 'Trans proline' 0 C--N 1.312 -1.384 0 C-N-CA 122.292 1.995 . . . . 3.29 110.546 179.666 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' D' D ' 323' ' ' LEU . . . . . . . . . . . . . 38.4 mt -79.55 100.15 7.62 Favored 'General case' 0 N--CA 1.488 1.474 0 O-C-N 121.033 -1.042 . . . . 3.16 109.384 -179.789 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' D' D ' 324' ' ' ASP . . . . . . . . . . . . . 17.9 m-20 -78.81 175.01 10.88 Favored 'General case' 0 N--CA 1.493 1.722 0 O-C-N 121.466 -0.772 . . . . 1.54 109.529 -179.983 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' D' D ' 325' ' ' GLY . . . . . . . . . . . . . . . -67.76 -174.14 7.54 Favored Glycine 0 N--CA 1.491 2.364 0 N-CA-C 109.655 -1.378 . . . . 0.65 109.655 -179.893 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' D' D ' 326' ' ' GLU . . . . . . . . . . . . . 3.4 mt-10 -59.59 -175.26 0.03 OUTLIER 'General case' 0 N--CA 1.489 1.491 0 O-C-N 121.276 -1.132 . . . . 2.13 109.723 -179.899 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' D' D ' 327' ' ' TYR . . . . . . . . . . . . . 40.5 m-85 -149.39 109.88 4.22 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.277 -0.89 . . . . 1.0 109.541 -179.695 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' D' D ' 328' ' ' PHE . . . . . . . . . . . . . 94.9 m-85 -113.29 -166.83 1.12 Allowed 'General case' 0 N--CA 1.488 1.469 0 O-C-N 121.213 -0.929 . . . . 0.34 109.38 179.986 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' D' D ' 329' ' ' THR . . . . . . . . . . . . . 19.1 p -154.1 165.05 37.44 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.248 -0.907 . . . . 1.05 109.517 179.875 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' D' D ' 330' ' ' LEU . . . . . 0.439 ' O ' ' HA ' ' B' ' 329' ' ' THR . 14.7 tp -150.69 132.56 15.08 Favored 'General case' 0 N--CA 1.487 1.413 0 O-C-N 121.029 -1.044 . . . . 1.07 109.997 -179.463 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' D' D ' 331' ' ' GLN . . . . . . . . . . . . . 1.3 tt0 -86.21 117.14 24.84 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.234 -0.916 . . . . 0.93 108.576 179.402 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' D' D ' 332' ' ' ILE . . . . . . . . . . . . . 63.7 mt -102.65 104.2 16.17 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.618 0 O-C-N 121.162 -0.961 . . . . 1.07 109.584 -179.923 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' D' D ' 333' ' ' ARG . . . . . 0.445 ' CG ' ' NH1' ' D' ' 333' ' ' ARG . 0.0 OUTLIER -70.19 146.49 50.71 Favored 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.422 -0.799 . . . . 3.42 109.477 179.869 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' D' D ' 334' ' ' GLY . . . . . . . . . . . . . . . 80.33 130.93 0.94 Allowed Glycine 0 N--CA 1.491 2.363 0 N-CA-C 109.533 -1.427 . . . . 0.41 109.533 -179.77 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' D' D ' 335' ' ' ARG . . . . . 0.466 ' O ' ' HB3' ' D' ' 338' ' ' PHE . 9.8 ttm180 -77.66 -36.33 51.47 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.104 -1.233 . . . . 3.58 109.572 -179.753 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' D' D ' 336' ' ' GLU . . . . . . . . . . . . . 1.1 tt0 -57.12 -55.31 36.36 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.369 -0.832 . . . . 2.26 109.358 -179.759 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' D' D ' 337' ' ' ARG . . . . . . . . . . . . . 18.1 mtp180 -61.48 -28.38 69.25 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.356 -0.84 . . . . 3.64 109.695 -179.932 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' D' D ' 338' ' ' PHE . . . . . 0.466 ' HB3' ' O ' ' D' ' 335' ' ' ARG . 79.5 t80 -55.74 -61.76 2.14 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.21 -0.931 . . . . 0.4 109.83 -179.482 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' D' D ' 339' ' ' GLU . . . . . . . . . . . . . 45.1 mt-10 -50.66 -31.63 16.81 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.38 -0.825 . . . . 1.99 109.945 -179.655 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' D' D ' 340' ' ' MET . . . . . . . . . . . . . 29.3 ttp -64.64 -53.86 40.96 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.093 -1.004 . . . . 1.13 110.0 -179.482 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' D' D ' 341' ' ' PHE . . . . . . . . . . . . . 46.3 m-85 -62.57 -53.41 55.1 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.216 -0.928 . . . . 0.21 109.549 -179.74 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' D' D ' 342' ' ' ARG . . . . . . . . . . . . . 4.0 ttp180 -45.08 -38.67 5.19 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.101 -0.999 . . . . 3.15 109.904 -179.924 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' D' D ' 343' ' ' GLU . . . . . . . . . . . . . 20.9 tt0 -59.39 -47.65 84.62 Favored 'General case' 0 N--CA 1.49 1.525 0 O-C-N 121.12 -0.988 . . . . 2.35 109.534 -179.978 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' D' D ' 344' ' ' LEU . . . . . 0.469 ' O ' HD21 ' D' ' 348' ' ' LEU . 44.9 mt -63.18 -45.37 92.08 Favored 'General case' 0 C--N 1.301 -1.51 0 O-C-N 121.193 -0.942 . . . . 1.06 110.037 -179.703 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' D' D ' 345' ' ' ASN . . . . . . . . . . . . . 33.9 t-20 -52.43 -49.03 65.36 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.22 -0.925 . . . . 1.35 109.858 -179.349 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' D' D ' 346' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -60.07 -35.63 75.59 Favored 'General case' 0 N--CA 1.488 1.436 0 O-C-N 121.077 -1.014 . . . . 1.69 109.453 -179.961 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' D' D ' 347' ' ' ALA . . . . . . . . . . . . . . . -61.42 -48.97 78.78 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.259 -0.901 . . . . 1.03 110.215 -179.677 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' D' D ' 348' ' ' LEU . . . . . 0.511 ' CD2' ' N ' ' D' ' 348' ' ' LEU . 4.0 mm? -62.91 -40.66 98.25 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.147 -0.971 . . . . 1.04 109.663 -179.7 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' D' D ' 349' ' ' GLU . . . . . . . . . . . . . 59.6 mt-10 -59.05 -41.64 88.39 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.3 -0.875 . . . . 1.95 110.059 -179.309 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' D' D ' 350' ' ' LEU . . . . . 0.497 ' CD1' HD22 ' C' ' 350' ' ' LEU . 8.3 tt -61.76 -41.45 97.7 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.04 -1.037 . . . . 1.16 109.791 -179.282 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' D' D ' 351' ' ' LYS . . . . . . . . . . . . . 13.3 tttt -57.56 -47.34 82.33 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.01 -1.056 . . . . 1.97 109.301 -179.96 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' D' D ' 352' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -55.8 -51.45 67.4 Favored 'General case' 0 C--N 1.301 -1.505 0 O-C-N 121.393 -0.817 . . . . 1.17 109.503 179.984 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' D' D ' 353' ' ' ALA . . . . . . . . . . . . . . . -68.77 -14.88 63.31 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.153 -0.967 . . . . 1.21 109.616 -179.806 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' D' D ' 354' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -82.81 -3.76 57.13 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.334 -0.854 . . . . 1.68 109.955 -179.51 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' D' D ' 355' ' ' ALA . . . . . . . . . . . . . . . -69.51 -91.15 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.208 -0.932 . . . . 1.29 109.983 -179.846 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' D' D ' 356' ' ' GLY . . . . . . . . . . . . . . . -64.41 99.25 0.32 Allowed Glycine 0 N--CA 1.497 2.747 0 N-CA-C 109.744 -1.342 . . . . 1.28 109.744 -179.699 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' D' D ' 357' ' ' LYS . . . . . 0.439 ' O ' ' HD3' ' D' ' 359' ' ' PRO . 0.2 OUTLIER -89.55 128.44 36.01 Favored 'General case' 0 N--CA 1.493 1.692 0 O-C-N 121.421 -1.047 . . . . 4.45 109.535 -179.741 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' D' D ' 358' ' ' GLU . . . . . . . . . . . . . 12.0 tt0 -48.44 107.01 0.68 Allowed Pre-proline 0 N--CA 1.49 1.528 0 O-C-N 121.185 -0.947 . . . . 5.71 109.217 179.633 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' D' D ' 359' ' ' PRO . . . . . 0.439 ' HD3' ' O ' ' D' ' 357' ' ' LYS . 2.3 Cg_endo -61.97 126.15 18.15 Favored 'Trans proline' 0 C--N 1.313 -1.312 0 C-N-CA 122.003 1.802 . . . . 5.6 109.977 -179.943 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' D' D ' 360' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.232 0 N-CA-C 109.361 -1.496 . . . . 6.97 109.361 -179.944 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 319' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.49 1.535 0 N-CA-C 109.282 -0.636 . . . . 7.95 109.282 . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 320' ' ' LYS . . . . . . . . . . . . . 32.4 tttt 58.43 90.43 0.05 OUTLIER 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.177 -0.952 . . . . 6.71 109.167 -179.878 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 321' ' ' LYS . . . . . . . . . . . . . 27.8 mttt -81.4 155.27 71.74 Favored Pre-proline 0 N--CA 1.489 1.475 0 O-C-N 121.328 -0.857 . . . . 6.5 109.565 -179.731 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 322' ' ' PRO . . . . . . . . . . . . . 4.0 Cg_exo -59.51 -154.28 0.01 OUTLIER 'Trans proline' 0 C--N 1.308 -1.585 0 C-N-CA 122.179 1.919 . . . . 3.3 110.146 -179.993 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 323' ' ' LEU . . . . . . . . . . . . . 87.9 mt -80.67 123.36 28.1 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.154 -0.966 . . . . 3.16 109.398 -179.964 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 324' ' ' ASP . . . . . . . . . . . . . 6.1 m-20 -80.26 -157.23 0.14 Allowed 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.241 -0.912 . . . . 1.53 109.613 -179.883 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 325' ' ' GLY . . . . . . . . . . . . . . . -69.09 174.4 33.78 Favored Glycine 0 N--CA 1.49 2.281 0 N-CA-C 109.669 -1.372 . . . . 0.67 109.669 -179.944 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 326' ' ' GLU . . . . . . . . . . . . . 6.2 mm-40 -58.85 -169.96 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.316 -1.108 . . . . 2.13 109.548 179.957 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 327' ' ' TYR . . . . . 0.58 ' CE1' ' HG2' ' C' ' 333' ' ' ARG . 49.1 m-85 -149.36 108.47 3.91 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.31 -0.869 . . . . 1.0 109.315 179.98 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 328' ' ' PHE . . . . . 0.4 ' CZ ' ' HG3' ' C' ' 335' ' ' ARG . 98.0 m-85 -113.97 -167.54 1.22 Allowed 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.261 -0.9 . . . . 0.34 109.693 -179.902 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 329' ' ' THR . . . . . . . . . . . . . 41.5 p -152.83 165.13 36.39 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.398 -0.814 . . . . 1.05 108.967 179.91 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 330' ' ' LEU . . . . . . . . . . . . . 21.4 tp -151.55 129.59 11.83 Favored 'General case' 0 N--CA 1.489 1.497 0 O-C-N 121.067 -1.021 . . . . 1.07 110.063 -179.519 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 331' ' ' GLN . . . . . . . . . . . . . 1.7 tp60 -88.28 116.32 26.4 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.28 -0.887 . . . . 0.91 109.02 179.422 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 332' ' ' ILE . . . . . 0.444 HG23 ' HA ' ' A' ' 338' ' ' PHE . 36.1 mt -103.71 108.64 25.0 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.641 0 O-C-N 121.107 -0.996 . . . . 1.09 110.082 -179.588 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 333' ' ' ARG . . . . . 0.427 ' HG2' ' CE1' ' C' ' 327' ' ' TYR . 0.1 OUTLIER -73.41 144.84 46.22 Favored 'General case' 0 N--CA 1.489 1.483 0 O-C-N 121.284 -0.885 . . . . 3.41 109.152 179.417 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 334' ' ' GLY . . . . . 0.476 ' CA ' ' HB2' ' C' ' 326' ' ' GLU . . . 82.37 128.01 1.1 Allowed Glycine 0 N--CA 1.492 2.385 0 N-CA-C 109.534 -1.426 . . . . 0.4 109.534 -179.853 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 335' ' ' ARG . . . . . . . . . . . . . 40.3 ttp180 -79.92 -30.48 40.04 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.269 -1.136 . . . . 3.55 110.019 -179.717 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 336' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -55.41 -68.29 0.21 Allowed 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.199 -0.938 . . . . 2.29 109.967 -179.537 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 337' ' ' ARG . . . . . . . . . . . . . 16.3 mmt180 -60.36 -28.05 67.88 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.182 -0.949 . . . . 3.64 109.693 -179.72 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 338' ' ' PHE . . . . . 0.444 ' HA ' HG23 ' A' ' 332' ' ' ILE . 66.2 t80 -55.56 -56.35 21.31 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.141 -0.974 . . . . 0.41 109.749 -179.934 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 339' ' ' GLU . . . . . . . . . . . . . 20.2 mm-40 -51.37 -37.48 48.3 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.276 -0.89 . . . . 1.97 109.948 -179.774 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 340' ' ' MET . . . . . . . . . . . . . 33.6 ttp -64.36 -45.39 87.95 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.138 -0.977 . . . . 1.14 110.252 -179.545 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 341' ' ' PHE . . . . . . . . . . . . . 32.8 m-85 -63.04 -51.07 68.18 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.234 -0.917 . . . . 0.21 110.313 -179.341 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 342' ' ' ARG . . . . . 0.543 ' HG2' ' NH1' ' A' ' 342' ' ' ARG . 4.5 ttt-85 -49.0 -46.2 43.53 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.187 -0.946 . . . . 3.15 110.158 -179.295 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 343' ' ' GLU . . . . . . . . . . . . . 2.1 tt0 -58.44 -43.05 88.6 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.27 -0.894 . . . . 2.35 110.046 -179.408 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 344' ' ' LEU . . . . . 0.425 ' O ' HD21 ' A' ' 348' ' ' LEU . 40.3 mt -62.54 -38.41 89.9 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.111 -0.993 . . . . 1.06 109.828 -179.745 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 345' ' ' ASN . . . . . . . . . . . . . 46.7 t-20 -56.88 -48.43 78.18 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.152 -0.967 . . . . 1.36 109.648 -179.778 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 346' ' ' GLU . . . . . . . . . . . . . 2.9 tt0 -61.7 -33.65 74.39 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.274 -0.891 . . . . 1.65 109.835 -179.776 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 347' ' ' ALA . . . . . . . . . . . . . . . -60.53 -53.76 53.59 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.204 -0.935 . . . . 1.03 110.27 -179.601 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 348' ' ' LEU . . . . . 0.443 ' N ' ' CD2' ' A' ' 348' ' ' LEU . 4.1 mm? -61.51 -48.46 80.93 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.201 -0.937 . . . . 1.04 110.166 -179.319 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 349' ' ' GLU . . . . . . . . . . . . . 64.9 mm-40 -57.86 -32.89 68.1 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.182 -0.949 . . . . 1.94 110.126 -179.426 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 350' ' ' LEU . . . . . 0.461 HD23 HD23 ' B' ' 350' ' ' LEU . 7.7 tt -64.39 -49.11 72.88 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.136 -0.978 . . . . 1.17 109.821 -179.647 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 351' ' ' LYS . . . . . . . . . . . . . 68.0 tttt -59.01 -43.25 91.52 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.193 -0.942 . . . . 1.97 109.781 -179.547 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 352' ' ' ASP . . . . . . . . . . . . . 66.7 m-20 -56.52 -50.91 70.45 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.11 -0.994 . . . . 1.16 109.66 -179.79 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 353' ' ' ALA . . . . . . . . . . . . . . . -68.23 -14.11 62.74 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.308 -0.87 . . . . 1.22 109.803 -179.676 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 354' ' ' GLN . . . . . . . . . . . . . 10.6 tt0 -83.85 -12.71 55.16 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.181 -0.949 . . . . 1.71 109.798 -179.857 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 355' ' ' ALA . . . . . . . . . . . . . . . -72.08 -46.28 57.44 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.276 -0.89 . . . . 1.3 109.797 -179.911 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 356' ' ' GLY . . . . . . . . . . . . . . . -80.27 11.03 39.4 Favored Glycine 0 N--CA 1.492 2.377 0 N-CA-C 110.333 -1.107 . . . . 1.3 110.333 -179.673 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 357' ' ' LYS . . . . . . . . . . . . . 2.8 tttt -85.76 14.76 5.45 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.013 -1.287 . . . . 4.46 109.714 -179.831 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 358' ' ' GLU . . . . . . . . . . . . . 18.1 tt0 -49.31 135.11 16.74 Favored Pre-proline 0 N--CA 1.49 1.552 0 O-C-N 121.168 -0.958 . . . . 5.75 109.222 -179.99 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 359' ' ' PRO . . . . . . . . . . . . . 2.3 Cg_endo -62.06 -155.95 0.02 OUTLIER 'Trans proline' 0 C--N 1.312 -1.372 0 C-N-CA 122.034 1.823 . . . . 5.63 110.267 -179.823 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 360' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.204 0 CA-C-O 117.993 -1.448 . . . . 6.97 109.612 -179.995 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' B' B ' 319' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.49 1.548 0 N-CA-C 109.437 -0.579 . . . . 7.95 109.437 . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 320' ' ' LYS . . . . . . . . . . . . . 31.7 tttt 58.63 90.03 0.05 Allowed 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.225 -0.922 . . . . 6.73 109.179 -179.776 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 321' ' ' LYS . . . . . . . . . . . . . 27.0 mttt -81.09 155.47 72.43 Favored Pre-proline 0 N--CA 1.489 1.499 0 O-C-N 121.26 -0.9 . . . . 6.5 109.511 -179.714 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 322' ' ' PRO . . . . . . . . . . . . . 4.0 Cg_exo -59.71 -154.48 0.01 OUTLIER 'Trans proline' 0 C--N 1.309 -1.531 0 C-N-CA 122.237 1.958 . . . . 3.29 110.038 179.896 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 323' ' ' LEU . . . . . . . . . . . . . 87.8 mt -80.48 123.4 28.04 Favored 'General case' 0 N--CA 1.488 1.465 0 O-C-N 121.201 -0.937 . . . . 3.18 109.458 -179.923 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 324' ' ' ASP . . . . . . . . . . . . . 6.1 m-20 -80.19 -156.64 0.13 Allowed 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.272 -0.892 . . . . 1.53 109.584 -179.838 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 325' ' ' GLY . . . . . . . . . . . . . . . -69.71 174.47 35.82 Favored Glycine 0 N--CA 1.489 2.225 0 N-CA-C 109.683 -1.367 . . . . 0.65 109.683 -179.895 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 326' ' ' GLU . . . . . . . . . . . . . 6.5 mm-40 -58.75 -170.19 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.318 -1.107 . . . . 2.13 109.536 179.956 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 327' ' ' TYR . . . . . 0.456 ' CE1' ' HG2' ' D' ' 333' ' ' ARG . 49.0 m-85 -149.33 108.69 3.96 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.264 -0.898 . . . . 0.99 109.373 179.881 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 328' ' ' PHE . . . . . . . . . . . . . 98.0 m-85 -114.09 -167.32 1.2 Allowed 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.242 -0.911 . . . . 0.36 109.73 -179.847 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 329' ' ' THR . . . . . . . . . . . . . 40.9 p -152.81 165.2 36.13 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.423 -0.798 . . . . 1.05 109.041 179.876 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 330' ' ' LEU . . . . . . . . . . . . . 21.4 tp -151.81 129.66 11.68 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.038 -1.039 . . . . 1.07 110.038 -179.647 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 331' ' ' GLN . . . . . . . . . . . . . 1.7 tp60 -88.42 116.32 26.56 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.397 -0.814 . . . . 0.91 109.001 179.528 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 332' ' ' ILE . . . . . 0.435 HG23 ' HA ' ' B' ' 338' ' ' PHE . 35.4 mt -103.74 108.94 25.7 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.614 0 O-C-N 121.18 -0.95 . . . . 1.08 109.988 -179.555 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 333' ' ' ARG . . . . . 0.526 ' HG2' ' CE1' ' D' ' 327' ' ' TYR . 0.1 OUTLIER -73.83 144.57 45.45 Favored 'General case' 0 N--CA 1.489 1.481 0 O-C-N 121.267 -0.896 . . . . 3.42 109.043 179.359 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' B' B ' 334' ' ' GLY . . . . . . . . . . . . . . . 82.65 127.54 1.11 Allowed Glycine 0 N--CA 1.492 2.418 0 N-CA-C 109.491 -1.444 . . . . 0.4 109.491 -179.821 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 335' ' ' ARG . . . . . . . . . . . . . 40.3 ttp180 -79.71 -30.32 40.94 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.333 -1.098 . . . . 3.55 109.944 -179.654 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 336' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -55.6 -68.43 0.2 Allowed 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.128 -0.982 . . . . 2.28 109.824 -179.533 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 337' ' ' ARG . . . . . . . . . . . . . 16.5 mmt180 -60.21 -27.88 67.54 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.192 -0.942 . . . . 3.64 109.67 -179.614 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 338' ' ' PHE . . . . . 0.435 ' HA ' HG23 ' B' ' 332' ' ' ILE . 65.4 t80 -55.73 -56.39 21.06 Favored 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.298 -0.876 . . . . 0.39 109.672 -179.867 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 339' ' ' GLU . . . . . . . . . . . . . 21.2 mm-40 -51.42 -37.56 49.14 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.229 -0.919 . . . . 1.98 109.886 -179.77 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 340' ' ' MET . . . . . . . . . . . . . 33.6 ttp -64.25 -45.54 87.68 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.202 -0.936 . . . . 1.14 110.171 -179.48 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 341' ' ' PHE . . . . . . . . . . . . . 32.6 m-85 -62.88 -50.85 69.26 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.202 -0.936 . . . . 0.22 110.433 -179.331 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 342' ' ' ARG . . . . . 0.535 ' NH1' ' HG2' ' B' ' 342' ' ' ARG . 4.5 ttt-85 -49.25 -46.21 45.78 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.165 -0.959 . . . . 3.15 110.164 -179.337 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 343' ' ' GLU . . . . . . . . . . . . . 2.0 tt0 -58.28 -43.03 87.83 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.061 -1.024 . . . . 2.35 110.016 -179.475 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 344' ' ' LEU . . . . . 0.438 ' O ' HD21 ' B' ' 348' ' ' LEU . 40.2 mt -62.71 -38.19 89.47 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.107 -0.995 . . . . 1.05 109.922 -179.718 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 345' ' ' ASN . . . . . . . . . . . . . 47.0 t-20 -57.13 -48.3 79.0 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.211 -0.931 . . . . 1.35 109.658 -179.825 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 346' ' ' GLU . . . . . . . . . . . . . 2.9 tt0 -61.66 -33.7 74.42 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.206 -0.934 . . . . 1.66 109.812 -179.825 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 347' ' ' ALA . . . . . . . . . . . . . . . -60.56 -53.74 53.81 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.197 -0.939 . . . . 1.02 110.188 -179.526 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 348' ' ' LEU . . . . . 0.452 ' CD2' ' N ' ' B' ' 348' ' ' LEU . 4.1 mm? -61.42 -48.59 80.49 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.221 -0.924 . . . . 1.05 110.178 -179.287 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 349' ' ' GLU . . . . . . . . . . . . . 64.3 mm-40 -57.76 -32.91 67.94 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.188 -0.945 . . . . 1.95 110.105 -179.348 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 350' ' ' LEU . . . . . 0.461 HD23 HD23 ' A' ' 350' ' ' LEU . 7.6 tt -64.44 -49.06 72.94 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.133 -0.979 . . . . 1.18 109.853 -179.631 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 351' ' ' LYS . . . . . . . . . . . . . 67.3 tttt -59.06 -43.41 91.73 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.299 -0.876 . . . . 1.96 109.77 -179.569 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 352' ' ' ASP . . . . . . . . . . . . . 66.7 m-20 -56.25 -50.99 69.75 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.147 -0.971 . . . . 1.16 109.729 -179.902 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 353' ' ' ALA . . . . . . . . . . . . . . . -68.29 -13.98 62.66 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.217 -0.927 . . . . 1.21 109.777 -179.621 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 354' ' ' GLN . . . . . . . . . . . . . 10.5 tt0 -83.97 -12.53 55.18 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.17 -0.956 . . . . 1.69 109.775 -179.871 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 355' ' ' ALA . . . . . . . . . . . . . . . -72.46 -45.92 57.28 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.28 -0.887 . . . . 1.3 109.638 -179.878 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 356' ' ' GLY . . . . . . . . . . . . . . . -80.5 11.06 40.77 Favored Glycine 0 N--CA 1.492 2.392 0 N-CA-C 110.358 -1.097 . . . . 1.29 110.358 -179.665 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 357' ' ' LYS . . . . . . . . . . . . . 2.8 tttt -85.91 15.08 5.21 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 120.969 -1.313 . . . . 4.45 109.749 -179.806 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 358' ' ' GLU . . . . . . . . . . . . . 18.1 tt0 -49.47 135.27 17.87 Favored Pre-proline 0 N--CA 1.491 1.586 0 O-C-N 121.143 -0.973 . . . . 5.72 109.246 179.967 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 359' ' ' PRO . . . . . . . . . . . . . 2.4 Cg_endo -62.05 -155.71 0.02 OUTLIER 'Trans proline' 0 C--N 1.312 -1.353 0 C-N-CA 121.983 1.788 . . . . 5.6 110.247 -179.88 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 360' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.311 0 N-CA-C 109.522 -1.431 . . . . 6.98 109.522 179.985 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' C' C ' 319' ' ' LYS . . . . . 0.453 ' O ' ' HD2' ' C' ' 322' ' ' PRO . 1.7 tttp . . . . . 0 N--CA 1.49 1.535 0 CA-C-O 121.4 0.619 . . . . 7.03 109.48 . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 320' ' ' LYS . . . . . 0.439 ' HB2' ' O ' ' C' ' 319' ' ' LYS . 2.5 mptt 66.55 -91.94 0.03 OUTLIER 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.24 -0.912 . . . . 6.84 109.788 179.871 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' C' C ' 321' ' ' LYS . . . . . 0.609 ' CB ' ' HD3' ' C' ' 322' ' ' PRO . 0.2 OUTLIER -84.51 -64.97 0.22 Allowed Pre-proline 0 N--CA 1.49 1.558 0 O-C-N 121.045 -1.035 . . . . 6.78 110.617 -179.394 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' C' C ' 322' ' ' PRO . . . . . 0.609 ' HD3' ' CB ' ' C' ' 321' ' ' LYS . 3.0 Cg_exo -58.37 83.68 0.05 OUTLIER 'Trans proline' 0 C--N 1.315 -1.211 0 C-N-CA 121.874 1.716 . . . . 3.98 110.994 -179.697 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' C' C ' 323' ' ' LEU . . . . . 0.451 ' HG ' ' O ' ' C' ' 321' ' ' LYS . 76.1 mt -85.62 42.85 0.99 Allowed 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.225 -0.922 . . . . 4.31 109.326 179.398 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' C' C ' 324' ' ' ASP . . . . . 0.404 ' N ' ' OD1' ' C' ' 324' ' ' ASP . 6.9 m-20 -83.41 5.6 23.04 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.19 -0.944 . . . . 1.63 110.572 -179.344 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' C' C ' 325' ' ' GLY . . . . . 0.603 ' O ' ' CD2' ' C' ' 327' ' ' TYR . . . -65.85 159.47 46.12 Favored Glycine 0 N--CA 1.491 2.341 0 N-CA-C 108.91 -1.676 . . . . 0.82 108.91 179.846 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' C' C ' 326' ' ' GLU . . . . . 0.476 ' HB2' ' CA ' ' A' ' 334' ' ' GLY . 6.5 mm-40 -58.18 157.89 7.72 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 120.993 -1.298 . . . . 2.17 108.836 -179.947 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' C' C ' 327' ' ' TYR . . . . . 0.603 ' CD2' ' O ' ' C' ' 325' ' ' GLY . 37.5 m-85 -149.09 102.94 3.29 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.042 -1.036 . . . . 1.03 110.215 -179.583 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' C' C ' 328' ' ' PHE . . . . . 0.445 ' O ' HG21 ' C' ' 329' ' ' THR . 90.6 m-85 -112.98 -165.23 0.97 Allowed 'General case' 0 N--CA 1.489 1.478 0 O-C-N 121.48 -0.762 . . . . 0.37 108.966 179.337 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' C' C ' 329' ' ' THR . . . . . 0.445 HG21 ' O ' ' C' ' 328' ' ' PHE . 54.6 p -155.48 156.45 35.27 Favored 'General case' 0 N--CA 1.489 1.492 0 O-C-N 121.085 -1.01 . . . . 1.04 109.437 179.961 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' C' C ' 330' ' ' LEU . . . . . . . . . . . . . 18.1 tp -148.71 120.06 7.87 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.331 -0.856 . . . . 1.09 109.596 -179.671 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 331' ' ' GLN . . . . . 0.451 ' OE1' ' HB3' ' A' ' 327' ' ' TYR . 0.1 OUTLIER -86.98 117.69 25.87 Favored 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.32 -0.863 . . . . 1.48 109.089 179.743 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' C' C ' 332' ' ' ILE . . . . . . . . . . . . . 18.8 mt -103.8 118.68 51.31 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.557 0 O-C-N 121.116 -0.99 . . . . 1.08 109.972 -179.639 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 333' ' ' ARG . . . . . 0.58 ' HG2' ' CE1' ' A' ' 327' ' ' TYR . 4.1 mtp180 -73.25 143.38 47.1 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.384 -0.823 . . . . 3.36 109.309 179.526 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' C' C ' 334' ' ' GLY . . . . . . . . . . . . . . . 86.22 130.78 2.73 Favored Glycine 0 N--CA 1.491 2.365 0 N-CA-C 109.694 -1.363 . . . . 0.35 109.694 179.867 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 335' ' ' ARG . . . . . 0.441 ' NH1' ' CG ' ' C' ' 335' ' ' ARG . 0.0 OUTLIER -80.25 -37.91 31.99 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.367 -1.078 . . . . 3.23 109.81 -179.994 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' C' C ' 336' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -56.33 -59.0 5.59 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.222 -0.923 . . . . 2.62 109.521 -179.83 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' C' C ' 337' ' ' ARG . . . . . 0.525 ' HD2' ' N ' ' C' ' 337' ' ' ARG . 18.6 mmm180 -60.95 -30.82 70.46 Favored 'General case' 0 N--CA 1.489 1.482 0 O-C-N 121.247 -0.908 . . . . 3.61 109.241 179.836 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' C' C ' 338' ' ' PHE . . . . . 0.434 ' HB3' ' O ' ' C' ' 335' ' ' ARG . 91.7 t80 -55.03 -54.99 36.0 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.326 -0.859 . . . . 0.43 109.554 179.991 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' C' C ' 339' ' ' GLU . . . . . . . . . . . . . 27.4 mt-10 -51.82 -32.81 33.14 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.313 -0.867 . . . . 2.05 110.055 -179.787 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 340' ' ' MET . . . . . . . . . . . . . 3.3 ttt -63.66 -51.7 63.96 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.073 -1.017 . . . . 1.1 110.067 -179.539 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 341' ' ' PHE . . . . . . . . . . . . . 65.1 m-85 -62.68 -46.48 87.96 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.161 -0.962 . . . . 0.21 110.057 -179.506 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 342' ' ' ARG . . . . . 0.463 ' O ' ' HB3' ' C' ' 345' ' ' ASN . 14.6 ttm180 -49.81 -43.53 48.61 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.2 -0.937 . . . . 3.42 109.965 -179.558 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' C' C ' 343' ' ' GLU . . . . . . . . . . . . . 1.3 tt0 -58.19 -48.53 80.02 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.04 -1.037 . . . . 2.14 109.568 -179.685 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 344' ' ' LEU . . . . . . . . . . . . . 36.7 mt -61.82 -26.58 68.2 Favored 'General case' 0 N--CA 1.488 1.469 0 O-C-N 121.229 -0.919 . . . . 1.09 109.549 -179.977 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 345' ' ' ASN . . . . . 0.463 ' HB3' ' O ' ' C' ' 342' ' ' ARG . 24.0 t-20 -57.15 -62.52 1.7 Allowed 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.219 -0.926 . . . . 1.38 109.659 -179.866 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' C' C ' 346' ' ' GLU . . . . . 0.438 ' O ' ' HB2' ' C' ' 350' ' ' LEU . 2.5 tt0 -62.04 -23.66 66.6 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.209 -0.932 . . . . 2.21 109.768 -179.692 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' C' C ' 347' ' ' ALA . . . . . . . . . . . . . . . -62.33 -57.04 12.81 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.194 -0.941 . . . . 1.03 109.865 -179.84 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 348' ' ' LEU . . . . . 0.508 ' N ' ' CD2' ' C' ' 348' ' ' LEU . 3.6 mm? -61.58 -53.46 55.93 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.244 -0.91 . . . . 1.06 110.032 -179.658 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' C' C ' 349' ' ' GLU . . . . . . . . . . . . . 1.5 mt-10 -56.38 -28.83 60.39 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.172 -0.955 . . . . 2.19 109.692 -179.578 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 350' ' ' LEU . . . . . 0.52 ' CD2' ' CD1' ' D' ' 350' ' ' LEU . 10.3 tt -65.24 -48.78 72.11 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.341 -0.849 . . . . 1.2 109.212 179.821 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' C' C ' 351' ' ' LYS . . . . . . . . . . . . . 31.1 tttm -58.26 -42.83 87.29 Favored 'General case' 0 N--CA 1.488 1.454 0 O-C-N 121.466 -0.771 . . . . 1.92 109.579 -179.782 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 352' ' ' ASP . . . . . . . . . . . . . 5.2 m-20 -61.0 -43.05 99.46 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.288 -0.882 . . . . 1.19 109.712 179.752 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 353' ' ' ALA . . . . . . . . . . . . . . . -66.73 -9.96 42.01 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.275 -0.891 . . . . 1.15 109.855 -179.483 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 354' ' ' GLN . . . . . . . . . . . . . 4.9 mt-30 -81.21 -49.62 10.56 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.24 -0.913 . . . . 1.7 109.37 -179.997 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 355' ' ' ALA . . . . . . . . . . . . . . . -70.19 -19.51 63.17 Favored 'General case' 0 N--CA 1.489 1.5 0 O-C-N 121.226 -0.921 . . . . 1.3 108.949 179.713 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 356' ' ' GLY . . . . . . . . . . . . . . . -80.6 -78.36 0.94 Allowed Glycine 0 N--CA 1.489 2.233 0 N-CA-C 108.934 -1.666 . . . . 1.33 108.934 179.509 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 357' ' ' LYS . . . . . . . . . . . . . 1.7 ttmm -84.96 101.06 12.06 Favored 'General case' 0 N--CA 1.488 1.464 0 O-C-N 121.412 -1.052 . . . . 4.39 109.145 179.699 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 358' ' ' GLU . . . . . 0.546 ' CB ' ' HD3' ' C' ' 359' ' ' PRO . 0.9 OUTLIER -48.79 -55.2 21.2 Favored Pre-proline 0 N--CA 1.489 1.51 0 O-C-N 121.222 -0.924 . . . . 5.75 109.715 -179.799 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' C' C ' 359' ' ' PRO . . . . . 0.546 ' HD3' ' CB ' ' C' ' 358' ' ' GLU . 1.8 Cg_endo -63.37 103.75 0.39 Allowed 'Trans proline' 0 C--N 1.311 -1.418 0 C-N-CA 121.868 1.712 . . . . 5.54 110.182 -179.975 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' C' C ' 360' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.488 2.156 0 CA-C-O 117.983 -1.454 . . . . 6.5 109.506 179.943 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' D' D ' 319' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.489 1.501 0 N-CA-C 109.377 -0.601 . . . . 7.93 109.377 . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' D' D ' 320' ' ' LYS . . . . . . . . . . . . . 31.5 tttt 58.63 90.3 0.05 OUTLIER 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.232 -0.917 . . . . 6.7 109.182 -179.762 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' D' D ' 321' ' ' LYS . . . . . . . . . . . . . 27.4 mttt -81.11 155.19 72.52 Favored Pre-proline 0 N--CA 1.489 1.498 0 O-C-N 121.316 -0.865 . . . . 6.49 109.623 -179.767 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' D' D ' 322' ' ' PRO . . . . . . . . . . . . . 4.0 Cg_exo -59.66 -154.29 0.01 OUTLIER 'Trans proline' 0 C--N 1.309 -1.511 0 C-N-CA 122.053 1.835 . . . . 3.29 110.116 179.823 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' D' D ' 323' ' ' LEU . . . . . . . . . . . . . 88.1 mt -80.52 123.27 27.95 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.212 -0.93 . . . . 3.16 109.519 -179.947 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' D' D ' 324' ' ' ASP . . . . . . . . . . . . . 6.3 m-20 -80.3 -156.93 0.13 Allowed 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.299 -0.876 . . . . 1.54 109.638 -179.787 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' D' D ' 325' ' ' GLY . . . . . . . . . . . . . . . -69.32 174.35 34.65 Favored Glycine 0 N--CA 1.489 2.217 0 N-CA-C 109.705 -1.358 . . . . 0.65 109.705 -179.94 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' D' D ' 326' ' ' GLU . . . . . . . . . . . . . 6.6 mm-40 -58.93 -170.26 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.287 -1.126 . . . . 2.13 109.45 179.921 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' D' D ' 327' ' ' TYR . . . . . 0.526 ' CE1' ' HG2' ' B' ' 333' ' ' ARG . 49.4 m-85 -149.25 108.81 3.99 Favored 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.295 -0.878 . . . . 1.0 109.371 179.979 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' D' D ' 328' ' ' PHE . . . . . . . . . . . . . 97.9 m-85 -114.09 -167.15 1.17 Allowed 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.352 -0.842 . . . . 0.34 109.687 -179.808 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' D' D ' 329' ' ' THR . . . . . . . . . . . . . 40.7 p -152.97 164.96 36.99 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.369 -0.832 . . . . 1.05 109.024 179.934 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' D' D ' 330' ' ' LEU . . . . . . . . . . . . . 21.3 tp -151.66 129.53 11.69 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.113 -0.992 . . . . 1.07 110.016 -179.571 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' D' D ' 331' ' ' GLN . . . . . . . . . . . . . 1.7 tp60 -88.27 116.38 26.44 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.266 -0.896 . . . . 0.93 108.97 179.506 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' D' D ' 332' ' ' ILE . . . . . 0.445 HG23 ' HA ' ' D' ' 338' ' ' PHE . 36.2 mt -103.81 109.02 25.91 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.57 0 O-C-N 121.023 -1.048 . . . . 1.07 110.071 -179.634 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' D' D ' 333' ' ' ARG . . . . . 0.456 ' HG2' ' CE1' ' B' ' 327' ' ' TYR . 0.1 OUTLIER -73.87 144.54 45.37 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.306 -0.871 . . . . 3.42 109.142 179.442 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' D' D ' 334' ' ' GLY . . . . . . . . . . . . . . . 82.58 127.91 1.14 Allowed Glycine 0 N--CA 1.492 2.399 0 N-CA-C 109.417 -1.473 . . . . 0.41 109.417 -179.841 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' D' D ' 335' ' ' ARG . . . . . . . . . . . . . 40.4 ttp180 -79.96 -30.29 39.8 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.239 -1.153 . . . . 3.58 110.017 -179.722 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' D' D ' 336' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -55.48 -68.47 0.19 Allowed 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.126 -0.984 . . . . 2.26 109.889 -179.568 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' D' D ' 337' ' ' ARG . . . . . . . . . . . . . 16.3 mmt180 -60.23 -27.9 67.57 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.24 -0.913 . . . . 3.64 109.746 -179.787 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' D' D ' 338' ' ' PHE . . . . . 0.445 ' HA ' HG23 ' D' ' 332' ' ' ILE . 65.6 t80 -55.69 -56.41 20.81 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.174 -0.954 . . . . 0.4 109.638 -179.917 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' D' D ' 339' ' ' GLU . . . . . . . . . . . . . 21.7 mm-40 -51.45 -37.51 49.07 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.245 -0.909 . . . . 1.99 109.865 -179.764 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' D' D ' 340' ' ' MET . . . . . . . . . . . . . 33.6 ttp -64.21 -45.78 86.77 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.164 -0.96 . . . . 1.13 110.162 -179.468 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' D' D ' 341' ' ' PHE . . . . . . . . . . . . . 32.5 m-85 -62.61 -51.18 68.31 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.127 -0.983 . . . . 0.21 110.377 -179.357 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' D' D ' 342' ' ' ARG . . . . . 0.531 ' NH1' ' HG2' ' D' ' 342' ' ' ARG . 4.7 ttt-85 -49.06 -46.12 44.0 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.13 -0.981 . . . . 3.15 110.212 -179.314 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' D' D ' 343' ' ' GLU . . . . . . . . . . . . . 2.0 tt0 -58.4 -43.04 88.41 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.115 -0.991 . . . . 2.35 109.921 -179.481 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' D' D ' 344' ' ' LEU . . . . . 0.43 ' O ' HD21 ' D' ' 348' ' ' LEU . 39.1 mt -62.59 -38.37 89.87 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.163 -0.961 . . . . 1.06 109.898 -179.675 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' D' D ' 345' ' ' ASN . . . . . . . . . . . . . 46.4 t-20 -57.01 -48.4 78.56 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.231 -0.918 . . . . 1.35 109.667 -179.838 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' D' D ' 346' ' ' GLU . . . . . . . . . . . . . 2.8 tt0 -61.53 -33.99 74.78 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.22 -0.925 . . . . 1.69 109.753 -179.784 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' D' D ' 347' ' ' ALA . . . . . . . . . . . . . . . -60.27 -53.64 55.22 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.238 -0.914 . . . . 1.03 110.331 -179.594 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' D' D ' 348' ' ' LEU . . . . . 0.452 ' CD2' ' N ' ' D' ' 348' ' ' LEU . 4.2 mm? -61.63 -48.63 79.99 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.187 -0.946 . . . . 1.04 110.112 -179.165 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' D' D ' 349' ' ' GLU . . . . . . . . . . . . . 64.5 mm-40 -57.8 -32.78 67.89 Favored 'General case' 0 N--CA 1.492 1.675 0 O-C-N 121.257 -0.902 . . . . 1.95 110.076 -179.296 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' D' D ' 350' ' ' LEU . . . . . 0.52 ' CD1' ' CD2' ' C' ' 350' ' ' LEU . 7.6 tt -64.48 -49.12 72.64 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.13 -0.981 . . . . 1.16 109.855 -179.697 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' D' D ' 351' ' ' LYS . . . . . . . . . . . . . 66.5 tttt -58.97 -43.1 91.3 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.246 -0.909 . . . . 1.97 109.785 -179.581 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' D' D ' 352' ' ' ASP . . . . . . . . . . . . . 66.7 m-20 -56.58 -51.05 70.1 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.286 -0.884 . . . . 1.17 109.706 -179.848 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' D' D ' 353' ' ' ALA . . . . . . . . . . . . . . . -68.11 -14.01 62.65 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.287 -0.883 . . . . 1.21 109.866 -179.824 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' D' D ' 354' ' ' GLN . . . . . . . . . . . . . 10.5 tt0 -83.94 -12.69 54.98 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.092 -1.005 . . . . 1.68 109.69 -179.867 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' D' D ' 355' ' ' ALA . . . . . . . . . . . . . . . -72.18 -46.12 57.61 Favored 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.195 -0.941 . . . . 1.29 109.799 -179.927 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' D' D ' 356' ' ' GLY . . . . . . . . . . . . . . . -80.47 11.11 40.33 Favored Glycine 0 N--CA 1.492 2.391 0 N-CA-C 110.3 -1.12 . . . . 1.28 110.3 -179.69 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' D' D ' 357' ' ' LYS . . . . . . . . . . . . . 2.7 tttt -85.76 14.92 5.23 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.053 -1.263 . . . . 4.45 109.733 -179.862 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' D' D ' 358' ' ' GLU . . . . . . . . . . . . . 18.0 tt0 -49.47 135.42 17.77 Favored Pre-proline 0 N--CA 1.49 1.569 0 O-C-N 121.21 -0.931 . . . . 5.71 109.145 -179.954 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' D' D ' 359' ' ' PRO . . . . . . . . . . . . . 2.3 Cg_endo -62.15 -155.56 0.02 OUTLIER 'Trans proline' 0 C--N 1.312 -1.367 0 C-N-CA 121.972 1.781 . . . . 5.6 110.312 -179.918 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' D' D ' 360' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.322 0 CA-C-O 117.998 -1.446 . . . . 6.97 109.501 -179.968 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 319' ' ' LYS . . . . . . . . . . . . . 14.9 mttt . . . . . 0 N--CA 1.49 1.561 0 N-CA-C 109.393 -0.595 . . . . 7.95 109.393 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 320' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 60.81 16.85 7.15 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.275 -0.891 . . . . 6.71 109.452 179.965 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 321' ' ' LYS . . . . . 0.468 ' N ' ' HD3' ' A' ' 322' ' ' PRO . 0.0 OUTLIER -158.1 62.27 2.35 Favored Pre-proline 0 N--CA 1.489 1.496 0 O-C-N 121.335 -0.853 . . . . 6.5 109.095 179.839 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 322' ' ' PRO . . . . . 0.468 ' HD3' ' N ' ' A' ' 321' ' ' LYS . 5.2 Cg_exo -58.68 106.43 0.28 Allowed 'Trans proline' 0 C--N 1.309 -1.549 0 C-N-CA 122.158 1.905 . . . . 3.3 110.183 -179.893 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 323' ' ' LEU . . . . . . . . . . . . . 90.4 mt -81.55 80.84 7.82 Favored 'General case' 0 N--CA 1.489 1.481 0 O-C-N 121.253 -0.904 . . . . 3.16 109.362 179.97 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 324' ' ' ASP . . . . . 0.52 ' CB ' ' OH ' ' A' ' 327' ' ' TYR . 63.3 m-20 -81.38 159.06 24.44 Favored 'General case' 0 N--CA 1.489 1.484 0 O-C-N 121.248 -0.908 . . . . 1.53 109.131 179.816 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 325' ' ' GLY . . . . . . . . . . . . . . . -67.64 -170.52 5.06 Favored Glycine 0 N--CA 1.489 2.22 0 N-CA-C 109.138 -1.585 . . . . 0.67 109.138 179.889 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 326' ' ' GLU . . . . . . . . . . . . . 11.0 mm-40 -57.2 -169.8 0.0 OUTLIER 'General case' 0 N--CA 1.488 1.462 0 O-C-N 121.178 -1.19 . . . . 2.13 109.362 -179.903 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 327' ' ' TYR . . . . . 0.52 ' OH ' ' CB ' ' A' ' 324' ' ' ASP . 39.5 m-85 -148.7 109.51 4.26 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.244 -0.91 . . . . 1.0 109.732 -179.9 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 328' ' ' PHE . . . . . 0.486 ' CD1' ' N ' ' A' ' 328' ' ' PHE . 5.2 m-85 -113.7 -169.18 1.46 Allowed 'General case' 0 N--CA 1.488 1.473 0 O-C-N 121.401 -0.812 . . . . 0.34 108.969 179.75 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 329' ' ' THR . . . . . . . . . . . . . 23.9 p -154.4 171.67 18.95 Favored 'General case' 0 N--CA 1.489 1.476 0 O-C-N 121.041 -1.037 . . . . 1.05 109.605 -179.763 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 330' ' ' LEU . . . . . . . . . . . . . 29.7 tp -150.49 129.88 12.93 Favored 'General case' 0 N--CA 1.488 1.456 0 O-C-N 121.307 -0.87 . . . . 1.07 109.378 -179.913 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 331' ' ' GLN . . . . . . . . . . . . . 1.6 tp60 -87.27 113.89 23.4 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.19 -0.944 . . . . 0.91 109.511 -179.982 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 332' ' ' ILE . . . . . 0.52 ' CG2' ' HA ' ' A' ' 338' ' ' PHE . 96.1 mt -103.44 99.97 9.48 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.552 0 O-C-N 121.162 -0.961 . . . . 1.09 109.417 179.902 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 333' ' ' ARG . . . . . . . . . . . . . 25.7 mtt180 -71.85 145.29 48.69 Favored 'General case' 0 N--CA 1.489 1.49 0 O-C-N 121.2 -0.937 . . . . 3.41 109.27 179.756 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 334' ' ' GLY . . . . . . . . . . . . . . . 82.71 121.3 0.68 Allowed Glycine 0 N--CA 1.489 2.181 0 N-CA-C 109.452 -1.459 . . . . 0.4 109.452 -179.854 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 335' ' ' ARG . . . . . 0.545 ' NH1' ' HG3' ' A' ' 335' ' ' ARG . 1.3 ttm-85 -69.18 -29.36 67.33 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.327 -1.102 . . . . 3.55 109.684 -179.844 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 336' ' ' GLU . . . . . . . . . . . . . 21.6 tt0 -59.31 -65.63 0.64 Allowed 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.267 -0.896 . . . . 2.29 109.906 -179.763 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 337' ' ' ARG . . . . . 0.61 ' CB ' ' CZ ' ' A' ' 337' ' ' ARG . 0.4 OUTLIER -59.0 -31.05 68.45 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.223 -0.923 . . . . 3.64 109.289 -179.906 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 338' ' ' PHE . . . . . 0.52 ' HA ' ' CG2' ' A' ' 332' ' ' ILE . 54.3 t80 -54.47 -58.09 8.8 Favored 'General case' 0 N--CA 1.488 1.469 0 O-C-N 121.409 -0.807 . . . . 0.41 109.695 -179.856 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 339' ' ' GLU . . . . . . . . . . . . . 12.5 mt-10 -51.19 -34.18 30.58 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.204 -0.935 . . . . 1.97 110.146 -179.709 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 340' ' ' MET . . . . . . . . . . . . . 32.3 ttp -63.9 -51.58 63.87 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.14 -0.975 . . . . 1.14 110.27 -179.388 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 341' ' ' PHE . . . . . 0.426 ' CZ ' ' HA ' ' C' ' 345' ' ' ASN . 39.7 m-85 -62.12 -47.67 83.56 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.11 -0.994 . . . . 0.21 110.029 -179.513 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 342' ' ' ARG . . . . . . . . . . . . . 31.4 ttt180 -48.05 -41.83 26.9 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.246 -0.909 . . . . 3.15 109.95 -179.563 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 343' ' ' GLU . . . . . . . . . . . . . 3.2 tt0 -58.72 -48.27 81.74 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.08 -1.013 . . . . 2.35 109.738 -179.643 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 344' ' ' LEU . . . . . . . . . . . . . 80.9 mt -62.29 -31.2 71.75 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.142 -0.974 . . . . 1.06 109.618 -179.853 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 345' ' ' ASN . . . . . . . . . . . . . 17.5 t-20 -57.16 -60.56 3.43 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.296 -0.878 . . . . 1.36 109.802 -179.67 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 346' ' ' GLU . . . . . 0.413 ' O ' ' HB2' ' A' ' 350' ' ' LEU . 24.9 tt0 -62.35 -25.25 67.8 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.316 -0.865 . . . . 1.65 110.15 -179.684 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 347' ' ' ALA . . . . . 0.472 ' HB2' ' HB2' ' B' ' 347' ' ' ALA . . . -60.33 -59.91 4.65 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.195 -0.941 . . . . 1.03 110.17 -179.568 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 348' ' ' LEU . . . . . 0.487 ' N ' HD23 ' A' ' 348' ' ' LEU . 3.8 mm? -61.34 -49.03 78.6 Favored 'General case' 0 N--CA 1.493 1.711 0 O-C-N 121.274 -0.891 . . . . 1.04 109.901 -179.523 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 349' ' ' GLU . . . . . . . . . . . . . 4.5 mm-40 -57.43 -27.62 62.57 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.223 -0.923 . . . . 1.94 109.798 -179.565 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 350' ' ' LEU . . . . . 0.486 HD23 HD23 ' B' ' 350' ' ' LEU . 2.9 tt -64.49 -43.59 93.66 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.244 -0.91 . . . . 1.17 109.293 -179.984 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 351' ' ' LYS . . . . . . . . . . . . . 33.3 tttt -59.4 -52.94 63.44 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.41 -0.806 . . . . 1.97 109.868 -179.788 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 352' ' ' ASP . . . . . . . . . . . . . 66.9 m-20 -57.17 -38.54 73.74 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.246 -0.909 . . . . 1.16 109.966 -179.594 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 353' ' ' ALA . . . . . . . . . . . . . . . -67.08 -24.67 65.98 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.104 -0.997 . . . . 1.22 109.886 -179.539 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 354' ' ' GLN . . . . . . . . . . . . . 3.8 tt0 -84.15 -15.44 47.11 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.091 -1.005 . . . . 1.71 109.586 -179.854 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 355' ' ' ALA . . . . . . . . . . . . . . . -73.3 -4.58 34.1 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.182 -0.949 . . . . 1.3 109.716 179.864 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 356' ' ' GLY . . . . . . . . . . . . . . . -77.61 3.48 59.63 Favored Glycine 0 N--CA 1.492 2.407 0 N-CA-C 109.896 -1.282 . . . . 1.3 109.896 -179.777 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 357' ' ' LYS . . . . . . . . . . . . . 14.0 tttt -85.33 143.19 28.82 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.202 -1.175 . . . . 4.46 109.43 -179.968 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 358' ' ' GLU . . . . . . . . . . . . . 38.4 mt-10 -49.71 149.24 4.57 Favored Pre-proline 0 N--CA 1.49 1.556 0 O-C-N 121.265 -0.897 . . . . 5.75 109.525 -179.81 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 359' ' ' PRO . . . . . . . . . . . . . 2.6 Cg_endo -62.08 -160.35 0.03 OUTLIER 'Trans proline' 0 C--N 1.309 -1.514 0 C-N-CA 122.272 1.982 . . . . 5.63 110.36 179.952 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 360' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.302 0 CA-C-O 118.014 -1.437 . . . . 6.97 109.543 -179.943 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' B' B ' 319' ' ' LYS . . . . . . . . . . . . . 14.5 mttt . . . . . 0 N--CA 1.49 1.546 0 CA-C-O 121.3 0.571 . . . . 7.95 109.462 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' B' B ' 320' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 60.6 16.97 7.0 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.321 -0.862 . . . . 6.73 109.516 -179.886 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 321' ' ' LYS . . . . . 0.466 ' N ' ' HD3' ' B' ' 322' ' ' PRO . 0.0 OUTLIER -158.16 62.31 2.34 Favored Pre-proline 0 N--CA 1.489 1.5 0 O-C-N 121.287 -0.883 . . . . 6.5 109.126 179.828 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' B' B ' 322' ' ' PRO . . . . . 0.466 ' HD3' ' N ' ' B' ' 321' ' ' LYS . 5.3 Cg_exo -58.58 106.28 0.27 Allowed 'Trans proline' 0 C--N 1.308 -1.566 0 C-N-CA 122.21 1.94 . . . . 3.29 110.209 -179.896 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 323' ' ' LEU . . . . . . . . . . . . . 89.7 mt -81.55 81.08 7.76 Favored 'General case' 0 N--CA 1.489 1.495 0 O-C-N 121.234 -0.916 . . . . 3.18 109.336 179.938 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 324' ' ' ASP . . . . . 0.52 ' CB ' ' OH ' ' B' ' 327' ' ' TYR . 60.4 m-20 -81.82 157.58 24.39 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.351 -0.843 . . . . 1.53 109.291 179.769 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 325' ' ' GLY . . . . . . . . . . . . . . . -65.93 -170.34 3.28 Favored Glycine 0 N--CA 1.49 2.234 0 N-CA-C 109.298 -1.521 . . . . 0.65 109.298 179.91 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 326' ' ' GLU . . . . . . . . . . . . . 10.4 mm-40 -57.65 -169.82 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.162 -1.199 . . . . 2.13 109.349 -179.977 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 327' ' ' TYR . . . . . 0.52 ' OH ' ' CB ' ' B' ' 324' ' ' ASP . 39.8 m-85 -148.62 109.82 4.36 Favored 'General case' 0 N--CA 1.488 1.474 0 O-C-N 121.302 -0.874 . . . . 0.99 109.767 179.987 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 328' ' ' PHE . . . . . 0.485 ' CD1' ' N ' ' B' ' 328' ' ' PHE . 5.5 m-85 -113.73 -168.89 1.41 Allowed 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.293 -0.879 . . . . 0.36 109.057 179.725 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 329' ' ' THR . . . . . 0.474 ' HA ' ' O ' ' D' ' 330' ' ' LEU . 23.5 p -154.46 171.49 19.28 Favored 'General case' 0 N--CA 1.488 1.466 0 O-C-N 121.08 -1.013 . . . . 1.05 109.682 -179.947 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 330' ' ' LEU . . . . . 0.437 ' O ' ' HA ' ' D' ' 329' ' ' THR . 30.1 tp -150.41 129.67 12.82 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.34 -0.85 . . . . 1.07 109.388 -179.95 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 331' ' ' GLN . . . . . . . . . . . . . 1.7 tp60 -87.06 113.86 23.18 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.192 -0.942 . . . . 0.91 109.575 179.917 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 332' ' ' ILE . . . . . 0.52 ' CG2' ' HA ' ' B' ' 338' ' ' PHE . 96.2 mt -103.31 99.94 9.41 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.581 0 O-C-N 121.142 -0.974 . . . . 1.08 109.385 179.889 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 333' ' ' ARG . . . . . . . . . . . . . 25.9 mtt180 -71.94 145.59 48.34 Favored 'General case' 0 N--CA 1.489 1.482 0 O-C-N 121.263 -0.898 . . . . 3.42 109.203 179.79 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 334' ' ' GLY . . . . . . . . . . . . . . . 82.58 121.15 0.66 Allowed Glycine 0 N--CA 1.49 2.238 0 N-CA-C 109.424 -1.47 . . . . 0.4 109.424 -179.903 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 335' ' ' ARG . . . . . 0.557 ' NH1' ' HG3' ' B' ' 335' ' ' ARG . 1.3 ttm-85 -69.02 -29.57 67.76 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.341 -1.094 . . . . 3.55 109.678 -179.879 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 336' ' ' GLU . . . . . . . . . . . . . 21.3 tt0 -59.2 -65.68 0.63 Allowed 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.275 -0.891 . . . . 2.28 109.871 -179.786 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 337' ' ' ARG . . . . . 0.609 ' CB ' ' CZ ' ' B' ' 337' ' ' ARG . 0.4 OUTLIER -59.11 -30.84 68.41 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.155 -0.966 . . . . 3.64 109.326 -179.884 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' B' B ' 338' ' ' PHE . . . . . 0.52 ' HA ' ' CG2' ' B' ' 332' ' ' ILE . 53.5 t80 -54.65 -58.06 9.0 Favored 'General case' 0 N--CA 1.488 1.444 0 O-C-N 121.303 -0.873 . . . . 0.39 109.583 -179.797 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 339' ' ' GLU . . . . . . . . . . . . . 12.6 mt-10 -51.27 -34.08 31.22 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.154 -0.966 . . . . 1.98 110.124 -179.691 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 340' ' ' MET . . . . . . . . . . . . . 32.4 ttp -63.88 -51.75 63.11 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.108 -0.995 . . . . 1.14 110.234 -179.397 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 341' ' ' PHE . . . . . . . . . . . . . 39.5 m-85 -61.96 -47.55 84.34 Favored 'General case' 0 N--CA 1.493 1.675 0 O-C-N 121.108 -0.995 . . . . 0.22 110.089 -179.45 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 342' ' ' ARG . . . . . . . . . . . . . 31.5 ttt180 -48.16 -41.77 27.77 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.28 -0.888 . . . . 3.15 110.006 -179.543 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 343' ' ' GLU . . . . . . . . . . . . . 3.2 tt0 -58.73 -48.15 82.17 Favored 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.14 -0.975 . . . . 2.35 109.781 -179.649 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 344' ' ' LEU . . . . . . . . . . . . . 80.5 mt -62.46 -31.21 71.9 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.151 -0.968 . . . . 1.05 109.624 -179.859 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 345' ' ' ASN . . . . . . . . . . . . . 17.7 t-20 -56.98 -60.73 3.14 Favored 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.163 -0.96 . . . . 1.35 109.786 -179.812 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 346' ' ' GLU . . . . . 0.419 ' O ' ' HB2' ' B' ' 350' ' ' LEU . 24.8 tt0 -62.24 -25.27 67.73 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.304 -0.873 . . . . 1.66 110.152 -179.646 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 347' ' ' ALA . . . . . 0.472 ' HB2' ' HB2' ' A' ' 347' ' ' ALA . . . -60.29 -59.97 4.57 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.087 -1.008 . . . . 1.02 110.17 -179.534 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 348' ' ' LEU . . . . . 0.485 ' N ' HD23 ' B' ' 348' ' ' LEU . 3.7 mm? -61.34 -49.02 78.66 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.262 -0.899 . . . . 1.05 109.994 -179.498 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 349' ' ' GLU . . . . . . . . . . . . . 4.5 mm-40 -57.27 -27.94 62.54 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.165 -0.96 . . . . 1.95 109.784 -179.594 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 350' ' ' LEU . . . . . 0.486 HD23 HD23 ' A' ' 350' ' ' LEU . 2.8 tt -64.28 -43.5 94.61 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.259 -0.901 . . . . 1.18 109.311 -179.989 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 351' ' ' LYS . . . . . . . . . . . . . 33.4 tttt -59.52 -53.13 61.66 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.305 -0.872 . . . . 1.96 109.833 -179.692 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 352' ' ' ASP . . . . . . . . . . . . . 65.9 m-20 -56.97 -38.63 73.27 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.262 -0.899 . . . . 1.16 109.979 -179.733 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 353' ' ' ALA . . . . . . . . . . . . . . . -66.94 -24.86 66.12 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.209 -0.932 . . . . 1.21 109.876 -179.54 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 354' ' ' GLN . . . . . . . . . . . . . 3.7 tt0 -83.99 -15.6 47.13 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.168 -0.958 . . . . 1.69 109.549 -179.889 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 355' ' ' ALA . . . . . . . . . . . . . . . -73.17 -4.62 33.98 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.207 -0.933 . . . . 1.3 109.718 179.928 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 356' ' ' GLY . . . . . . . . . . . . . . . -77.68 3.6 59.52 Favored Glycine 0 N--CA 1.492 2.378 0 N-CA-C 109.862 -1.295 . . . . 1.29 109.862 -179.695 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 357' ' ' LYS . . . . . . . . . . . . . 14.1 tttt -85.44 143.25 28.69 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.172 -1.193 . . . . 4.45 109.484 179.975 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 358' ' ' GLU . . . . . . . . . . . . . 38.6 mt-10 -49.67 149.16 4.56 Favored Pre-proline 0 N--CA 1.49 1.557 0 O-C-N 121.232 -0.917 . . . . 5.72 109.595 -179.899 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 359' ' ' PRO . . . . . . . . . . . . . 2.7 Cg_endo -62.16 -160.34 0.03 OUTLIER 'Trans proline' 0 C--N 1.31 -1.476 0 C-N-CA 122.202 1.934 . . . . 5.6 110.321 179.947 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 360' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.289 0 CA-C-O 117.958 -1.468 . . . . 6.98 109.468 -179.965 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' C' C ' 319' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 N--CA 1.49 1.566 0 CA-C-O 121.268 0.556 . . . . 7.03 109.513 . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 320' ' ' LYS . . . . . . . . . . . . . 9.5 mttp 56.24 95.81 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.32 -0.863 . . . . 6.84 109.494 -179.965 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 321' ' ' LYS . . . . . 0.538 ' CB ' ' HD3' ' C' ' 322' ' ' PRO . 0.1 OUTLIER -80.07 -53.53 0.94 Allowed Pre-proline 0 N--CA 1.49 1.553 0 O-C-N 121.266 -0.896 . . . . 6.78 110.143 -179.701 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' C' C ' 322' ' ' PRO . . . . . 0.538 ' HD3' ' CB ' ' C' ' 321' ' ' LYS . 1.8 Cg_endo -64.94 126.9 17.4 Favored 'Trans proline' 0 C--N 1.311 -1.41 0 C-N-CA 121.982 1.788 . . . . 3.98 110.45 -179.451 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' C' C ' 323' ' ' LEU . . . . . . . . . . . . . 83.9 mt -79.62 139.21 37.52 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.22 -0.925 . . . . 4.31 108.673 179.46 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 324' ' ' ASP . . . . . 0.459 ' HB3' ' OH ' ' C' ' 327' ' ' TYR . 9.0 m-20 -77.59 144.92 37.14 Favored 'General case' 0 N--CA 1.489 1.48 0 O-C-N 121.115 -0.99 . . . . 1.63 109.49 -179.48 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' C' C ' 325' ' ' GLY . . . . . . . . . . . . . . . -67.22 -167.9 3.39 Favored Glycine 0 N--CA 1.487 2.05 0 N-CA-C 109.168 -1.573 . . . . 0.82 109.168 179.982 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 326' ' ' GLU . . . . . . . . . . . . . 66.3 mm-40 -57.55 -172.9 0.01 OUTLIER 'General case' 0 C--N 1.302 -1.496 0 O-C-N 121.214 -1.168 . . . . 2.17 109.48 -179.943 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 327' ' ' TYR . . . . . 0.459 ' OH ' ' HB3' ' C' ' 324' ' ' ASP . 36.2 m-85 -147.47 105.93 3.79 Favored 'General case' 0 C--N 1.302 -1.484 0 O-C-N 121.441 -0.787 . . . . 1.03 109.226 179.661 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' C' C ' 328' ' ' PHE . . . . . . . . . . . . . 43.3 m-85 -113.35 -171.81 1.95 Allowed 'General case' 0 C--N 1.302 -1.461 0 O-C-N 121.297 -0.877 . . . . 0.37 108.91 179.902 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 329' ' ' THR . . . . . . . . . . . . . 19.0 p -152.5 -175.66 5.38 Favored 'General case' 0 C--N 1.302 -1.461 0 O-C-N 121.091 -1.006 . . . . 1.04 109.645 -179.973 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 330' ' ' LEU . . . . . . . . . . . . . 28.1 tp -153.37 128.99 10.03 Favored 'General case' 0 N--CA 1.489 1.492 0 O-C-N 121.331 -0.855 . . . . 1.09 109.557 -179.65 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 331' ' ' GLN . . . . . . . . . . . . . 8.2 tp-100 -89.08 106.49 18.47 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.253 -0.904 . . . . 1.48 109.418 179.759 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 332' ' ' ILE . . . . . 0.468 HD12 ' CD2' ' C' ' 341' ' ' PHE . 68.3 mt -103.55 108.53 24.69 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.557 0 O-C-N 121.193 -0.942 . . . . 1.08 109.813 -179.96 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' C' C ' 333' ' ' ARG . . . . . 0.439 ' HG2' ' CE2' ' A' ' 327' ' ' TYR . 2.1 mpt_? -74.13 156.54 37.27 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.267 -0.895 . . . . 3.36 109.685 179.935 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' C' C ' 334' ' ' GLY . . . . . . . . . . . . . . . 76.93 132.73 0.52 Allowed Glycine 0 N--CA 1.492 2.4 0 N-CA-C 109.9 -1.28 . . . . 0.35 109.9 179.709 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 335' ' ' ARG . . . . . . . . . . . . . 26.4 ttp180 -77.9 -32.83 52.0 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.3 -1.118 . . . . 3.23 109.595 179.947 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 336' ' ' GLU . . . . . . . . . . . . . 1.6 mt-10 -57.05 -59.72 4.65 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.291 -0.88 . . . . 2.62 109.67 -179.707 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 337' ' ' ARG . . . . . 0.544 ' HG2' ' NH1' ' C' ' 337' ' ' ARG . 0.1 OUTLIER -61.23 -35.22 76.63 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.217 -0.927 . . . . 3.61 109.667 -179.742 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' C' C ' 338' ' ' PHE . . . . . . . . . . . . . 51.5 t80 -54.32 -54.86 34.6 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.185 -0.947 . . . . 0.43 109.598 -179.714 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 339' ' ' GLU . . . . . . . . . . . . . 6.9 mt-10 -53.12 -33.39 52.07 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.165 -0.959 . . . . 2.05 109.942 -179.922 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 340' ' ' MET . . . . . . . . . . . . . 25.7 ttp -65.01 -55.35 19.52 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.239 -0.913 . . . . 1.1 110.366 -179.402 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 341' ' ' PHE . . . . . 0.468 ' CD2' HD12 ' C' ' 332' ' ' ILE . 49.7 m-85 -61.39 -35.23 76.93 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.111 -0.993 . . . . 0.21 110.082 -179.231 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' C' C ' 342' ' ' ARG . . . . . . . . . . . . . 10.7 ttt180 -53.33 -49.44 67.06 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.227 -0.92 . . . . 3.42 110.13 -179.807 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 343' ' ' GLU . . . . . . . . . . . . . 2.3 tt0 -59.28 -47.11 86.59 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.214 -0.929 . . . . 2.14 110.289 -179.33 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 344' ' ' LEU . . . . . . . . . . . . . 85.2 mt -60.33 -30.97 69.86 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.065 -1.022 . . . . 1.09 109.641 -179.457 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 345' ' ' ASN . . . . . 0.426 ' HA ' ' CZ ' ' A' ' 341' ' ' PHE . 19.4 t-20 -59.15 -58.84 6.85 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.266 -0.896 . . . . 1.38 109.928 -179.873 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' C' C ' 346' ' ' GLU . . . . . 0.4 ' O ' ' HG3' ' C' ' 346' ' ' GLU . 8.8 tp10 -61.85 -25.5 67.57 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.356 -0.84 . . . . 2.21 110.321 -179.351 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' C' C ' 347' ' ' ALA . . . . . . . . . . . . . . . -58.52 -62.46 1.84 Allowed 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.045 -1.035 . . . . 1.03 110.26 -179.355 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 348' ' ' LEU . . . . . 0.406 ' N ' ' CD2' ' C' ' 348' ' ' LEU . 3.4 mm? -61.34 -42.44 98.69 Favored 'General case' 0 N--CA 1.494 1.761 0 O-C-N 121.181 -0.949 . . . . 1.06 110.014 -179.274 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' C' C ' 349' ' ' GLU . . . . . . . . . . . . . 34.7 mt-10 -57.25 -31.29 65.41 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.109 -0.994 . . . . 2.19 109.709 -179.697 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 350' ' ' LEU . . . . . 0.491 HD23 HD23 ' D' ' 350' ' ' LEU . 5.8 tt -62.87 -43.59 98.38 Favored 'General case' 0 N--CA 1.488 1.453 0 O-C-N 121.106 -0.996 . . . . 1.2 109.604 179.993 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' C' C ' 351' ' ' LYS . . . . . . . . . . . . . 6.0 tttp -58.79 -44.77 90.79 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.288 -0.883 . . . . 1.92 109.831 -179.808 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 352' ' ' ASP . . . . . 0.437 ' O ' ' HB1' ' C' ' 355' ' ' ALA . 81.6 m-20 -54.99 -44.64 74.64 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.083 -1.011 . . . . 1.19 109.945 -179.753 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' C' C ' 353' ' ' ALA . . . . . . . . . . . . . . . -67.03 -30.5 70.61 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.1 -1.0 . . . . 1.15 109.84 -179.607 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 354' ' ' GLN . . . . . . . . . . . . . 6.9 tt0 -81.77 8.32 10.39 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.152 -0.968 . . . . 1.7 109.851 -179.879 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 355' ' ' ALA . . . . . 0.437 ' HB1' ' O ' ' C' ' 352' ' ' ASP . . . -70.3 -67.95 0.46 Allowed 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.203 -0.935 . . . . 1.3 110.368 -179.572 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' C' C ' 356' ' ' GLY . . . . . . . . . . . . . . . -81.3 48.77 3.88 Favored Glycine 0 N--CA 1.494 2.527 0 C-N-CA 120.386 -0.911 . . . . 1.33 111.272 -178.825 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 357' ' ' LYS . . . . . 0.477 ' HB3' ' HD2' ' C' ' 359' ' ' PRO . 0.0 OUTLIER -87.95 -152.86 0.22 Allowed 'General case' 0 N--CA 1.493 1.701 0 O-C-N 120.778 -1.424 . . . . 4.39 109.055 179.326 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' C' C ' 358' ' ' GLU . . . . . 0.578 ' CB ' ' HD3' ' C' ' 359' ' ' PRO . 0.2 OUTLIER -50.99 -59.21 8.02 Favored Pre-proline 0 N--CA 1.492 1.644 0 O-C-N 121.028 -1.045 . . . . 5.75 109.308 -179.97 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' C' C ' 359' ' ' PRO . . . . . 0.578 ' HD3' ' CB ' ' C' ' 358' ' ' GLU . 1.9 Cg_endo -61.25 111.66 1.18 Allowed 'Trans proline' 0 C--N 1.312 -1.353 0 C-N-CA 121.923 1.749 . . . . 5.54 109.923 179.722 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' C' C ' 360' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.18 0 CA-C-O 117.965 -1.464 . . . . 6.5 109.58 -179.98 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' D' D ' 319' ' ' LYS . . . . . . . . . . . . . 14.6 mttt . . . . . 0 N--CA 1.491 1.589 0 N-CA-C 109.344 -0.613 . . . . 7.93 109.344 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' D' D ' 320' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 60.74 17.04 7.22 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.268 -0.895 . . . . 6.7 109.488 -179.953 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' D' D ' 321' ' ' LYS . . . . . 0.452 ' N ' ' HD3' ' D' ' 322' ' ' PRO . 0.0 OUTLIER -158.17 62.22 2.32 Favored Pre-proline 0 N--CA 1.49 1.557 0 O-C-N 121.287 -0.883 . . . . 6.49 109.094 179.861 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' D' D ' 322' ' ' PRO . . . . . 0.452 ' HD3' ' N ' ' D' ' 321' ' ' LYS . 5.2 Cg_exo -58.73 106.64 0.29 Allowed 'Trans proline' 0 C--N 1.309 -1.553 0 C-N-CA 122.102 1.868 . . . . 3.29 110.166 -179.769 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' D' D ' 323' ' ' LEU . . . . . . . . . . . . . 90.1 mt -81.73 80.89 7.95 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.341 -0.849 . . . . 3.16 109.272 179.979 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' D' D ' 324' ' ' ASP . . . . . 0.516 ' CB ' ' OH ' ' D' ' 327' ' ' TYR . 60.0 m-20 -81.51 158.34 24.52 Favored 'General case' 0 N--CA 1.489 1.489 0 O-C-N 121.282 -0.887 . . . . 1.54 109.241 179.688 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' D' D ' 325' ' ' GLY . . . . . . . . . . . . . . . -66.89 -170.2 4.08 Favored Glycine 0 N--CA 1.49 2.263 0 N-CA-C 109.073 -1.611 . . . . 0.65 109.073 179.897 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' D' D ' 326' ' ' GLU . . . . . . . . . . . . . 11.1 mm-40 -57.61 -169.96 0.01 OUTLIER 'General case' 0 N--CA 1.488 1.445 0 O-C-N 121.243 -1.151 . . . . 2.13 109.37 -179.969 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' D' D ' 327' ' ' TYR . . . . . 0.516 ' OH ' ' CB ' ' D' ' 324' ' ' ASP . 40.1 m-85 -148.55 110.02 4.43 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.225 -0.922 . . . . 1.0 109.721 -179.985 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' D' D ' 328' ' ' PHE . . . . . 0.478 ' CD1' ' N ' ' D' ' 328' ' ' PHE . 5.4 m-85 -113.96 -168.9 1.42 Allowed 'General case' 0 N--CA 1.489 1.483 0 O-C-N 121.345 -0.847 . . . . 0.34 109.064 179.679 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' D' D ' 329' ' ' THR . . . . . 0.437 ' HA ' ' O ' ' B' ' 330' ' ' LEU . 23.8 p -154.45 171.75 18.86 Favored 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.216 -0.928 . . . . 1.05 109.613 -179.88 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' D' D ' 330' ' ' LEU . . . . . 0.474 ' O ' ' HA ' ' B' ' 329' ' ' THR . 29.8 tp -150.65 129.53 12.48 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.299 -0.876 . . . . 1.07 109.369 -179.943 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' D' D ' 331' ' ' GLN . . . . . . . . . . . . . 1.6 tp60 -87.0 113.92 23.17 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.259 -0.901 . . . . 0.93 109.578 179.958 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' D' D ' 332' ' ' ILE . . . . . 0.519 ' CG2' ' HA ' ' D' ' 338' ' ' PHE . 96.2 mt -103.29 100.03 9.6 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.522 0 O-C-N 121.223 -0.923 . . . . 1.07 109.421 179.882 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' D' D ' 333' ' ' ARG . . . . . 0.443 ' HG2' ' CE2' ' B' ' 327' ' ' TYR . 26.2 mtt180 -71.88 145.61 48.43 Favored 'General case' 0 N--CA 1.488 1.427 0 O-C-N 121.253 -0.905 . . . . 3.42 109.225 179.761 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' D' D ' 334' ' ' GLY . . . . . . . . . . . . . . . 82.75 121.21 0.68 Allowed Glycine 0 N--CA 1.49 2.253 0 N-CA-C 109.518 -1.433 . . . . 0.41 109.518 -179.93 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' D' D ' 335' ' ' ARG . . . . . 0.542 ' NH1' ' HG3' ' D' ' 335' ' ' ARG . 1.3 ttm-85 -69.02 -29.98 68.27 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.324 -1.103 . . . . 3.58 109.613 -179.94 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' D' D ' 336' ' ' GLU . . . . . . . . . . . . . 21.3 tt0 -58.93 -65.57 0.64 Allowed 'General case' 0 N--CA 1.491 1.625 0 O-C-N 121.239 -0.913 . . . . 2.26 109.95 -179.728 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' D' D ' 337' ' ' ARG . . . . . 0.588 ' CZ ' ' CB ' ' D' ' 337' ' ' ARG . 0.4 OUTLIER -59.22 -30.77 68.48 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.172 -0.955 . . . . 3.64 109.355 -179.877 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' D' D ' 338' ' ' PHE . . . . . 0.519 ' HA ' ' CG2' ' D' ' 332' ' ' ILE . 54.0 t80 -54.61 -58.01 9.19 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.389 -0.819 . . . . 0.4 109.635 -179.951 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' D' D ' 339' ' ' GLU . . . . . . . . . . . . . 12.6 mt-10 -51.37 -34.2 33.17 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.207 -0.933 . . . . 1.99 110.093 -179.636 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' D' D ' 340' ' ' MET . . . . . . . . . . . . . 32.3 ttp -63.79 -51.53 64.38 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.077 -1.015 . . . . 1.13 110.327 -179.5 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' D' D ' 341' ' ' PHE . . . . . . . . . . . . . 39.2 m-85 -62.17 -47.67 83.48 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.128 -0.982 . . . . 0.21 110.043 -179.438 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' D' D ' 342' ' ' ARG . . . . . . . . . . . . . 31.1 ttt180 -47.89 -41.98 25.73 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.286 -0.883 . . . . 3.15 110.042 -179.606 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' D' D ' 343' ' ' GLU . . . . . . . . . . . . . 3.2 tt0 -58.72 -48.07 82.42 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.156 -0.965 . . . . 2.35 109.729 -179.556 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' D' D ' 344' ' ' LEU . . . . . . . . . . . . . 80.2 mt -62.49 -31.29 72.01 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.244 -0.91 . . . . 1.06 109.624 -179.772 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' D' D ' 345' ' ' ASN . . . . . . . . . . . . . 17.4 t-20 -56.91 -60.42 3.6 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.279 -0.888 . . . . 1.35 109.798 -179.775 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' D' D ' 346' ' ' GLU . . . . . 0.42 ' O ' ' HB2' ' D' ' 350' ' ' LEU . 24.8 tt0 -62.69 -25.4 68.13 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.179 -0.95 . . . . 1.69 110.077 -179.55 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' D' D ' 347' ' ' ALA . . . . . . . . . . . . . . . -60.18 -59.87 4.72 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.173 -0.954 . . . . 1.03 110.06 -179.518 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' D' D ' 348' ' ' LEU . . . . . 0.499 ' N ' HD23 ' D' ' 348' ' ' LEU . 3.8 mm? -61.44 -49.11 78.16 Favored 'General case' 0 N--CA 1.493 1.722 0 O-C-N 121.248 -0.907 . . . . 1.04 110.02 -179.48 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' D' D ' 349' ' ' GLU . . . . . . . . . . . . . 4.5 mm-40 -57.21 -27.77 62.27 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.186 -0.946 . . . . 1.95 109.77 -179.602 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' D' D ' 350' ' ' LEU . . . . . 0.491 HD23 HD23 ' C' ' 350' ' ' LEU . 2.7 tt -64.59 -43.52 93.57 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.142 -0.974 . . . . 1.16 109.268 -179.979 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' D' D ' 351' ' ' LYS . . . . . . . . . . . . . 32.9 tttt -59.28 -53.14 61.59 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.3 -0.875 . . . . 1.97 109.913 -179.84 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' D' D ' 352' ' ' ASP . . . . . . . . . . . . . 66.6 m-20 -56.96 -38.65 73.27 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.146 -0.971 . . . . 1.17 110.006 -179.745 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' D' D ' 353' ' ' ALA . . . . . . . . . . . . . . . -66.89 -24.73 66.14 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.144 -0.972 . . . . 1.21 109.917 -179.555 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' D' D ' 354' ' ' GLN . . . . . . . . . . . . . 3.7 tt0 -84.01 -15.69 46.72 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.205 -0.934 . . . . 1.68 109.621 -179.885 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' D' D ' 355' ' ' ALA . . . . . . . . . . . . . . . -73.13 -4.59 33.66 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.17 -0.956 . . . . 1.29 109.711 179.918 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' D' D ' 356' ' ' GLY . . . . . . . . . . . . . . . -77.52 3.35 59.72 Favored Glycine 0 N--CA 1.491 2.357 0 N-CA-C 109.879 -1.288 . . . . 1.28 109.879 -179.779 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' D' D ' 357' ' ' LYS . . . . . . . . . . . . . 14.0 tttt -85.24 143.23 28.87 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.208 -1.172 . . . . 4.45 109.5 -179.998 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' D' D ' 358' ' ' GLU . . . . . . . . . . . . . 38.5 mt-10 -49.87 148.98 5.02 Favored Pre-proline 0 N--CA 1.49 1.557 0 O-C-N 121.222 -0.924 . . . . 5.71 109.547 -179.898 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' D' D ' 359' ' ' PRO . . . . . . . . . . . . . 2.5 Cg_endo -62.18 -160.35 0.03 OUTLIER 'Trans proline' 0 C--N 1.31 -1.48 0 C-N-CA 122.201 1.934 . . . . 5.6 110.278 -179.881 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' D' D ' 360' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.274 0 N-CA-C 109.516 -1.434 . . . . 6.97 109.516 179.983 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 319' ' ' LYS . . . . . . . . . . . . . 30.9 mttt . . . . . 0 N--CA 1.49 1.547 0 N-CA-C 109.329 -0.619 . . . . 7.95 109.329 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 320' ' ' LYS . . . . . . . . . . . . . 11.0 mttt 60.85 164.08 0.07 Allowed 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.194 -0.941 . . . . 6.71 109.392 -179.847 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 321' ' ' LYS . . . . . 0.455 ' HG2' ' HD2' ' A' ' 322' ' ' PRO . 0.0 OUTLIER -157.34 138.95 9.91 Favored Pre-proline 0 C--N 1.303 -1.445 0 O-C-N 121.362 -0.836 . . . . 6.5 109.075 179.571 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 322' ' ' PRO . . . . . 0.455 ' HD2' ' HG2' ' A' ' 321' ' ' LYS . 1.9 Cg_endo -63.19 -80.85 0.01 OUTLIER 'Trans proline' 0 C--N 1.311 -1.444 0 C-N-CA 122.159 1.906 . . . . 3.3 110.119 179.85 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 323' ' ' LEU . . . . . . . . . . . . . 38.8 mt -79.63 96.28 6.14 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.198 -0.939 . . . . 3.16 109.888 -179.722 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 324' ' ' ASP . . . . . . . . . . . . . 3.3 m-20 -80.17 156.07 27.13 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.378 -0.827 . . . . 1.53 109.563 179.741 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 325' ' ' GLY . . . . . 0.565 ' O ' ' CD2' ' A' ' 327' ' ' TYR . . . -68.99 176.41 29.89 Favored Glycine 0 N--CA 1.491 2.334 0 N-CA-C 109.6 -1.4 . . . . 0.67 109.6 179.866 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 326' ' ' GLU . . . . . . . . . . . . . 35.5 mm-40 -58.51 168.93 1.0 Allowed 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.156 -1.202 . . . . 2.13 109.241 179.747 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 327' ' ' TYR . . . . . 0.565 ' CD2' ' O ' ' A' ' 325' ' ' GLY . 49.7 m-85 -150.17 111.75 4.48 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.235 -0.916 . . . . 1.0 109.617 -179.892 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 328' ' ' PHE . . . . . . . . . . . . . 46.2 m-85 -112.56 -170.07 1.6 Allowed 'General case' 0 N--CA 1.488 1.465 0 O-C-N 121.358 -0.839 . . . . 0.34 109.425 179.934 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 329' ' ' THR . . . . . 0.474 ' HA ' ' O ' ' C' ' 330' ' ' LEU . 9.1 p -153.38 175.62 12.93 Favored 'General case' 0 N--CA 1.487 1.416 0 O-C-N 121.203 -0.936 . . . . 1.05 109.404 -179.899 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 330' ' ' LEU . . . . . 0.479 ' O ' ' HA ' ' C' ' 329' ' ' THR . 29.2 tp -151.49 133.46 15.06 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.192 -0.942 . . . . 1.07 109.665 -179.698 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 331' ' ' GLN . . . . . . . . . . . . . 1.9 tp60 -85.64 110.42 19.26 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.365 -0.834 . . . . 0.91 109.222 179.784 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 332' ' ' ILE . . . . . 0.448 ' CG2' ' HA ' ' A' ' 338' ' ' PHE . 83.0 mt -103.11 103.99 15.94 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.659 0 O-C-N 121.251 -0.906 . . . . 1.09 109.404 -179.772 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 333' ' ' ARG . . . . . 0.48 ' HG2' ' CE1' ' C' ' 327' ' ' TYR . 85.4 mtt180 -73.34 143.88 46.73 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.178 -0.951 . . . . 3.41 109.424 179.891 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 334' ' ' GLY . . . . . . . . . . . . . . . 88.99 131.94 4.24 Favored Glycine 0 N--CA 1.49 2.279 0 N-CA-C 109.636 -1.386 . . . . 0.4 109.636 179.932 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 335' ' ' ARG . . . . . . . . . . . . . 58.7 ttt180 -80.23 -41.19 25.58 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.304 -1.115 . . . . 3.55 109.76 -179.92 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 336' ' ' GLU . . . . . . . . . . . . . 2.4 tt0 -58.49 -59.25 5.66 Favored 'General case' 0 N--CA 1.489 1.492 0 O-C-N 121.179 -0.951 . . . . 2.29 109.685 -179.754 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 337' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -59.43 -33.29 71.06 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.235 -0.916 . . . . 3.64 109.422 179.993 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 338' ' ' PHE . . . . . 0.448 ' HA ' ' CG2' ' A' ' 332' ' ' ILE . 43.6 t80 -55.51 -56.74 16.8 Favored 'General case' 0 N--CA 1.488 1.425 0 O-C-N 121.219 -0.926 . . . . 0.41 109.456 179.95 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 339' ' ' GLU . . . . . . . . . . . . . 43.4 mt-10 -51.29 -30.9 19.51 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.23 -0.919 . . . . 1.97 109.925 179.979 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 340' ' ' MET . . . . . . . . . . . . . 6.1 ttp -63.34 -53.15 57.05 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.128 -0.983 . . . . 1.14 109.919 -179.505 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 341' ' ' PHE . . . . . . . . . . . . . 40.6 m-85 -62.03 -43.65 98.39 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.208 -0.933 . . . . 0.21 109.719 -179.918 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 342' ' ' ARG . . . . . 0.456 ' NH1' ' CG ' ' A' ' 342' ' ' ARG . 0.0 OUTLIER -49.58 -41.06 40.79 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.178 -0.951 . . . . 3.15 109.562 -179.924 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 343' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -59.68 -47.54 85.21 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.28 -0.887 . . . . 2.35 109.638 -179.816 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 344' ' ' LEU . . . . . . . . . . . . . 53.2 mt -62.24 -31.68 72.27 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.237 -0.914 . . . . 1.06 109.566 -179.81 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 345' ' ' ASN . . . . . . . . . . . . . 10.4 t-20 -57.11 -57.26 13.35 Favored 'General case' 0 N--CA 1.488 1.467 0 O-C-N 121.257 -0.902 . . . . 1.36 109.772 -179.95 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 346' ' ' GLU . . . . . . . . . . . . . 64.9 tt0 -61.74 -26.47 68.08 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.311 -0.868 . . . . 1.65 109.68 -179.851 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 347' ' ' ALA . . . . . . . . . . . . . . . -61.82 -61.18 2.69 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.229 -0.919 . . . . 1.03 110.064 -179.59 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 348' ' ' LEU . . . . . 0.416 ' N ' ' CD2' ' A' ' 348' ' ' LEU . 4.1 mm? -59.79 -44.84 93.75 Favored 'General case' 0 N--CA 1.493 1.725 0 O-C-N 121.137 -0.977 . . . . 1.04 109.825 -179.519 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 349' ' ' GLU . . . . . . . . . . . . . 92.8 mt-10 -57.95 -32.47 67.85 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.196 -0.94 . . . . 1.94 109.901 -179.571 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 350' ' ' LEU . . . . . 0.523 HD21 ' CD1' ' B' ' 350' ' ' LEU . 5.9 tt -64.03 -45.55 88.38 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.24 -0.913 . . . . 1.17 109.274 -179.894 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 351' ' ' LYS . . . . . . . . . . . . . 85.9 tttt -60.26 -41.57 93.52 Favored 'General case' 0 C--N 1.303 -1.454 0 O-C-N 121.436 -0.79 . . . . 1.97 109.319 179.991 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 352' ' ' ASP . . . . . . . . . . . . . 21.1 m-20 -57.83 -40.91 81.14 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.406 -0.809 . . . . 1.16 109.841 179.922 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 353' ' ' ALA . . . . . . . . . . . . . . . -66.99 -21.2 65.97 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.293 -0.879 . . . . 1.22 109.798 -179.602 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 354' ' ' GLN . . . . . . . . . . . . . 5.6 tt0 -82.76 -15.47 51.65 Favored 'General case' 0 C--N 1.302 -1.459 0 O-C-N 121.04 -1.038 . . . . 1.71 109.0 179.729 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 355' ' ' ALA . . . . . . . . . . . . . . . -72.62 -2.67 20.89 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.262 -0.898 . . . . 1.3 109.6 179.683 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 356' ' ' GLY . . . . . . . . . . . . . . . -77.69 -79.09 0.74 Allowed Glycine 0 N--CA 1.491 2.328 0 N-CA-C 110.0 -1.24 . . . . 1.3 110.0 -179.741 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 357' ' ' LYS . . . . . . . . . . . . . 3.7 mttp -85.37 105.47 16.04 Favored 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.235 -1.156 . . . . 4.46 109.858 -179.544 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 358' ' ' GLU . . . . . 0.478 ' HB2' ' HD2' ' A' ' 359' ' ' PRO . 17.0 pt-20 -53.34 159.71 2.09 Favored Pre-proline 0 N--CA 1.49 1.552 0 O-C-N 121.251 -0.906 . . . . 5.75 109.23 179.582 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 359' ' ' PRO . . . . . 0.478 ' HD2' ' HB2' ' A' ' 358' ' ' GLU . 2.6 Cg_endo -61.71 -164.43 0.04 OUTLIER 'Trans proline' 0 C--N 1.309 -1.513 0 C-N-CA 122.035 1.823 . . . . 5.63 110.261 179.665 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 360' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.357 0 CA-C-O 117.961 -1.466 . . . . 6.97 109.669 -179.707 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' B' B ' 319' ' ' LYS . . . . . . . . . . . . . 33.0 mttt . . . . . 0 N--CA 1.491 1.581 0 CA-C-O 121.326 0.584 . . . . 7.95 109.542 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' B' B ' 320' ' ' LYS . . . . . . . . . . . . . 11.7 mttt 61.43 165.04 0.09 Allowed 'General case' 0 N--CA 1.489 1.485 0 O-C-N 121.266 -0.896 . . . . 6.73 109.527 179.955 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 321' ' ' LYS . . . . . 0.458 ' HG2' ' HD2' ' B' ' 322' ' ' PRO . 0.0 OUTLIER -158.21 137.92 8.58 Favored Pre-proline 0 C--N 1.302 -1.472 0 O-C-N 121.308 -0.87 . . . . 6.5 109.121 179.717 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' B' B ' 322' ' ' PRO . . . . . 0.458 ' HD2' ' HG2' ' B' ' 321' ' ' LYS . 2.2 Cg_endo -62.37 -81.1 0.01 OUTLIER 'Trans proline' 0 C--N 1.308 -1.566 0 C-N-CA 121.997 1.798 . . . . 3.29 110.105 179.938 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 323' ' ' LEU . . . . . . . . . . . . . 37.6 mt -79.2 96.62 5.94 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.245 -0.91 . . . . 3.18 109.745 -179.686 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 324' ' ' ASP . . . . . . . . . . . . . 3.6 m-20 -80.77 156.4 26.23 Favored 'General case' 0 N--CA 1.489 1.477 0 O-C-N 121.341 -0.85 . . . . 1.53 109.483 179.668 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 325' ' ' GLY . . . . . 0.541 ' O ' ' CD2' ' B' ' 327' ' ' TYR . . . -69.16 177.49 28.46 Favored Glycine 0 N--CA 1.491 2.321 0 N-CA-C 109.557 -1.417 . . . . 0.65 109.557 179.9 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 326' ' ' GLU . . . . . . . . . . . . . 37.5 mm-40 -59.26 168.97 1.26 Allowed 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.145 -1.209 . . . . 2.13 109.224 179.806 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 327' ' ' TYR . . . . . 0.541 ' CD2' ' O ' ' B' ' 325' ' ' GLY . 50.4 m-85 -149.85 112.12 4.67 Favored 'General case' 0 N--CA 1.488 1.469 0 O-C-N 121.205 -0.934 . . . . 0.99 109.489 179.91 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 328' ' ' PHE . . . . . . . . . . . . . 47.6 m-85 -112.73 -170.21 1.62 Allowed 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.401 -0.812 . . . . 0.36 109.216 179.879 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 329' ' ' THR . . . . . . . . . . . . . 9.3 p -153.41 175.51 13.06 Favored 'General case' 0 N--CA 1.489 1.485 0 O-C-N 121.282 -0.886 . . . . 1.05 109.315 -179.89 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 330' ' ' LEU . . . . . 0.448 ' O ' ' HA ' ' D' ' 329' ' ' THR . 27.1 tp -151.21 133.92 15.65 Favored 'General case' 0 N--CA 1.488 1.442 0 O-C-N 121.167 -0.958 . . . . 1.07 109.644 -179.761 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 331' ' ' GLN . . . . . . . . . . . . . 1.9 tp60 -85.79 110.18 19.18 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.416 -0.803 . . . . 0.91 109.158 179.839 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 332' ' ' ILE . . . . . 0.431 ' CG2' ' HA ' ' B' ' 338' ' ' PHE . 83.5 mt -103.07 103.29 14.87 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.668 0 O-C-N 121.249 -0.907 . . . . 1.08 109.72 -179.737 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 333' ' ' ARG . . . . . 0.424 ' HG2' ' CD1' ' D' ' 327' ' ' TYR . 85.0 mtt180 -72.72 143.95 47.84 Favored 'General case' 0 N--CA 1.489 1.481 0 O-C-N 121.252 -0.905 . . . . 3.42 109.492 179.834 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 334' ' ' GLY . . . . . . . . . . . . . . . 89.11 132.13 4.36 Favored Glycine 0 N--CA 1.492 2.377 0 N-CA-C 109.561 -1.415 . . . . 0.4 109.561 -179.95 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 335' ' ' ARG . . . . . . . . . . . . . 58.4 ttt180 -80.31 -41.7 24.39 Favored 'General case' 0 N--CA 1.489 1.481 0 O-C-N 121.221 -1.164 . . . . 3.55 109.53 -179.99 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 336' ' ' GLU . . . . . . . . . . . . . 2.5 tt0 -58.0 -59.68 4.9 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.27 -0.894 . . . . 2.28 109.685 -179.823 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 337' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -58.86 -33.59 70.63 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.148 -0.97 . . . . 3.64 109.395 -179.872 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 338' ' ' PHE . . . . . 0.431 ' HA ' ' CG2' ' B' ' 332' ' ' ILE . 45.8 t80 -55.14 -56.72 16.75 Favored 'General case' 0 N--CA 1.487 1.397 0 O-C-N 121.324 -0.86 . . . . 0.39 109.623 179.963 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 339' ' ' GLU . . . . . . . . . . . . . 44.7 mt-10 -51.58 -30.46 20.98 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.205 -0.934 . . . . 1.98 109.984 -179.98 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 340' ' ' MET . . . . . . . . . . . . . 5.8 ttp -63.55 -53.71 47.51 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.177 -0.952 . . . . 1.14 109.784 -179.461 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 341' ' ' PHE . . . . . . . . . . . . . 39.8 m-85 -61.76 -43.84 98.06 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.282 -0.886 . . . . 0.22 109.637 -179.812 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 342' ' ' ARG . . . . . 0.432 ' CG ' HH11 ' B' ' 342' ' ' ARG . 0.1 OUTLIER -49.02 -41.7 35.62 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.258 -0.901 . . . . 3.15 109.711 -179.948 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' B' B ' 343' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -58.98 -48.69 80.66 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.266 -0.896 . . . . 2.35 109.599 -179.987 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 344' ' ' LEU . . . . . . . . . . . . . 59.6 mt -61.12 -31.18 70.89 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.253 -0.904 . . . . 1.05 109.807 -179.753 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 345' ' ' ASN . . . . . . . . . . . . . 10.5 t-20 -57.95 -56.91 15.92 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.192 -0.943 . . . . 1.35 109.681 -179.833 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 346' ' ' GLU . . . . . . . . . . . . . 62.4 tt0 -62.02 -26.38 68.2 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.226 -0.921 . . . . 1.66 109.572 -179.768 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 347' ' ' ALA . . . . . . . . . . . . . . . -61.86 -60.62 3.38 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.192 -0.943 . . . . 1.02 110.202 -179.687 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 348' ' ' LEU . . . . . 0.474 ' CD1' ' NH2' ' D' ' 337' ' ' ARG . 4.2 mm? -60.27 -45.16 94.27 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.045 -1.034 . . . . 1.05 109.683 -179.441 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 349' ' ' GLU . . . . . . . . . . . . . 93.2 mt-10 -57.34 -33.36 67.67 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.386 -0.821 . . . . 1.95 109.863 -179.649 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 350' ' ' LEU . . . . . 0.523 ' CD1' HD21 ' A' ' 350' ' ' LEU . 5.9 tt -63.13 -46.63 86.36 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.122 -0.986 . . . . 1.18 109.167 179.988 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 351' ' ' LYS . . . . . . . . . . . . . 87.5 tttt -59.23 -41.41 88.64 Favored 'General case' 0 N--CA 1.488 1.462 0 O-C-N 121.244 -0.91 . . . . 1.96 109.455 179.856 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 352' ' ' ASP . . . . . . . . . . . . . 21.1 m-20 -58.11 -40.99 82.59 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.095 -1.003 . . . . 1.16 110.06 -179.874 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 353' ' ' ALA . . . . . . . . . . . . . . . -66.48 -21.98 66.19 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.251 -0.905 . . . . 1.21 109.66 -179.64 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 354' ' ' GLN . . . . . . . . . . . . . 5.5 tt0 -82.14 -14.82 55.12 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.205 -0.934 . . . . 1.69 109.241 179.853 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 355' ' ' ALA . . . . . . . . . . . . . . . -73.09 -2.81 22.86 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.239 -0.913 . . . . 1.3 109.539 179.682 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 356' ' ' GLY . . . . . . . . . . . . . . . -77.51 -79.25 0.72 Allowed Glycine 0 N--CA 1.491 2.328 0 N-CA-C 109.989 -1.244 . . . . 1.29 109.989 -179.538 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 357' ' ' LYS . . . . . . . . . . . . . 3.4 mttp -85.74 104.47 15.48 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.282 -1.128 . . . . 4.45 110.213 -179.28 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 358' ' ' GLU . . . . . 0.466 ' HB2' ' HD2' ' B' ' 359' ' ' PRO . 17.0 pt-20 -52.04 159.02 1.56 Allowed Pre-proline 0 N--CA 1.491 1.599 0 O-C-N 121.276 -0.89 . . . . 5.72 109.484 179.6 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 359' ' ' PRO . . . . . 0.466 ' HD2' ' HB2' ' B' ' 358' ' ' GLU . 2.9 Cg_endo -61.61 -164.2 0.04 OUTLIER 'Trans proline' 0 C--N 1.309 -1.516 0 C-N-CA 122.094 1.863 . . . . 5.6 110.018 179.756 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 360' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 2.405 0 CA-C-O 117.878 -1.512 . . . . 6.98 109.597 -179.884 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' C' C ' 319' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.491 1.583 0 N-CA-C 109.279 -0.637 . . . . 7.03 109.279 . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 320' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 60.54 94.29 0.04 OUTLIER 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.271 -0.893 . . . . 6.84 109.81 179.572 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' C' C ' 321' ' ' LYS . . . . . 0.599 ' CB ' ' HD3' ' C' ' 322' ' ' PRO . 0.0 OUTLIER -160.13 -65.38 0.02 OUTLIER Pre-proline 0 N--CA 1.493 1.676 0 O-C-N 121.085 -1.009 . . . . 6.78 109.844 179.473 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' C' C ' 322' ' ' PRO . . . . . 0.599 ' HD3' ' CB ' ' C' ' 321' ' ' LYS . 3.4 Cg_exo -57.93 -151.0 0.01 OUTLIER 'Trans proline' 0 C--N 1.315 -1.219 0 C-N-CA 121.708 1.605 . . . . 3.98 110.079 179.648 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' C' C ' 323' ' ' LEU . . . . . . . . . . . . . 96.4 mt -77.34 141.66 39.76 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.199 -0.938 . . . . 4.31 109.114 179.697 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 324' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 -77.69 -172.81 2.74 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.2 -0.938 . . . . 1.63 109.711 -179.698 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 325' ' ' GLY . . . . . 0.47 ' O ' ' CE2' ' C' ' 327' ' ' TYR . . . -69.83 176.96 31.92 Favored Glycine 0 N--CA 1.491 2.318 0 N-CA-C 110.223 -1.151 . . . . 0.82 110.223 -179.591 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' C' C ' 326' ' ' GLU . . . . . . . . . . . . . 45.0 mt-10 -59.68 -178.53 0.07 Allowed 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.278 -1.131 . . . . 2.17 109.763 179.921 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 327' ' ' TYR . . . . . 0.48 ' CE1' ' HG2' ' A' ' 333' ' ' ARG . 59.1 m-85 -150.77 108.04 3.61 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.39 -0.819 . . . . 1.03 109.507 -179.905 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' C' C ' 328' ' ' PHE . . . . . 0.402 ' O ' ' CG2' ' C' ' 329' ' ' THR . 67.3 m-85 -104.12 -164.02 1.02 Allowed 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.201 -0.937 . . . . 0.37 109.825 -179.885 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' C' C ' 329' ' ' THR . . . . . 0.479 ' HA ' ' O ' ' A' ' 330' ' ' LEU . 56.1 p -156.28 177.8 11.03 Favored 'General case' 0 N--CA 1.491 1.589 0 N-CA-C 108.997 -0.742 . . . . 1.04 108.997 179.748 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' C' C ' 330' ' ' LEU . . . . . 0.474 ' O ' ' HA ' ' A' ' 329' ' ' THR . 39.3 tp -153.48 132.09 12.23 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 120.949 -1.095 . . . . 1.09 109.492 179.823 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' C' C ' 331' ' ' GLN . . . . . . . . . . . . . 1.1 tp60 -87.56 114.04 23.81 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.133 -0.979 . . . . 1.48 109.547 179.791 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 332' ' ' ILE . . . . . 0.452 HD12 ' CB ' ' C' ' 341' ' ' PHE . 48.5 mt -103.91 108.28 24.23 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.526 0 O-C-N 121.197 -0.939 . . . . 1.08 109.728 -179.933 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' C' C ' 333' ' ' ARG . . . . . 0.442 ' HG2' ' CE1' ' A' ' 327' ' ' TYR . 5.1 mtp180 -72.89 144.98 47.18 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.006 -1.058 . . . . 3.36 109.488 179.848 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' C' C ' 334' ' ' GLY . . . . . . . . . . . . . . . 73.05 130.92 0.15 Allowed Glycine 0 N--CA 1.491 2.322 0 N-CA-C 109.93 -1.268 . . . . 0.35 109.93 179.794 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 335' ' ' ARG . . . . . 0.479 ' O ' ' HB3' ' C' ' 338' ' ' PHE . 2.4 ttp180 -73.45 -27.77 61.6 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.238 -1.154 . . . . 3.23 109.667 179.922 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' C' C ' 336' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -57.08 -58.82 6.52 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 120.961 -1.087 . . . . 2.62 109.158 -179.987 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' C' C ' 337' ' ' ARG . . . . . 0.55 ' HG3' ' NH1' ' C' ' 337' ' ' ARG . 0.5 OUTLIER -60.95 -30.83 70.47 Favored 'General case' 0 N--CA 1.488 1.474 0 O-C-N 121.296 -0.877 . . . . 3.61 108.776 179.618 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' C' C ' 338' ' ' PHE . . . . . 0.479 ' HB3' ' O ' ' C' ' 335' ' ' ARG . 82.6 t80 -54.89 -58.66 6.68 Favored 'General case' 0 C--N 1.304 -1.378 0 O-C-N 121.345 -0.847 . . . . 0.43 109.646 -179.835 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' C' C ' 339' ' ' GLU . . . . . . . . . . . . . 41.2 mt-10 -50.97 -32.63 21.62 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.07 -1.018 . . . . 2.05 109.989 -179.657 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 340' ' ' MET . . . . . . . . . . . . . 29.8 ttp -65.37 -56.24 13.71 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.242 -0.911 . . . . 1.1 110.208 -179.472 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 341' ' ' PHE . . . . . 0.452 ' CB ' HD12 ' C' ' 332' ' ' ILE . 63.9 m-85 -61.44 -53.51 55.53 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.091 -1.006 . . . . 0.21 110.155 -179.416 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' C' C ' 342' ' ' ARG . . . . . 0.438 ' NH1' ' CG ' ' C' ' 342' ' ' ARG . 0.0 OUTLIER -44.8 -41.15 6.73 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.255 -0.903 . . . . 3.42 110.051 -179.265 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' C' C ' 343' ' ' GLU . . . . . . . . . . . . . 36.6 tt0 -57.89 -51.42 69.67 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.162 -0.961 . . . . 2.14 109.77 -179.91 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 344' ' ' LEU . . . . . 0.458 ' O ' HD21 ' C' ' 348' ' ' LEU . 55.8 mt -62.73 -26.87 68.9 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.329 -0.857 . . . . 1.09 109.7 179.983 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' C' C ' 345' ' ' ASN . . . . . . . . . . . . . 13.2 t-20 -58.0 -58.54 7.96 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.281 -0.887 . . . . 1.38 109.501 -179.957 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 346' ' ' GLU . . . . . . . . . . . . . 10.0 tp10 -62.2 -28.88 69.99 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.456 -0.778 . . . . 2.21 109.722 -179.667 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 347' ' ' ALA . . . . . . . . . . . . . . . -60.7 -57.79 11.21 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.103 -0.998 . . . . 1.03 109.984 -179.72 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 348' ' ' LEU . . . . . 0.458 HD21 ' O ' ' C' ' 344' ' ' LEU . 3.5 mm? -62.5 -45.8 91.35 Favored 'General case' 0 N--CA 1.494 1.761 0 O-C-N 121.096 -1.002 . . . . 1.06 110.044 -179.494 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' C' C ' 349' ' ' GLU . . . . . . . . . . . . . 1.3 mm-40 -55.02 -36.02 65.04 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.276 -0.89 . . . . 2.19 109.886 -179.223 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 350' ' ' LEU . . . . . 0.496 HD21 ' CD1' ' D' ' 350' ' ' LEU . 7.0 tt -63.46 -46.88 84.22 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.355 -0.841 . . . . 1.2 109.894 -179.632 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' C' C ' 351' ' ' LYS . . . . . . . . . . . . . 22.8 tttt -58.32 -40.24 81.55 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.355 -0.841 . . . . 1.92 109.672 -179.66 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 352' ' ' ASP . . . . . . . . . . . . . 52.0 m-20 -57.12 -51.69 68.29 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.361 -0.837 . . . . 1.19 109.925 179.993 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 353' ' ' ALA . . . . . . . . . . . . . . . -66.07 -12.44 55.44 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.154 -0.966 . . . . 1.15 109.923 -179.233 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 354' ' ' GLN . . . . . . . . . . . . . 8.9 tt0 -85.68 -27.46 25.33 Favored 'General case' 0 N--CA 1.488 1.47 0 O-C-N 121.183 -0.948 . . . . 1.7 109.577 179.872 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 355' ' ' ALA . . . . . . . . . . . . . . . -73.16 -4.26 31.7 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.313 -0.867 . . . . 1.3 109.55 179.849 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 356' ' ' GLY . . . . . . . . . . . . . . . -58.72 -59.01 11.58 Favored Glycine 0 N--CA 1.492 2.402 0 N-CA-C 109.697 -1.361 . . . . 1.33 109.697 -179.628 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 357' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -86.12 63.89 8.27 Favored 'General case' 0 N--CA 1.488 1.447 0 O-C-N 121.295 -1.121 . . . . 4.39 109.302 -179.924 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' C' C ' 358' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -51.16 141.19 21.01 Favored Pre-proline 0 N--CA 1.49 1.538 0 O-C-N 121.32 -0.863 . . . . 5.75 109.61 -179.842 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' C' C ' 359' ' ' PRO . . . . . . . . . . . . . 1.7 Cg_endo -63.81 105.01 0.5 Allowed 'Trans proline' 0 C--N 1.312 -1.36 0 C-N-CA 122.156 1.904 . . . . 5.54 110.047 179.915 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 360' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.336 0 N-CA-C 109.639 -1.385 . . . . 6.5 109.639 -179.916 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' D' D ' 319' ' ' LYS . . . . . . . . . . . . . 33.6 mttt . . . . . 0 N--CA 1.49 1.569 0 N-CA-C 109.431 -0.581 . . . . 7.93 109.431 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' D' D ' 320' ' ' LYS . . . . . . . . . . . . . 11.6 mttt 62.36 164.64 0.1 Allowed 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.258 -0.901 . . . . 6.7 109.345 -179.981 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' D' D ' 321' ' ' LYS . . . . . 0.432 ' HG2' ' HD2' ' D' ' 322' ' ' PRO . 0.0 OUTLIER -158.02 137.85 8.66 Favored Pre-proline 0 N--CA 1.489 1.52 0 O-C-N 121.344 -0.847 . . . . 6.49 109.175 179.945 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' D' D ' 322' ' ' PRO . . . . . 0.432 ' HD2' ' HG2' ' D' ' 321' ' ' LYS . 2.2 Cg_endo -62.31 -80.98 0.01 OUTLIER 'Trans proline' 0 C--N 1.311 -1.439 0 C-N-CA 121.934 1.756 . . . . 3.29 110.003 179.908 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' D' D ' 323' ' ' LEU . . . . . . . . . . . . . 34.3 mt -78.92 96.68 5.77 Favored 'General case' 0 N--CA 1.488 1.454 0 O-C-N 121.188 -0.945 . . . . 3.16 109.96 -179.708 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' D' D ' 324' ' ' ASP . . . . . . . . . . . . . 3.5 m-20 -81.01 156.45 25.9 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.283 -0.886 . . . . 1.54 109.41 179.731 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' D' D ' 325' ' ' GLY . . . . . 0.554 ' O ' ' CD2' ' D' ' 327' ' ' TYR . . . -69.5 176.71 31.18 Favored Glycine 0 N--CA 1.491 2.355 0 N-CA-C 109.458 -1.457 . . . . 0.65 109.458 -179.955 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' D' D ' 326' ' ' GLU . . . . . . . . . . . . . 38.1 mm-40 -58.6 168.78 1.08 Allowed 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.26 -1.141 . . . . 2.13 109.237 179.939 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' D' D ' 327' ' ' TYR . . . . . 0.554 ' CD2' ' O ' ' D' ' 325' ' ' GLY . 49.0 m-85 -149.67 111.92 4.67 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.22 -0.925 . . . . 1.0 109.553 179.977 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' D' D ' 328' ' ' PHE . . . . . . . . . . . . . 50.6 m-85 -112.12 -170.12 1.6 Allowed 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.265 -0.897 . . . . 0.34 109.206 179.856 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' D' D ' 329' ' ' THR . . . . . 0.448 ' HA ' ' O ' ' B' ' 330' ' ' LEU . 9.8 p -153.2 175.7 12.76 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.231 -0.918 . . . . 1.05 109.147 -179.85 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' D' D ' 330' ' ' LEU . . . . . . . . . . . . . 26.0 tp -151.63 134.03 15.35 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.116 -0.99 . . . . 1.07 109.631 -179.762 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' D' D ' 331' ' ' GLN . . . . . . . . . . . . . 1.9 tp60 -85.81 110.28 19.26 Favored 'General case' 0 N--CA 1.488 1.454 0 O-C-N 121.248 -0.907 . . . . 0.93 109.31 179.88 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' D' D ' 332' ' ' ILE . . . . . 0.439 ' CG2' ' HA ' ' D' ' 338' ' ' PHE . 86.1 mt -102.85 103.37 14.97 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.573 0 O-C-N 121.226 -0.921 . . . . 1.07 109.541 -179.819 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' D' D ' 333' ' ' ARG . . . . . . . . . . . . . 84.9 mtt180 -73.09 143.31 47.44 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.25 -0.906 . . . . 3.42 109.498 179.81 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' D' D ' 334' ' ' GLY . . . . . . . . . . . . . . . 89.16 131.65 4.22 Favored Glycine 0 N--CA 1.49 2.278 0 N-CA-C 109.49 -1.444 . . . . 0.41 109.49 -179.907 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' D' D ' 335' ' ' ARG . . . . . . . . . . . . . 55.9 ttt180 -79.77 -41.71 26.01 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.352 -1.087 . . . . 3.58 109.835 -179.672 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' D' D ' 336' ' ' GLU . . . . . . . . . . . . . 2.8 tt0 -58.26 -58.73 7.19 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.25 -0.906 . . . . 2.26 109.736 -179.724 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' D' D ' 337' ' ' ARG . . . . . 0.474 ' NH2' ' CD1' ' B' ' 348' ' ' LEU . 0.9 OUTLIER -59.75 -33.25 71.42 Favored 'General case' 0 N--CA 1.489 1.478 0 O-C-N 121.28 -0.887 . . . . 3.64 109.354 -179.965 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' D' D ' 338' ' ' PHE . . . . . 0.439 ' HA ' ' CG2' ' D' ' 332' ' ' ILE . 45.7 t80 -55.5 -57.03 13.57 Favored 'General case' 0 N--CA 1.489 1.478 0 O-C-N 121.22 -0.925 . . . . 0.4 109.435 179.978 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' D' D ' 339' ' ' GLU . . . . . . . . . . . . . 45.3 mt-10 -51.25 -31.37 20.69 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.229 -0.919 . . . . 1.99 109.726 -179.856 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' D' D ' 340' ' ' MET . . . . . . . . . . . . . 5.3 ttp -62.59 -53.96 46.8 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.223 -0.923 . . . . 1.13 109.859 -179.576 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' D' D ' 341' ' ' PHE . . . . . . . . . . . . . 40.2 m-85 -61.74 -43.38 98.97 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.145 -0.972 . . . . 0.21 109.692 -179.727 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' D' D ' 342' ' ' ARG . . . . . 0.435 ' NH1' ' CG ' ' D' ' 342' ' ' ARG . 0.1 OUTLIER -49.51 -41.13 40.14 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.268 -0.895 . . . . 3.15 109.608 -179.789 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' D' D ' 343' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -59.36 -48.0 83.3 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.293 -0.88 . . . . 2.35 109.647 -179.862 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' D' D ' 344' ' ' LEU . . . . . . . . . . . . . 57.4 mt -61.99 -30.94 71.28 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.171 -0.956 . . . . 1.06 109.815 -179.777 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' D' D ' 345' ' ' ASN . . . . . . . . . . . . . 10.6 t-20 -57.91 -57.4 12.98 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.157 -0.964 . . . . 1.35 109.559 -179.913 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' D' D ' 346' ' ' GLU . . . . . . . . . . . . . 60.3 tt0 -61.55 -26.63 68.07 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.104 -0.997 . . . . 1.69 109.543 -179.854 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' D' D ' 347' ' ' ALA . . . . . . . . . . . . . . . -60.94 -61.58 2.48 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.137 -0.977 . . . . 1.03 110.136 -179.784 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' D' D ' 348' ' ' LEU . . . . . 0.424 ' N ' HD23 ' D' ' 348' ' ' LEU . 4.2 mm? -60.03 -44.13 94.83 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.164 -0.96 . . . . 1.04 109.946 -179.495 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' D' D ' 349' ' ' GLU . . . . . . . . . . . . . 92.8 mt-10 -58.08 -33.1 68.7 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.067 -1.02 . . . . 1.95 109.851 -179.542 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' D' D ' 350' ' ' LEU . . . . . 0.496 ' CD1' HD21 ' C' ' 350' ' ' LEU . 5.9 tt -63.52 -45.99 88.08 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.201 -0.937 . . . . 1.16 109.352 -179.975 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' D' D ' 351' ' ' LYS . . . . . . . . . . . . . 88.1 tttt -59.68 -41.61 91.08 Favored 'General case' 0 N--CA 1.488 1.456 0 O-C-N 121.298 -0.876 . . . . 1.97 109.383 179.957 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' D' D ' 352' ' ' ASP . . . . . . . . . . . . . 20.9 m-20 -58.17 -40.42 81.41 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.399 -0.813 . . . . 1.17 109.881 179.955 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' D' D ' 353' ' ' ALA . . . . . . . . . . . . . . . -67.56 -20.86 65.45 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.203 -0.936 . . . . 1.21 109.602 -179.39 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' D' D ' 354' ' ' GLN . . . . . . . . . . . . . 5.6 tt0 -83.35 -14.27 53.23 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.1 -1.0 . . . . 1.68 109.169 179.708 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' D' D ' 355' ' ' ALA . . . . . . . . . . . . . . . -73.52 -1.82 20.13 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.453 -0.78 . . . . 1.29 109.502 179.47 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' D' D ' 356' ' ' GLY . . . . . . . . . . . . . . . -78.84 -78.98 0.81 Allowed Glycine 0 N--CA 1.49 2.288 0 N-CA-C 110.085 -1.206 . . . . 1.28 110.085 -179.532 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' D' D ' 357' ' ' LYS . . . . . . . . . . . . . 3.0 mttp -86.05 106.12 16.97 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.346 -1.091 . . . . 4.45 109.718 -179.507 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' D' D ' 358' ' ' GLU . . . . . 0.467 ' HB2' ' HD2' ' D' ' 359' ' ' PRO . 17.0 pt-20 -53.44 159.21 2.41 Favored Pre-proline 0 N--CA 1.491 1.58 0 O-C-N 121.414 -0.804 . . . . 5.71 109.433 179.636 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' D' D ' 359' ' ' PRO . . . . . 0.467 ' HD2' ' HB2' ' D' ' 358' ' ' GLU . 2.9 Cg_endo -61.73 -164.31 0.04 OUTLIER 'Trans proline' 0 C--N 1.309 -1.501 0 C-N-CA 121.934 1.756 . . . . 5.6 109.857 179.776 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' D' D ' 360' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.226 0 N-CA-C 109.484 -1.446 . . . . 6.97 109.484 179.745 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 319' ' ' LYS . . . . . . . . . . . . . 31.1 mttm . . . . . 0 N--CA 1.49 1.555 0 N-CA-C 109.528 -0.545 . . . . 7.95 109.528 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 320' ' ' LYS . . . . . 0.453 ' O ' ' HG3' ' A' ' 321' ' ' LYS . 0.4 OUTLIER 53.97 66.41 1.24 Allowed 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.304 -0.872 . . . . 6.71 109.889 179.984 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 321' ' ' LYS . . . . . 0.6 ' CB ' ' CD ' ' A' ' 322' ' ' PRO . 15.9 mttt -162.06 -64.09 0.02 OUTLIER Pre-proline 0 C--N 1.301 -1.53 0 O-C-N 121.133 -0.98 . . . . 6.5 109.739 179.582 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 322' ' ' PRO . . . . . 0.6 ' CD ' ' CB ' ' A' ' 321' ' ' LYS . 3.3 Cg_exo -57.0 -81.18 0.01 OUTLIER 'Trans proline' 0 C--N 1.311 -1.414 0 C-N-CA 121.79 1.66 . . . . 3.3 110.555 179.783 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 323' ' ' LEU . . . . . . . . . . . . . 62.9 mt -78.27 92.73 4.53 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 120.882 -1.136 . . . . 3.16 109.775 -179.592 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 324' ' ' ASP . . . . . . . . . . . . . 70.1 m-20 -80.38 165.75 21.94 Favored 'General case' 0 C--N 1.303 -1.427 0 O-C-N 121.23 -0.919 . . . . 1.53 109.277 179.788 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 325' ' ' GLY . . . . . 0.45 ' O ' ' CE2' ' A' ' 327' ' ' TYR . . . -68.33 174.0 31.69 Favored Glycine 0 N--CA 1.489 2.214 0 N-CA-C 109.232 -1.547 . . . . 0.67 109.232 -179.793 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 326' ' ' GLU . . . . . . . . . . . . . 2.9 mm-40 -57.5 173.64 0.26 Allowed 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.152 -1.205 . . . . 2.13 109.343 -179.773 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 327' ' ' TYR . . . . . 0.45 ' CE2' ' O ' ' A' ' 325' ' ' GLY . 44.0 m-85 -149.61 112.21 4.76 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.24 -0.912 . . . . 1.0 109.643 179.994 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 328' ' ' PHE . . . . . 0.511 ' CE2' ' HB2' ' C' ' 335' ' ' ARG . 95.9 m-85 -114.26 -168.07 1.31 Allowed 'General case' 0 N--CA 1.488 1.465 0 O-C-N 121.236 -0.915 . . . . 0.34 109.316 179.957 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 329' ' ' THR . . . . . . . . . . . . . 40.2 p -152.77 162.14 41.65 Favored 'General case' 0 N--CA 1.489 1.482 0 O-C-N 121.284 -0.885 . . . . 1.05 109.575 179.927 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 330' ' ' LEU . . . . . . . . . . . . . 18.4 tp -150.58 130.52 13.38 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.375 -0.828 . . . . 1.07 109.433 -179.958 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 331' ' ' GLN . . . . . 0.426 ' HG3' ' O ' ' C' ' 328' ' ' PHE . 1.5 tt0 -86.81 118.38 26.17 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.265 -0.897 . . . . 0.91 109.439 179.903 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 332' ' ' ILE . . . . . 0.408 HD11 ' CD1' ' A' ' 338' ' ' PHE . 9.9 mt -103.46 110.6 30.39 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.527 0 O-C-N 121.286 -0.884 . . . . 1.09 109.673 179.988 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 333' ' ' ARG . . . . . 0.576 ' HG2' ' CE2' ' C' ' 327' ' ' TYR . 44.7 mtt180 -72.92 149.31 43.52 Favored 'General case' 0 C--N 1.303 -1.448 0 O-C-N 121.373 -0.83 . . . . 3.41 109.238 179.728 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 334' ' ' GLY . . . . . . . . . . . . . . . 85.65 129.65 2.29 Favored Glycine 0 N--CA 1.49 2.251 0 N-CA-C 109.619 -1.392 . . . . 0.4 109.619 -179.982 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 335' ' ' ARG . . . . . 0.434 ' O ' ' HB3' ' A' ' 338' ' ' PHE . 31.5 ttp180 -78.92 -44.52 22.45 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.361 -1.082 . . . . 3.55 109.758 -179.92 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 336' ' ' GLU . . . . . . . . . . . . . 1.3 tt0 -58.7 -57.34 13.45 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.231 -0.918 . . . . 2.29 109.717 -179.743 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 337' ' ' ARG . . . . . 0.455 ' NH1' ' CG ' ' A' ' 337' ' ' ARG . 0.0 OUTLIER -59.21 -31.3 68.91 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.278 -0.889 . . . . 3.64 109.523 -179.83 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 338' ' ' PHE . . . . . 0.434 ' HB3' ' O ' ' A' ' 335' ' ' ARG . 60.2 t80 -54.74 -55.86 25.42 Favored 'General case' 0 N--CA 1.489 1.48 0 O-C-N 121.114 -0.991 . . . . 0.41 109.442 179.993 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 339' ' ' GLU . . . . . . . . . . . . . 13.7 mt-10 -51.41 -35.31 38.58 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.196 -0.94 . . . . 1.97 109.903 -179.798 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 340' ' ' MET . . . . . . . . . . . . . 26.2 ttp -63.11 -50.04 72.06 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.222 -0.923 . . . . 1.14 110.068 -179.474 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 341' ' ' PHE . . . . . 0.456 ' CZ ' ' HA ' ' C' ' 345' ' ' ASN . 41.1 m-85 -61.21 -46.16 91.6 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.12 -0.988 . . . . 0.21 109.561 -179.806 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 342' ' ' ARG . . . . . 0.47 ' NH1' ' CG ' ' A' ' 342' ' ' ARG . 0.0 OUTLIER -51.03 -37.55 45.95 Favored 'General case' 0 C--N 1.301 -1.506 0 O-C-N 121.278 -0.889 . . . . 3.15 109.627 -179.933 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 343' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -59.49 -51.7 68.74 Favored 'General case' 0 N--CA 1.489 1.483 0 O-C-N 121.257 -0.902 . . . . 2.35 109.694 -179.488 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 344' ' ' LEU . . . . . 0.474 ' O ' HD21 ' A' ' 348' ' ' LEU . 53.6 mt -60.9 -33.78 73.65 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.308 -0.87 . . . . 1.06 109.375 179.984 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 345' ' ' ASN . . . . . . . . . . . . . 28.5 t-20 -57.95 -56.31 23.6 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.233 -0.917 . . . . 1.36 109.802 -179.984 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 346' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -61.39 -32.79 72.73 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.278 -0.889 . . . . 1.65 110.034 -179.56 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 347' ' ' ALA . . . . . . . . . . . . . . . -58.75 -55.1 39.41 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.061 -1.024 . . . . 1.03 109.948 -179.773 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 348' ' ' LEU . . . . . 0.497 ' N ' ' CD2' ' A' ' 348' ' ' LEU . 4.1 mm? -60.61 -46.45 90.21 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.125 -0.985 . . . . 1.04 109.594 -179.717 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 349' ' ' GLU . . . . . 0.502 ' HG2' ' NH1' ' C' ' 333' ' ' ARG . 1.7 mt-10 -58.11 -29.87 65.83 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.128 -0.982 . . . . 1.94 110.02 -179.648 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 350' ' ' LEU . . . . . 0.456 ' O ' HD22 ' A' ' 350' ' ' LEU . 6.4 tt -64.09 -48.98 74.06 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.028 -1.045 . . . . 1.17 109.173 179.774 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 351' ' ' LYS . . . . . . . . . . . . . 19.3 tttt -58.98 -41.79 88.45 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.421 -0.799 . . . . 1.97 109.447 179.833 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 352' ' ' ASP . . . . . . . . . . . . . 15.1 m-20 -56.7 -39.23 73.48 Favored 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.399 -0.813 . . . . 1.16 109.537 -179.947 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 353' ' ' ALA . . . . . . . . . . . . . . . -66.73 -32.63 74.05 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.294 -0.879 . . . . 1.22 109.611 -179.875 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 354' ' ' GLN . . . . . . . . . . . . . 7.2 tt0 -81.09 -1.15 43.1 Favored 'General case' 0 C--N 1.303 -1.451 0 O-C-N 121.23 -0.919 . . . . 1.71 109.629 -179.989 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 355' ' ' ALA . . . . . . . . . . . . . . . -70.88 -39.06 73.06 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.162 -0.961 . . . . 1.3 110.126 -179.725 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 356' ' ' GLY . . . . . . . . . . . . . . . -80.06 -8.36 87.71 Favored Glycine 0 N--CA 1.491 2.317 0 N-CA-C 109.956 -1.258 . . . . 1.3 109.956 -179.757 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 357' ' ' LYS . . . . . . . . . . . . . 24.4 mttt -89.32 105.35 17.73 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.164 -1.197 . . . . 4.46 109.315 179.641 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 358' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -49.29 143.72 9.26 Favored Pre-proline 0 N--CA 1.488 1.436 0 O-C-N 121.221 -0.924 . . . . 5.75 109.394 -179.991 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 359' ' ' PRO . . . . . . . . . . . . . 1.1 Cg_endo -65.09 -81.81 0.01 OUTLIER 'Trans proline' 0 C--N 1.309 -1.534 0 C-N-CA 122.264 1.976 . . . . 5.63 110.052 -179.969 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 360' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.229 0 CA-C-O 117.94 -1.478 . . . . 6.97 109.478 179.957 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' B' B ' 319' ' ' LYS . . . . . . . . . . . . . 30.4 mttm . . . . . 0 N--CA 1.49 1.544 0 N-CA-C 109.727 -0.471 . . . . 7.95 109.727 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' B' B ' 320' ' ' LYS . . . . . 0.447 ' O ' ' HG3' ' B' ' 321' ' ' LYS . 0.4 OUTLIER 53.16 66.67 1.16 Allowed 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.023 -1.048 . . . . 6.73 110.071 179.768 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' B' B ' 321' ' ' LYS . . . . . 0.598 ' CB ' ' HD3' ' B' ' 322' ' ' PRO . 16.3 mttt -162.6 -63.95 0.01 OUTLIER Pre-proline 0 N--CA 1.492 1.627 0 O-C-N 120.988 -1.07 . . . . 6.5 109.629 179.289 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 322' ' ' PRO . . . . . 0.598 ' HD3' ' CB ' ' B' ' 321' ' ' LYS . 4.0 Cg_exo -56.69 -80.98 0.01 OUTLIER 'Trans proline' 0 C--N 1.315 -1.224 0 C-N-CA 121.811 1.674 . . . . 3.29 110.763 179.537 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 323' ' ' LEU . . . . . . . . . . . . . 63.5 mt -79.29 92.8 5.18 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 120.971 -1.081 . . . . 3.18 109.655 -179.59 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 324' ' ' ASP . . . . . . . . . . . . . 74.9 m-20 -80.32 164.12 23.39 Favored 'General case' 0 N--CA 1.49 1.525 0 O-C-N 121.272 -0.893 . . . . 1.53 109.416 179.613 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 325' ' ' GLY . . . . . 0.458 ' O ' ' CE2' ' B' ' 327' ' ' TYR . . . -66.19 173.13 24.72 Favored Glycine 0 N--CA 1.493 2.446 0 N-CA-C 109.464 -1.454 . . . . 0.65 109.464 179.841 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 326' ' ' GLU . . . . . . . . . . . . . 3.0 mm-40 -57.14 173.15 0.24 Allowed 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.171 -1.193 . . . . 2.13 109.372 -179.931 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 327' ' ' TYR . . . . . 0.564 ' CE1' ' HG2' ' D' ' 333' ' ' ARG . 42.7 m-85 -149.1 111.57 4.73 Favored 'General case' 0 N--CA 1.488 1.458 0 O-C-N 121.254 -0.904 . . . . 0.99 109.62 -179.834 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 328' ' ' PHE . . . . . 0.542 ' CE2' ' HA ' ' D' ' 335' ' ' ARG . 95.3 m-85 -113.72 -167.65 1.23 Allowed 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.245 -0.909 . . . . 0.36 109.415 179.904 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 329' ' ' THR . . . . . . . . . . . . . 38.9 p -153.5 161.35 42.33 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.174 -0.954 . . . . 1.05 109.601 -179.642 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 330' ' ' LEU . . . . . . . . . . . . . 16.3 tp -150.41 131.46 14.36 Favored 'General case' 0 N--CA 1.488 1.432 0 O-C-N 121.235 -0.916 . . . . 1.07 109.249 179.932 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 331' ' ' GLN . . . . . . . . . . . . . 1.5 tt0 -87.25 118.58 26.77 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.368 -0.832 . . . . 0.91 109.495 -179.917 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 332' ' ' ILE . . . . . 0.403 HD11 ' CD1' ' B' ' 338' ' ' PHE . 10.8 mt -103.59 110.14 29.13 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.496 0 O-C-N 121.166 -0.959 . . . . 1.08 109.7 -179.798 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 333' ' ' ARG . . . . . 0.501 ' HG2' ' CE1' ' D' ' 327' ' ' TYR . 46.6 mtt180 -72.65 148.81 44.42 Favored 'General case' 0 N--CA 1.487 1.381 0 O-C-N 121.19 -0.944 . . . . 3.42 109.323 179.585 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 334' ' ' GLY . . . . . . . . . . . . . . . 86.17 129.4 2.43 Favored Glycine 0 N--CA 1.49 2.277 0 N-CA-C 109.553 -1.419 . . . . 0.4 109.553 179.848 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 335' ' ' ARG . . . . . 0.456 ' HA ' ' CE2' ' D' ' 328' ' ' PHE . 31.8 ttp180 -78.5 -45.11 22.78 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.242 -1.152 . . . . 3.55 110.016 -179.844 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 336' ' ' GLU . . . . . . . . . . . . . 1.3 tt0 -58.45 -56.86 16.66 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.153 -0.967 . . . . 2.28 109.651 -179.706 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 337' ' ' ARG . . . . . 0.433 ' NH1' ' CG ' ' B' ' 337' ' ' ARG . 0.0 OUTLIER -59.09 -31.4 68.87 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.294 -0.879 . . . . 3.64 109.544 -179.793 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' B' B ' 338' ' ' PHE . . . . . 0.455 ' HB3' ' O ' ' B' ' 335' ' ' ARG . 60.9 t80 -55.02 -55.82 26.62 Favored 'General case' 0 N--CA 1.488 1.441 0 O-C-N 121.33 -0.856 . . . . 0.39 109.417 179.971 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 339' ' ' GLU . . . . . . . . . . . . . 15.4 mt-10 -51.74 -34.96 41.53 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.333 -0.855 . . . . 1.98 109.789 -179.882 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 340' ' ' MET . . . . . . . . . . . . . 28.8 ttp -63.2 -50.57 69.78 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.105 -0.997 . . . . 1.14 109.909 -179.641 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 341' ' ' PHE . . . . . . . . . . . . . 42.7 m-85 -60.62 -46.32 90.72 Favored 'General case' 0 N--CA 1.494 1.725 0 O-C-N 121.079 -1.013 . . . . 0.22 109.842 -179.906 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 342' ' ' ARG . . . . . 0.465 ' NH1' ' CG ' ' B' ' 342' ' ' ARG . 0.0 OUTLIER -50.86 -38.07 47.13 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.219 -0.926 . . . . 3.15 109.651 -179.862 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' B' B ' 343' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -58.8 -51.83 68.32 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.239 -0.913 . . . . 2.35 109.76 -179.823 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 344' ' ' LEU . . . . . 0.48 ' O ' HD21 ' B' ' 348' ' ' LEU . 52.6 mt -61.39 -32.94 72.88 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.182 -0.949 . . . . 1.05 109.53 -179.839 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 345' ' ' ASN . . . . . . . . . . . . . 28.8 t-20 -58.48 -56.58 20.23 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.301 -0.874 . . . . 1.35 109.573 -179.996 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 346' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -61.31 -32.12 71.97 Favored 'General case' 0 C--N 1.301 -1.54 0 O-C-N 121.417 -0.802 . . . . 1.66 110.086 -179.52 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 347' ' ' ALA . . . . . . . . . . . . . . . -59.15 -55.18 38.32 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.246 -0.909 . . . . 1.02 109.914 -179.577 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 348' ' ' LEU . . . . . 0.488 ' CD2' ' N ' ' B' ' 348' ' ' LEU . 4.1 mm? -60.61 -45.71 93.0 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.252 -0.905 . . . . 1.05 109.856 -179.717 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 349' ' ' GLU . . . . . . . . . . . . . 1.8 mt-10 -58.74 -29.84 67.04 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.137 -0.977 . . . . 1.95 109.762 -179.482 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 350' ' ' LEU . . . . . 0.449 HD23 HD23 ' A' ' 350' ' ' LEU . 6.4 tt -64.11 -48.87 74.42 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.26 -0.9 . . . . 1.18 109.159 179.651 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 351' ' ' LYS . . . . . . . . . . . . . 19.4 tttt -59.54 -41.67 90.59 Favored 'General case' 0 C--N 1.302 -1.462 0 O-C-N 121.348 -0.845 . . . . 1.96 109.437 179.966 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 352' ' ' ASP . . . . . . . . . . . . . 16.7 m-20 -56.55 -39.13 72.91 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.217 -0.927 . . . . 1.16 109.515 179.8 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 353' ' ' ALA . . . . . . . . . . . . . . . -66.76 -33.31 75.35 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.253 -0.904 . . . . 1.21 109.759 -179.91 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 354' ' ' GLN . . . . . . . . . . . . . 7.4 tt0 -80.55 -1.29 41.36 Favored 'General case' 0 N--CA 1.489 1.484 0 O-C-N 121.239 -0.913 . . . . 1.69 109.491 179.927 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 355' ' ' ALA . . . . . . . . . . . . . . . -70.51 -38.52 74.31 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.187 -0.946 . . . . 1.3 110.114 -179.761 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 356' ' ' GLY . . . . . . . . . . . . . . . -80.37 -8.91 87.12 Favored Glycine 0 N--CA 1.491 2.354 0 N-CA-C 109.762 -1.335 . . . . 1.29 109.762 -179.434 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 357' ' ' LYS . . . . . . . . . . . . . 23.5 mttt -89.12 106.15 18.25 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.116 -1.226 . . . . 4.45 109.492 179.854 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 358' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -49.49 143.61 10.1 Favored Pre-proline 0 N--CA 1.491 1.611 0 O-C-N 121.314 -0.867 . . . . 5.72 109.569 -179.877 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 359' ' ' PRO . . . . . . . . . . . . . 1.3 Cg_endo -65.13 -82.69 0.01 OUTLIER 'Trans proline' 0 C--N 1.311 -1.439 0 C-N-CA 121.895 1.73 . . . . 5.6 109.967 179.935 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 360' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.362 0 CA-C-O 117.984 -1.453 . . . . 6.98 109.481 179.788 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' C' C ' 319' ' ' LYS . . . . . 0.42 ' O ' ' HB2' ' C' ' 320' ' ' LYS . 0.0 OUTLIER . . . . . 0 N--CA 1.493 1.71 0 CA-C-O 121.297 0.57 . . . . 7.03 109.484 . . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' C' C ' 320' ' ' LYS . . . . . 0.42 ' HB2' ' O ' ' C' ' 319' ' ' LYS . 4.5 mtmp? 62.33 -97.64 0.07 Allowed 'General case' 0 N--CA 1.488 1.459 0 O-C-N 121.443 -0.786 . . . . 6.84 109.516 -179.99 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' C' C ' 321' ' ' LYS . . . . . 0.48 ' O ' ' O ' ' C' ' 322' ' ' PRO . 3.2 mtmm -159.32 82.98 2.42 Favored Pre-proline 0 N--CA 1.489 1.513 0 O-C-N 120.967 -1.083 . . . . 6.78 109.744 179.938 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' C' C ' 322' ' ' PRO . . . . . 0.48 ' O ' ' O ' ' C' ' 321' ' ' LYS . 3.5 Cg_exo -56.43 -144.0 0.0 OUTLIER 'Trans proline' 0 C--N 1.309 -1.521 0 C-N-CA 122.311 2.007 . . . . 3.98 109.836 179.537 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' C' C ' 323' ' ' LEU . . . . . . . . . . . . . 78.8 mt -74.94 139.39 42.99 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 120.667 -1.271 . . . . 4.31 108.909 -179.969 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 324' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -77.78 166.15 23.29 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.322 -0.861 . . . . 1.63 109.391 -179.666 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 325' ' ' GLY . . . . . . . . . . . . . . . -66.85 -174.59 6.45 Favored Glycine 0 N--CA 1.49 2.246 0 N-CA-C 109.374 -1.491 . . . . 0.82 109.374 179.97 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 326' ' ' GLU . . . . . . . . . . . . . 16.1 mm-40 -58.82 -169.41 0.01 OUTLIER 'General case' 0 N--CA 1.488 1.458 0 O-C-N 121.343 -1.092 . . . . 2.17 109.56 179.976 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 327' ' ' TYR . . . . . 0.576 ' CE2' ' HG2' ' A' ' 333' ' ' ARG . 46.4 m-85 -148.89 111.85 4.87 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.269 -0.895 . . . . 1.03 109.799 -179.978 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' C' C ' 328' ' ' PHE . . . . . 0.426 ' O ' ' HG3' ' A' ' 331' ' ' GLN . 93.5 m-85 -111.12 -167.03 1.13 Allowed 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.236 -0.915 . . . . 0.37 109.538 -179.924 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' C' C ' 329' ' ' THR . . . . . 0.401 HG22 ' O ' ' C' ' 328' ' ' PHE . 10.8 p -154.11 167.53 29.53 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.283 -0.886 . . . . 1.04 109.705 -179.434 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' C' C ' 330' ' ' LEU . . . . . . . . . . . . . 20.2 tp -152.5 132.06 13.04 Favored 'General case' 0 N--CA 1.489 1.525 0 O-C-N 121.15 -0.969 . . . . 1.09 109.89 179.886 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 331' ' ' GLN . . . . . . . . . . . . . 1.2 tt0 -89.23 116.96 27.85 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.337 -0.852 . . . . 1.48 109.428 179.79 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 332' ' ' ILE . . . . . 0.491 HD12 ' CD2' ' C' ' 341' ' ' PHE . 59.9 mt -103.85 115.96 46.74 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.783 0 O-C-N 121.151 -0.968 . . . . 1.08 109.805 -179.892 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' C' C ' 333' ' ' ARG . . . . . 0.502 ' NH1' ' HG2' ' A' ' 349' ' ' GLU . 0.1 OUTLIER -75.06 144.87 42.77 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.258 -0.901 . . . . 3.36 109.727 179.684 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' C' C ' 334' ' ' GLY . . . . . . . . . . . . . . . 82.53 123.7 0.79 Allowed Glycine 0 N--CA 1.491 2.36 0 C-N-CA 120.005 -1.093 . . . . 0.35 110.472 179.307 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 335' ' ' ARG . . . . . 0.52 ' HG2' ' NH1' ' C' ' 335' ' ' ARG . 0.4 OUTLIER -73.4 -31.19 63.73 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.372 -1.075 . . . . 3.23 109.034 179.438 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' C' C ' 336' ' ' GLU . . . . . 0.463 ' OE1' ' HG3' ' C' ' 337' ' ' ARG . 14.1 tm-20 -59.29 -63.57 1.26 Allowed 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.277 -0.889 . . . . 2.62 109.052 179.747 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' C' C ' 337' ' ' ARG . . . . . 0.463 ' HG3' ' OE1' ' C' ' 336' ' ' GLU . 4.0 mtt180 -60.75 -26.21 67.05 Favored 'General case' 0 N--CA 1.487 1.422 0 O-C-N 121.308 -0.87 . . . . 3.61 109.358 179.65 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' C' C ' 338' ' ' PHE . . . . . 0.451 ' HB3' ' O ' ' C' ' 335' ' ' ARG . 86.4 t80 -54.86 -62.2 1.81 Allowed 'General case' 0 C--N 1.305 -1.344 0 O-C-N 121.279 -0.888 . . . . 0.43 109.379 -179.97 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' C' C ' 339' ' ' GLU . . . . . . . . . . . . . 34.2 mt-10 -51.1 -31.58 19.71 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.227 -0.921 . . . . 2.05 110.032 -179.587 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 340' ' ' MET . . . . . 0.426 ' HB3' ' O ' ' C' ' 337' ' ' ARG . 7.1 ttp -63.93 -53.54 48.77 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.213 -0.929 . . . . 1.1 109.841 -179.756 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' C' C ' 341' ' ' PHE . . . . . 0.491 ' CD2' HD12 ' C' ' 332' ' ' ILE . 33.5 m-85 -61.19 -42.53 98.75 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.194 -0.941 . . . . 0.21 109.815 -179.661 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' C' C ' 342' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -46.6 -43.57 17.45 Favored 'General case' 0 C--N 1.301 -1.519 0 O-C-N 121.187 -0.946 . . . . 3.42 109.496 -179.823 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' C' C ' 343' ' ' GLU . . . . . . . . . . . . . 15.8 tp10 -61.45 -40.28 93.9 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 120.988 -1.07 . . . . 2.14 109.635 179.884 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 344' ' ' LEU . . . . . 0.478 HD23 HD23 ' D' ' 344' ' ' LEU . 43.6 mt -63.31 -52.93 59.89 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.156 -0.965 . . . . 1.09 109.77 -179.756 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' C' C ' 345' ' ' ASN . . . . . 0.456 ' HA ' ' CZ ' ' A' ' 341' ' ' PHE . 38.2 t30 -53.86 -44.91 70.76 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.277 -0.889 . . . . 1.38 109.656 -179.759 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' C' C ' 346' ' ' GLU . . . . . . . . . . . . . 3.2 tp10 -62.17 -37.58 85.81 Favored 'General case' 0 N--CA 1.488 1.435 0 O-C-N 121.209 -0.932 . . . . 2.21 109.823 -179.93 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 347' ' ' ALA . . . . . . . . . . . . . . . -59.35 -47.59 84.86 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.184 -0.948 . . . . 1.03 109.516 -179.662 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 348' ' ' LEU . . . . . 0.475 HD21 ' O ' ' C' ' 344' ' ' LEU . 3.9 mm? -63.66 -42.72 98.05 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.258 -0.901 . . . . 1.06 109.706 179.933 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' C' C ' 349' ' ' GLU . . . . . 0.404 ' OE1' ' CZ ' ' A' ' 333' ' ' ARG . 5.4 mm-40 -57.54 -39.14 75.95 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.046 -1.034 . . . . 2.19 109.341 179.996 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' C' C ' 350' ' ' LEU . . . . . 0.54 HD23 ' CD2' ' D' ' 350' ' ' LEU . 6.4 tt -61.31 -43.71 98.42 Favored 'General case' 0 N--CA 1.488 1.458 0 O-C-N 121.539 -0.726 . . . . 1.2 109.323 -179.992 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' C' C ' 351' ' ' LYS . . . . . . . . . . . . . 8.9 tttp -60.96 -41.91 97.25 Favored 'General case' 0 C--N 1.304 -1.395 0 O-C-N 121.116 -0.99 . . . . 1.92 109.085 179.867 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 352' ' ' ASP . . . . . . . . . . . . . 77.2 m-20 -52.76 -58.15 7.81 Favored 'General case' 0 N--CA 1.488 1.449 0 O-C-N 121.382 -0.824 . . . . 1.19 109.239 179.898 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 353' ' ' ALA . . . . . . . . . . . . . . . -69.49 -15.49 63.27 Favored 'General case' 0 N--CA 1.489 1.478 0 O-C-N 121.276 -0.89 . . . . 1.15 109.457 -179.956 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 354' ' ' GLN . . . . . 0.473 ' NE2' ' CD1' ' D' ' 350' ' ' LEU . 0.0 OUTLIER -86.21 -15.43 40.92 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.263 -0.898 . . . . 1.7 109.616 179.991 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' C' C ' 355' ' ' ALA . . . . . . . . . . . . . . . -72.25 -18.97 61.78 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.078 -1.014 . . . . 1.3 109.186 179.697 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 356' ' ' GLY . . . . . . . . . . . . . . . -81.26 -1.46 90.04 Favored Glycine 0 N--CA 1.491 2.363 0 N-CA-C 109.601 -1.399 . . . . 1.33 109.601 179.778 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 357' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -86.91 22.62 1.95 Allowed 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.017 -1.284 . . . . 4.39 109.963 -179.617 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' C' C ' 358' ' ' GLU . . . . . 0.556 ' N ' ' HD2' ' C' ' 359' ' ' PRO . 0.1 OUTLIER -49.12 -53.17 41.43 Favored Pre-proline 0 N--CA 1.489 1.486 0 O-C-N 120.896 -1.127 . . . . 5.75 109.629 179.637 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' C' C ' 359' ' ' PRO . . . . . 0.556 ' HD2' ' N ' ' C' ' 358' ' ' GLU . 5.8 Cg_exo -60.74 -169.05 0.05 OUTLIER 'Trans proline' 0 C--N 1.31 -1.476 0 C-N-CA 121.855 1.703 . . . . 5.54 110.329 -179.898 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' C' C ' 360' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.227 0 CA-C-O 117.951 -1.471 . . . . 6.5 109.68 -179.843 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' D' D ' 319' ' ' LYS . . . . . . . . . . . . . 30.0 mttm . . . . . 0 N--CA 1.491 1.601 0 CA-C-O 121.102 0.477 . . . . 7.93 109.889 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' D' D ' 320' ' ' LYS . . . . . 0.453 ' O ' ' HG3' ' D' ' 321' ' ' LYS . 0.3 OUTLIER 53.4 65.59 1.47 Allowed 'General case' 0 N--CA 1.494 1.742 0 O-C-N 121.138 -0.976 . . . . 6.7 110.227 179.868 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' D' D ' 321' ' ' LYS . . . . . 0.595 ' CB ' ' HD3' ' D' ' 322' ' ' PRO . 16.4 mttt -162.03 -63.73 0.02 OUTLIER Pre-proline 0 N--CA 1.491 1.593 0 O-C-N 121.246 -0.909 . . . . 6.49 109.968 179.25 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' D' D ' 322' ' ' PRO . . . . . 0.595 ' HD3' ' CB ' ' D' ' 321' ' ' LYS . 4.8 Cg_exo -56.43 -80.77 0.01 OUTLIER 'Trans proline' 0 C--N 1.313 -1.32 0 C-N-CA 121.94 1.76 . . . . 3.29 110.716 179.846 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' D' D ' 323' ' ' LEU . . . . . . . . . . . . . 64.6 mt -79.95 93.36 5.69 Favored 'General case' 0 N--CA 1.488 1.456 0 O-C-N 121.096 -1.002 . . . . 3.16 109.417 -179.587 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' D' D ' 324' ' ' ASP . . . . . . . . . . . . . 76.2 m-20 -80.75 165.26 22.1 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.499 -0.751 . . . . 1.54 109.396 179.827 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' D' D ' 325' ' ' GLY . . . . . 0.453 ' O ' ' CE2' ' D' ' 327' ' ' TYR . . . -67.36 173.74 28.53 Favored Glycine 0 N--CA 1.491 2.326 0 N-CA-C 109.615 -1.394 . . . . 0.65 109.615 -179.932 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' D' D ' 326' ' ' GLU . . . . . . . . . . . . . 3.3 mm-40 -57.43 173.5 0.26 Allowed 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.033 -1.275 . . . . 2.13 109.348 -179.769 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' D' D ' 327' ' ' TYR . . . . . 0.501 ' CE1' ' HG2' ' B' ' 333' ' ' ARG . 43.3 m-85 -149.75 111.37 4.51 Favored 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.012 -1.055 . . . . 1.0 109.436 179.959 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' D' D ' 328' ' ' PHE . . . . . 0.456 ' CE2' ' HA ' ' B' ' 335' ' ' ARG . 97.1 m-85 -113.4 -167.67 1.23 Allowed 'General case' 0 N--CA 1.488 1.472 0 O-C-N 121.375 -0.828 . . . . 0.34 109.184 -179.791 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' D' D ' 329' ' ' THR . . . . . . . . . . . . . 37.9 p -153.55 161.68 41.98 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.209 -0.932 . . . . 1.05 109.464 -179.957 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' D' D ' 330' ' ' LEU . . . . . . . . . . . . . 17.7 tp -150.48 130.89 13.78 Favored 'General case' 0 N--CA 1.488 1.474 0 O-C-N 121.464 -0.773 . . . . 1.07 109.473 -179.9 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' D' D ' 331' ' ' GLN . . . . . 0.44 ' HG3' ' O ' ' B' ' 328' ' ' PHE . 1.6 tt0 -86.69 119.87 27.38 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.017 -1.052 . . . . 0.93 109.325 179.835 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' D' D ' 332' ' ' ILE . . . . . 0.405 HD11 ' CD1' ' D' ' 338' ' ' PHE . 12.4 mt -104.4 109.58 27.86 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.564 0 O-C-N 121.094 -1.004 . . . . 1.07 109.636 -179.894 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' D' D ' 333' ' ' ARG . . . . . 0.564 ' HG2' ' CE1' ' B' ' 327' ' ' TYR . 46.1 mtt180 -72.28 149.97 44.01 Favored 'General case' 0 C--N 1.302 -1.465 0 O-C-N 121.106 -0.996 . . . . 3.42 109.209 179.827 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' D' D ' 334' ' ' GLY . . . . . . . . . . . . . . . 85.53 129.63 2.25 Favored Glycine 0 N--CA 1.493 2.486 0 N-CA-C 109.645 -1.382 . . . . 0.41 109.645 -179.911 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' D' D ' 335' ' ' ARG . . . . . 0.542 ' HA ' ' CE2' ' B' ' 328' ' ' PHE . 32.2 ttp180 -78.82 -45.96 19.75 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.007 -1.29 . . . . 3.58 109.647 179.898 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' D' D ' 336' ' ' GLU . . . . . . . . . . . . . 1.3 tt0 -57.65 -56.63 19.48 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.101 -0.999 . . . . 2.26 109.665 -179.821 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' D' D ' 337' ' ' ARG . . . . . 0.422 ' NH1' ' CG ' ' D' ' 337' ' ' ARG . 0.0 OUTLIER -59.32 -31.2 68.94 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.159 -0.963 . . . . 3.64 109.669 -179.769 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' D' D ' 338' ' ' PHE . . . . . 0.471 ' HB3' ' O ' ' D' ' 335' ' ' ARG . 61.2 t80 -55.26 -54.98 36.69 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.292 -0.88 . . . . 0.4 109.532 179.923 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' D' D ' 339' ' ' GLU . . . . . . . . . . . . . 17.1 mt-10 -52.36 -34.62 48.47 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.197 -0.94 . . . . 1.99 109.756 -179.687 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' D' D ' 340' ' ' MET . . . . . . . . . . . . . 31.1 ttp -63.52 -49.92 71.61 Favored 'General case' 0 N--CA 1.488 1.466 0 O-C-N 121.23 -0.919 . . . . 1.13 109.966 -179.616 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' D' D ' 341' ' ' PHE . . . . . . . . . . . . . 42.1 m-85 -61.37 -47.05 87.63 Favored 'General case' 0 N--CA 1.488 1.467 0 O-C-N 121.108 -0.995 . . . . 0.21 109.551 -179.687 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' D' D ' 342' ' ' ARG . . . . . 0.459 ' NH1' ' CG ' ' D' ' 342' ' ' ARG . 0.0 OUTLIER -50.24 -37.87 37.78 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.175 -0.953 . . . . 3.15 109.86 -179.876 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' D' D ' 343' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -59.07 -51.58 69.42 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.303 -0.873 . . . . 2.35 109.673 -179.701 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' D' D ' 344' ' ' LEU . . . . . 0.478 HD23 HD23 ' C' ' 344' ' ' LEU . 56.1 mt -61.52 -33.03 73.12 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.191 -0.943 . . . . 1.06 109.455 179.959 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' D' D ' 345' ' ' ASN . . . . . 0.42 ' ND2' ' OE2' ' D' ' 349' ' ' GLU . 29.3 t-20 -58.38 -56.29 24.01 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.258 -0.901 . . . . 1.35 109.718 179.932 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' D' D ' 346' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -61.63 -32.61 72.76 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.421 -0.8 . . . . 1.69 109.92 -179.634 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' D' D ' 347' ' ' ALA . . . . . . . . . . . . . . . -58.4 -55.22 37.86 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.053 -1.029 . . . . 1.03 109.827 -179.701 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' D' D ' 348' ' ' LEU . . . . . 0.492 ' CD2' ' N ' ' D' ' 348' ' ' LEU . 4.2 mm? -61.02 -46.47 90.62 Favored 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.17 -0.956 . . . . 1.04 109.844 -179.46 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' D' D ' 349' ' ' GLU . . . . . 0.42 ' OE2' ' ND2' ' D' ' 345' ' ' ASN . 1.8 mt-10 -57.85 -29.89 65.36 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.184 -0.947 . . . . 1.95 109.736 -179.582 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' D' D ' 350' ' ' LEU . . . . . 0.54 ' CD2' HD23 ' C' ' 350' ' ' LEU . 6.3 tt -63.88 -49.37 72.97 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.099 -1.001 . . . . 1.16 109.292 179.853 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' D' D ' 351' ' ' LYS . . . . . . . . . . . . . 19.8 tttt -59.19 -42.14 90.15 Favored 'General case' 0 C--N 1.303 -1.449 0 O-C-N 121.47 -0.769 . . . . 1.97 109.403 179.78 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' D' D ' 352' ' ' ASP . . . . . . . . . . . . . 17.8 m-20 -56.1 -38.85 71.3 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.396 -0.815 . . . . 1.17 109.562 179.601 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' D' D ' 353' ' ' ALA . . . . . . . . . . . . . . . -67.19 -33.49 75.5 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.116 -0.99 . . . . 1.21 109.608 -179.909 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' D' D ' 354' ' ' GLN . . . . . . . . . . . . . 7.6 tt0 -80.68 -0.51 38.55 Favored 'General case' 0 N--CA 1.488 1.475 0 O-C-N 121.131 -0.98 . . . . 1.68 109.497 -179.934 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' D' D ' 355' ' ' ALA . . . . . . . . . . . . . . . -71.29 -37.41 71.84 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.197 -0.94 . . . . 1.29 110.116 -179.742 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' D' D ' 356' ' ' GLY . . . . . . . . . . . . . . . -80.86 -8.87 87.0 Favored Glycine 0 N--CA 1.492 2.398 0 N-CA-C 110.02 -1.232 . . . . 1.28 110.02 -179.591 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' D' D ' 357' ' ' LYS . . . . . . . . . . . . . 22.6 mttt -89.34 107.35 19.02 Favored 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.217 -1.167 . . . . 4.45 109.455 179.761 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' D' D ' 358' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -50.19 144.05 11.85 Favored Pre-proline 0 N--CA 1.489 1.505 0 O-C-N 121.288 -0.882 . . . . 5.71 109.483 -179.892 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' D' D ' 359' ' ' PRO . . . . . . . . . . . . . 1.1 Cg_endo -64.85 -82.68 0.01 OUTLIER 'Trans proline' 0 C--N 1.31 -1.462 0 C-N-CA 122.008 1.805 . . . . 5.6 110.008 179.916 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' D' D ' 360' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.255 0 CA-C-O 117.91 -1.495 . . . . 6.97 109.513 179.826 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 319' ' ' LYS . . . . . 0.429 ' O ' ' O ' ' A' ' 320' ' ' LYS . 13.0 mtmt . . . . . 0 N--CA 1.491 1.6 0 N-CA-C 109.365 -0.606 . . . . 7.95 109.365 . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 320' ' ' LYS . . . . . 0.429 ' O ' ' O ' ' A' ' 319' ' ' LYS . 6.0 tttp 59.86 114.36 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.232 -0.917 . . . . 6.71 109.593 179.983 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 321' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -158.93 92.06 1.95 Allowed Pre-proline 0 N--CA 1.49 1.558 0 O-C-N 121.254 -0.904 . . . . 6.5 109.474 179.937 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 322' ' ' PRO . . . . . . . . . . . . . 2.2 Cg_endo -62.07 -47.2 10.9 Favored 'Trans proline' 0 C--N 1.31 -1.476 0 C-N-CA 122.113 1.875 . . . . 3.3 109.956 179.982 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 323' ' ' LEU . . . . . . . . . . . . . 19.6 mt -81.33 96.43 7.31 Favored 'General case' 0 N--CA 1.49 1.525 0 O-C-N 121.309 -0.869 . . . . 3.16 109.415 179.903 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 324' ' ' ASP . . . . . . . . . . . . . 8.1 m-20 -80.18 148.82 30.73 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.174 -0.953 . . . . 1.53 109.091 179.839 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 325' ' ' GLY . . . . . 0.466 ' O ' ' CE2' ' A' ' 327' ' ' TYR . . . -67.44 171.87 32.41 Favored Glycine 0 N--CA 1.49 2.273 0 N-CA-C 109.052 -1.619 . . . . 0.67 109.052 179.959 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 326' ' ' GLU . . . . . . . . . . . . . 3.0 mt-10 -56.7 174.36 0.16 Allowed 'General case' 0 N--CA 1.488 1.454 0 O-C-N 121.109 -1.23 . . . . 2.13 109.07 -179.893 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 327' ' ' TYR . . . . . 0.466 ' CE2' ' O ' ' A' ' 325' ' ' GLY . 47.3 m-85 -148.83 111.4 4.75 Favored 'General case' 0 N--CA 1.489 1.476 0 O-C-N 121.256 -0.902 . . . . 1.0 109.527 -179.835 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 328' ' ' PHE . . . . . 0.409 ' CE2' ' HA ' ' C' ' 335' ' ' ARG . 86.4 m-85 -113.87 -168.47 1.35 Allowed 'General case' 0 N--CA 1.488 1.451 0 O-C-N 121.347 -0.845 . . . . 0.34 109.532 -179.808 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 329' ' ' THR . . . . . 0.451 ' HA ' ' O ' ' C' ' 330' ' ' LEU . 24.4 p -153.56 165.21 36.61 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.346 -0.846 . . . . 1.05 109.078 179.94 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 330' ' ' LEU . . . . . 0.448 ' O ' ' HA ' ' C' ' 329' ' ' THR . 14.7 tp -151.47 131.33 13.29 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.045 -1.034 . . . . 1.07 109.877 -179.803 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 331' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -87.55 120.77 29.19 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.279 -0.888 . . . . 0.91 109.165 179.615 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 332' ' ' ILE . . . . . . . . . . . . . 59.6 mt -103.56 111.1 32.0 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.548 0 O-C-N 121.235 -0.916 . . . . 1.09 109.664 -179.794 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 333' ' ' ARG . . . . . 0.443 ' NH1' ' CG ' ' A' ' 333' ' ' ARG . 0.0 OUTLIER -72.59 139.56 47.51 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.403 -0.811 . . . . 3.41 109.35 179.83 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 334' ' ' GLY . . . . . . . . . . . . . . . 85.76 136.6 4.09 Favored Glycine 0 N--CA 1.49 2.251 0 N-CA-C 109.697 -1.361 . . . . 0.4 109.697 179.878 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 335' ' ' ARG . . . . . 0.487 ' NH1' ' HG3' ' A' ' 335' ' ' ARG . 0.3 OUTLIER -80.11 -36.17 35.74 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.405 -1.056 . . . . 3.55 109.582 -179.921 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 336' ' ' GLU . . . . . . . . . . . . . 52.2 tt0 -58.58 -57.24 13.84 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.238 -0.914 . . . . 2.29 110.052 -179.634 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 337' ' ' ARG . . . . . 0.548 ' HG3' ' NH1' ' A' ' 337' ' ' ARG . 0.6 OUTLIER -60.0 -30.36 69.09 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.117 -0.989 . . . . 3.64 109.815 -179.625 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 338' ' ' PHE . . . . . . . . . . . . . 88.8 t80 -54.34 -62.99 1.29 Allowed 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.214 -0.929 . . . . 0.41 109.756 -179.73 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 339' ' ' GLU . . . . . . . . . . . . . 80.9 mt-10 -51.88 -31.46 28.22 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.211 -0.93 . . . . 1.97 110.205 -179.667 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 340' ' ' MET . . . . . . . . . . . . . 28.0 ttp -63.8 -53.62 47.94 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.134 -0.979 . . . . 1.14 110.121 -179.432 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 341' ' ' PHE . . . . . . . . . . . . . 39.2 m-85 -62.25 -48.59 79.26 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.171 -0.955 . . . . 0.21 110.023 -179.533 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 342' ' ' ARG . . . . . . . . . . . . . 70.3 ttt180 -48.85 -38.38 22.17 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.161 -0.962 . . . . 3.15 109.858 -179.71 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 343' ' ' GLU . . . . . . . . . . . . . 42.5 tt0 -59.42 -49.45 77.77 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.157 -0.964 . . . . 2.35 109.896 -179.705 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 344' ' ' LEU . . . . . 0.448 ' O ' HD21 ' A' ' 348' ' ' LEU . 42.2 mt -61.32 -37.96 85.14 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.092 -1.005 . . . . 1.06 109.714 -179.597 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 345' ' ' ASN . . . . . 0.437 ' HA ' ' CZ ' ' C' ' 341' ' ' PHE . 60.6 t-20 -57.01 -50.37 72.94 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.165 -0.959 . . . . 1.36 109.675 -179.936 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 346' ' ' GLU . . . . . . . . . . . . . 2.7 tt0 -60.71 -34.44 74.38 Favored 'General case' 0 N--CA 1.489 1.49 0 O-C-N 121.263 -0.898 . . . . 1.65 109.894 -179.755 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 347' ' ' ALA . . . . . . . . . . . . . . . -60.84 -51.65 68.42 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.128 -0.982 . . . . 1.03 110.047 -179.771 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 348' ' ' LEU . . . . . 0.478 ' N ' HD23 ' A' ' 348' ' ' LEU . 3.9 mm? -61.41 -44.84 96.44 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.165 -0.96 . . . . 1.04 110.003 -179.508 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 349' ' ' GLU . . . . . . . . . . . . . 39.3 mt-10 -58.02 -40.58 81.17 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.27 -0.894 . . . . 1.94 110.337 -179.281 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 350' ' ' LEU . . . . . 0.515 HD23 HD23 ' B' ' 350' ' ' LEU . 8.5 tt -63.59 -48.37 77.67 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.16 -0.963 . . . . 1.17 109.977 -179.317 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 351' ' ' LYS . . . . . . . . . . . . . 25.3 tttt -55.43 -41.84 73.35 Favored 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.259 -0.901 . . . . 1.97 109.329 -179.548 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 352' ' ' ASP . . . . . . . . . . . . . 23.0 m-20 -59.36 -48.32 82.07 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.38 -0.825 . . . . 1.16 109.778 179.902 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 353' ' ' ALA . . . . . . . . . . . . . . . -67.49 -9.5 42.82 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.29 -0.881 . . . . 1.22 110.177 -179.419 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 354' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -83.91 -28.23 28.05 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.051 -1.03 . . . . 1.71 109.628 -179.945 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 355' ' ' ALA . . . . . . . . . . . . . . . -73.79 -21.36 60.19 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.256 -0.903 . . . . 1.3 109.545 179.8 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 356' ' ' GLY . . . . . . . . . . . . . . . -81.91 31.04 2.84 Favored Glycine 0 N--CA 1.493 2.48 0 N-CA-C 110.544 -1.022 . . . . 1.3 110.544 179.936 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 357' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -87.28 124.92 33.85 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 120.831 -1.393 . . . . 4.46 109.43 -179.897 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 358' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -49.9 155.68 1.47 Allowed Pre-proline 0 N--CA 1.489 1.51 0 O-C-N 121.22 -0.925 . . . . 5.75 109.403 -179.983 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 359' ' ' PRO . . . . . . . . . . . . . 3.2 Cg_exo -61.84 138.34 73.45 Favored 'Trans proline' 0 C--N 1.309 -1.519 0 C-N-CA 122.257 1.971 . . . . 5.63 110.189 -179.785 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 360' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.244 0 CA-C-O 117.995 -1.447 . . . . 6.97 109.522 179.952 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' B' B ' 319' ' ' LYS . . . . . 0.426 ' O ' ' O ' ' B' ' 320' ' ' LYS . 13.5 mtmt . . . . . 0 N--CA 1.491 1.578 0 N-CA-C 109.518 -0.549 . . . . 7.95 109.518 . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 320' ' ' LYS . . . . . 0.426 ' O ' ' O ' ' B' ' 319' ' ' LYS . 6.0 tttp 60.09 114.35 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.318 -0.864 . . . . 6.73 109.513 179.963 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 321' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -158.87 91.94 1.98 Allowed Pre-proline 0 N--CA 1.488 1.455 0 O-C-N 121.222 -0.924 . . . . 6.5 109.457 179.978 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 322' ' ' PRO . . . . . . . . . . . . . 2.2 Cg_endo -61.87 -47.3 11.11 Favored 'Trans proline' 0 C--N 1.309 -1.523 0 C-N-CA 122.147 1.898 . . . . 3.29 110.004 179.927 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 323' ' ' LEU . . . . . . . . . . . . . 19.8 mt -81.22 96.45 7.25 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.289 -0.882 . . . . 3.18 109.472 179.868 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 324' ' ' ASP . . . . . . . . . . . . . 7.3 m-20 -80.36 147.39 31.08 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.211 -0.931 . . . . 1.53 109.264 179.811 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 325' ' ' GLY . . . . . 0.455 ' O ' ' CE2' ' B' ' 327' ' ' TYR . . . -65.55 171.86 24.5 Favored Glycine 0 N--CA 1.49 2.244 0 N-CA-C 109.174 -1.571 . . . . 0.65 109.174 179.798 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 326' ' ' GLU . . . . . . . . . . . . . 2.9 mt-10 -57.09 174.54 0.17 Allowed 'General case' 0 N--CA 1.488 1.465 0 O-C-N 121.092 -1.24 . . . . 2.13 109.093 179.928 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 327' ' ' TYR . . . . . 0.455 ' CE2' ' O ' ' B' ' 325' ' ' GLY . 47.0 m-85 -148.85 111.41 4.75 Favored 'General case' 0 N--CA 1.488 1.44 0 O-C-N 121.203 -0.935 . . . . 0.99 109.531 -179.858 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 328' ' ' PHE . . . . . 0.41 ' CE2' ' HA ' ' D' ' 335' ' ' ARG . 86.3 m-85 -114.01 -168.58 1.37 Allowed 'General case' 0 N--CA 1.489 1.48 0 O-C-N 121.336 -0.852 . . . . 0.36 109.53 -179.845 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 329' ' ' THR . . . . . 0.407 ' HA ' ' O ' ' D' ' 330' ' ' LEU . 23.9 p -153.48 165.23 36.51 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.32 -0.862 . . . . 1.05 109.146 179.989 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 330' ' ' LEU . . . . . 0.419 ' O ' ' HA ' ' D' ' 329' ' ' THR . 14.8 tp -151.49 131.26 13.2 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.093 -1.004 . . . . 1.07 109.927 -179.739 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 331' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -87.48 120.65 28.99 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.225 -0.922 . . . . 0.91 109.166 179.63 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 332' ' ' ILE . . . . . . . . . . . . . 59.7 mt -103.52 111.1 31.96 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.526 0 O-C-N 121.15 -0.969 . . . . 1.08 109.722 -179.804 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 333' ' ' ARG . . . . . 0.448 ' CG ' ' NH1' ' B' ' 333' ' ' ARG . 0.0 OUTLIER -72.53 139.56 47.64 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.254 -0.903 . . . . 3.42 109.411 179.852 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' B' B ' 334' ' ' GLY . . . . . . . . . . . . . . . 85.87 136.37 4.08 Favored Glycine 0 N--CA 1.49 2.295 0 N-CA-C 109.655 -1.378 . . . . 0.4 109.655 179.861 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 335' ' ' ARG . . . . . 0.495 ' NH1' ' HG3' ' B' ' 335' ' ' ARG . 0.3 OUTLIER -80.03 -36.15 36.2 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.253 -1.145 . . . . 3.55 109.579 -179.975 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' B' B ' 336' ' ' GLU . . . . . . . . . . . . . 52.5 tt0 -58.56 -57.21 13.97 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.309 -0.87 . . . . 2.28 110.05 -179.719 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 337' ' ' ARG . . . . . 0.531 ' NH1' ' HG3' ' B' ' 337' ' ' ARG . 0.6 OUTLIER -60.04 -30.37 69.14 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.11 -0.994 . . . . 3.64 109.826 -179.548 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' B' B ' 338' ' ' PHE . . . . . . . . . . . . . 88.9 t80 -54.4 -62.86 1.38 Allowed 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.222 -0.924 . . . . 0.39 109.833 -179.751 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 339' ' ' GLU . . . . . . . . . . . . . 81.6 mt-10 -51.97 -31.38 28.92 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.235 -0.916 . . . . 1.98 110.178 -179.666 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 340' ' ' MET . . . . . . . . . . . . . 28.3 ttp -63.73 -53.73 46.56 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.091 -1.005 . . . . 1.14 110.139 -179.491 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 341' ' ' PHE . . . . . . . . . . . . . 39.3 m-85 -62.19 -48.66 79.05 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.167 -0.958 . . . . 0.22 109.978 -179.48 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 342' ' ' ARG . . . . . . . . . . . . . 70.4 ttt180 -48.72 -38.28 21.1 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.2 -0.937 . . . . 3.15 109.964 -179.734 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 343' ' ' GLU . . . . . . . . . . . . . 43.0 tt0 -59.63 -49.3 78.3 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.194 -0.941 . . . . 2.35 109.967 -179.713 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 344' ' ' LEU . . . . . 0.448 ' O ' HD21 ' B' ' 348' ' ' LEU . 42.6 mt -61.31 -38.03 85.36 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.205 -0.934 . . . . 1.05 109.747 -179.717 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 345' ' ' ASN . . . . . 0.414 ' HA ' ' CZ ' ' D' ' 341' ' ' PHE . 60.6 t-20 -57.07 -50.15 73.65 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.245 -0.909 . . . . 1.35 109.621 -179.879 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 346' ' ' GLU . . . . . . . . . . . . . 2.7 tt0 -60.87 -34.41 74.58 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.224 -0.922 . . . . 1.66 109.826 -179.709 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 347' ' ' ALA . . . . . . . . . . . . . . . -60.9 -51.56 68.77 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.153 -0.967 . . . . 1.02 110.087 -179.693 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 348' ' ' LEU . . . . . 0.482 ' N ' HD23 ' B' ' 348' ' ' LEU . 3.9 mm? -61.41 -44.94 96.27 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.211 -0.931 . . . . 1.05 110.049 -179.561 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 349' ' ' GLU . . . . . . . . . . . . . 39.5 mt-10 -58.08 -40.28 80.69 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.224 -0.922 . . . . 1.95 110.378 -179.343 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 350' ' ' LEU . . . . . 0.515 HD23 HD23 ' A' ' 350' ' ' LEU . 8.5 tt -63.79 -48.21 77.81 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.256 -0.902 . . . . 1.18 110.067 -179.411 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 351' ' ' LYS . . . . . . . . . . . . . 25.8 tttt -55.61 -41.83 74.02 Favored 'General case' 0 N--CA 1.488 1.441 0 O-C-N 121.198 -0.939 . . . . 1.96 109.27 -179.513 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 352' ' ' ASP . . . . . 0.504 ' OD2' ' NH2' ' D' ' 337' ' ' ARG . 23.3 m-20 -59.27 -48.43 81.66 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.282 -0.886 . . . . 1.16 109.828 179.797 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 353' ' ' ALA . . . . . . . . . . . . . . . -67.46 -9.7 44.46 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.241 -0.912 . . . . 1.21 110.116 -179.469 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 354' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -83.92 -28.38 27.9 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.046 -1.034 . . . . 1.69 109.536 -179.824 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 355' ' ' ALA . . . . . . . . . . . . . . . -73.68 -21.33 60.29 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.239 -0.913 . . . . 1.3 109.431 179.875 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 356' ' ' GLY . . . . . . . . . . . . . . . -81.84 30.93 2.83 Favored Glycine 0 N--CA 1.493 2.496 0 N-CA-C 110.561 -1.015 . . . . 1.29 110.561 -179.96 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 357' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -87.12 124.95 33.81 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 120.911 -1.347 . . . . 4.45 109.487 -179.934 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 358' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -49.96 155.62 1.51 Allowed Pre-proline 0 N--CA 1.491 1.584 0 O-C-N 121.251 -0.906 . . . . 5.72 109.393 179.877 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 359' ' ' PRO . . . . . . . . . . . . . 3.1 Cg_exo -61.65 138.57 75.95 Favored 'Trans proline' 0 C--N 1.31 -1.487 0 C-N-CA 122.224 1.949 . . . . 5.6 110.298 -179.948 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 360' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.258 0 CA-C-O 117.965 -1.464 . . . . 6.98 109.446 179.915 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' C' C ' 319' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.491 1.598 0 CA-C-O 121.297 0.57 . . . . 7.03 109.516 . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 320' ' ' LYS . . . . . . . . . . . . . 16.2 mttt 64.16 99.44 0.04 OUTLIER 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.328 -0.858 . . . . 6.84 109.543 179.989 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 321' ' ' LYS . . . . . 0.416 ' O ' ' O ' ' C' ' 322' ' ' PRO . 22.0 mtmt -81.64 153.35 70.55 Favored Pre-proline 0 N--CA 1.488 1.463 0 O-C-N 121.168 -0.958 . . . . 6.78 109.348 179.862 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' C' C ' 322' ' ' PRO . . . . . 0.416 ' O ' ' O ' ' C' ' 321' ' ' LYS . 6.1 Cg_exo -57.89 -150.56 0.01 OUTLIER 'Trans proline' 0 C--N 1.31 -1.48 0 C-N-CA 122.16 1.907 . . . . 3.98 110.101 -179.891 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' C' C ' 323' ' ' LEU . . . . . . . . . . . . . 83.9 mt -78.48 113.39 16.45 Favored 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.087 -1.008 . . . . 4.31 109.139 179.92 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 324' ' ' ASP . . . . . . . . . . . . . 43.3 m-20 -78.32 179.5 6.92 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.268 -0.895 . . . . 1.63 109.481 -179.698 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 325' ' ' GLY . . . . . . . . . . . . . . . -68.41 171.63 36.45 Favored Glycine 0 N--CA 1.488 2.162 0 N-CA-C 109.363 -1.495 . . . . 0.82 109.363 -179.958 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 326' ' ' GLU . . . . . 0.434 ' OE1' ' HB2' ' A' ' 335' ' ' ARG . 1.3 mp0 -57.94 -167.98 0.0 OUTLIER 'General case' 0 N--CA 1.489 1.501 0 O-C-N 121.239 -1.153 . . . . 2.17 109.48 -179.98 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' C' C ' 327' ' ' TYR . . . . . . . . . . . . . 51.6 m-85 -149.66 115.03 5.5 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.33 -0.856 . . . . 1.03 109.394 -179.916 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 328' ' ' PHE . . . . . 0.464 ' O ' HG21 ' C' ' 329' ' ' THR . 84.4 m-85 -113.36 -169.77 1.56 Allowed 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.319 -0.863 . . . . 0.37 109.562 -179.934 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' C' C ' 329' ' ' THR . . . . . 0.464 HG21 ' O ' ' C' ' 328' ' ' PHE . 16.3 p -153.54 162.48 41.22 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.265 -0.897 . . . . 1.04 109.463 -179.873 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' C' C ' 330' ' ' LEU . . . . . 0.451 ' O ' ' HA ' ' A' ' 329' ' ' THR . 14.3 tp -150.26 129.78 13.04 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.206 -0.934 . . . . 1.09 109.782 -179.725 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' C' C ' 331' ' ' GLN . . . . . . . . . . . . . 4.1 tt0 -89.22 119.4 29.68 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.263 -0.898 . . . . 1.48 109.387 179.568 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 332' ' ' ILE . . . . . 0.472 HG23 ' HA ' ' C' ' 338' ' ' PHE . 21.5 mt -103.67 115.58 45.88 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.576 0 O-C-N 121.101 -1.0 . . . . 1.08 109.654 179.811 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' C' C ' 333' ' ' ARG . . . . . 0.552 ' CZ ' ' HB2' ' C' ' 333' ' ' ARG . 5.6 mtm-85 -73.45 151.58 41.05 Favored 'General case' 0 N--CA 1.489 1.493 0 O-C-N 121.348 -0.845 . . . . 3.36 109.375 179.788 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' C' C ' 334' ' ' GLY . . . . . . . . . . . . . . . 71.83 129.99 0.1 OUTLIER Glycine 0 N--CA 1.491 2.305 0 N-CA-C 109.737 -1.345 . . . . 0.35 109.737 179.798 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 335' ' ' ARG . . . . . 0.454 ' NH1' ' CG ' ' C' ' 335' ' ' ARG . 0.2 OUTLIER -73.98 -31.26 62.9 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.273 -1.133 . . . . 3.23 109.358 179.847 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' C' C ' 336' ' ' GLU . . . . . . . . . . . . . 1.7 mp0 -59.22 -57.85 11.21 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.293 -0.88 . . . . 2.62 110.216 -179.768 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 337' ' ' ARG . . . . . 0.537 ' HG2' ' NH1' ' C' ' 337' ' ' ARG . 0.0 OUTLIER -59.03 -32.97 70.21 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.241 -0.912 . . . . 3.61 109.735 -179.471 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' C' C ' 338' ' ' PHE . . . . . 0.472 ' HA ' HG23 ' C' ' 332' ' ' ILE . 80.8 t80 -54.05 -49.53 68.77 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.224 -0.923 . . . . 0.43 109.576 -179.884 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' C' C ' 339' ' ' GLU . . . . . . . . . . . . . 14.5 mt-10 -54.99 -36.67 65.64 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.07 -1.019 . . . . 2.05 110.307 -179.849 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 340' ' ' MET . . . . . . . . . . . . . 19.0 ttp -64.6 -57.7 8.38 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.131 -0.981 . . . . 1.1 110.861 -178.984 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 341' ' ' PHE . . . . . 0.437 ' CZ ' ' HA ' ' A' ' 345' ' ' ASN . 59.1 m-85 -59.74 -51.44 69.75 Favored 'General case' 0 N--CA 1.493 1.713 0 O-C-N 121.091 -1.005 . . . . 0.21 110.246 -178.956 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' C' C ' 342' ' ' ARG . . . . . 0.443 HH11 ' CG ' ' C' ' 342' ' ' ARG . 0.2 OUTLIER -47.21 -45.85 23.58 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.25 -0.906 . . . . 3.42 110.217 -179.374 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' C' C ' 343' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -58.84 -43.19 90.66 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.213 -0.929 . . . . 2.14 109.968 -179.496 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' C' C ' 344' ' ' LEU . . . . . 0.468 ' O ' HD21 ' C' ' 348' ' ' LEU . 25.6 mt -62.28 -40.66 96.97 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.093 -1.004 . . . . 1.09 109.823 -179.583 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' C' C ' 345' ' ' ASN . . . . . . . . . . . . . 51.2 t-20 -55.26 -51.79 65.51 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.238 -0.914 . . . . 1.38 109.98 -179.596 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 346' ' ' GLU . . . . . . . . . . . . . 63.1 tt0 -60.14 -31.68 70.31 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.108 -0.995 . . . . 2.21 109.742 -179.602 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 347' ' ' ALA . . . . . . . . . . . . . . . -62.7 -48.05 80.95 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.112 -0.993 . . . . 1.03 109.879 -179.998 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 348' ' ' LEU . . . . . 0.482 HD23 ' N ' ' C' ' 348' ' ' LEU . 4.3 mm? -62.16 -53.84 49.64 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.209 -0.932 . . . . 1.06 110.108 -179.637 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' C' C ' 349' ' ' GLU . . . . . . . . . . . . . 6.6 mm-40 -57.65 -34.06 68.96 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.256 -0.902 . . . . 2.19 110.231 -179.097 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 350' ' ' LEU . . . . . 0.522 HD21 ' N ' ' C' ' 351' ' ' LYS . 4.2 tt -63.49 -44.04 95.51 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.099 -1.001 . . . . 1.2 109.282 -179.817 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' C' C ' 351' ' ' LYS . . . . . 0.522 ' N ' HD21 ' C' ' 350' ' ' LEU . 41.6 tttp -59.9 -34.43 73.18 Favored 'General case' 0 N--CA 1.488 1.454 0 O-C-N 121.342 -0.849 . . . . 1.92 109.445 -179.923 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' C' C ' 352' ' ' ASP . . . . . . . . . . . . . 3.2 m-20 -56.52 -45.49 81.09 Favored 'General case' 0 N--CA 1.489 1.499 0 O-C-N 121.241 -0.912 . . . . 1.19 109.663 179.978 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 353' ' ' ALA . . . . . . . . . . . . . . . -67.46 -21.01 65.56 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.184 -0.947 . . . . 1.15 109.333 -179.971 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 354' ' ' GLN . . . . . 0.523 ' NE2' HD13 ' D' ' 350' ' ' LEU . 0.2 OUTLIER -83.05 -10.85 58.51 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.331 -0.856 . . . . 1.7 109.488 179.921 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' C' C ' 355' ' ' ALA . . . . . . . . . . . . . . . -71.03 -82.09 0.04 OUTLIER 'General case' 0 N--CA 1.488 1.449 0 O-C-N 121.33 -0.856 . . . . 1.3 109.468 179.891 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 356' ' ' GLY . . . . . . . . . . . . . . . -69.92 94.21 0.43 Allowed Glycine 0 N--CA 1.489 2.211 0 N-CA-C 109.625 -1.39 . . . . 1.33 109.625 -179.955 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 357' ' ' LYS . . . . . . . . . . . . . 16.3 mtmm -86.56 136.64 32.99 Favored 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.104 -1.233 . . . . 4.39 109.293 179.844 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 358' ' ' GLU . . . . . . . . . . . . . 7.2 tt0 -47.36 108.71 0.93 Allowed Pre-proline 0 N--CA 1.489 1.516 0 O-C-N 121.253 -0.904 . . . . 5.75 109.434 -179.962 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 359' ' ' PRO . . . . . . . . . . . . . 5.2 Cg_exo -59.2 170.26 3.13 Favored 'Trans proline' 0 C--N 1.313 -1.315 0 C-N-CA 121.958 1.772 . . . . 5.54 110.242 -179.934 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 360' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 2.385 0 N-CA-C 109.429 -1.469 . . . . 6.5 109.429 -179.937 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' D' D ' 319' ' ' LYS . . . . . 0.421 ' O ' ' O ' ' D' ' 320' ' ' LYS . 13.5 mtmt . . . . . 0 N--CA 1.49 1.56 0 N-CA-C 109.449 -0.575 . . . . 7.93 109.449 . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' D' D ' 320' ' ' LYS . . . . . 0.421 ' O ' ' O ' ' D' ' 319' ' ' LYS . 5.8 tttp 60.01 114.45 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.24 -0.912 . . . . 6.7 109.526 -179.942 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' D' D ' 321' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -158.88 91.99 1.97 Allowed Pre-proline 0 N--CA 1.49 1.528 0 O-C-N 121.208 -0.933 . . . . 6.49 109.508 179.869 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' D' D ' 322' ' ' PRO . . . . . . . . . . . . . 2.1 Cg_endo -61.95 -47.29 10.97 Favored 'Trans proline' 0 C--N 1.309 -1.546 0 C-N-CA 122.108 1.872 . . . . 3.29 110.016 179.936 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' D' D ' 323' ' ' LEU . . . . . . . . . . . . . 19.5 mt -81.3 96.53 7.32 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.339 -0.851 . . . . 3.16 109.497 179.791 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' D' D ' 324' ' ' ASP . . . . . . . . . . . . . 7.1 m-20 -80.16 148.36 30.95 Favored 'General case' 0 N--CA 1.488 1.467 0 O-C-N 121.244 -0.91 . . . . 1.54 109.194 179.751 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' D' D ' 325' ' ' GLY . . . . . 0.46 ' O ' ' CE2' ' D' ' 327' ' ' TYR . . . -66.85 171.87 30.12 Favored Glycine 0 N--CA 1.49 2.264 0 N-CA-C 109.104 -1.598 . . . . 0.65 109.104 179.927 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' D' D ' 326' ' ' GLU . . . . . . . . . . . . . 3.0 mt-10 -56.84 174.43 0.16 Allowed 'General case' 0 N--CA 1.488 1.441 0 O-C-N 121.121 -1.223 . . . . 2.13 109.07 -179.966 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' D' D ' 327' ' ' TYR . . . . . 0.46 ' CE2' ' O ' ' D' ' 325' ' ' GLY . 47.1 m-85 -148.79 111.53 4.8 Favored 'General case' 0 C--N 1.303 -1.427 0 O-C-N 121.173 -0.954 . . . . 1.0 109.469 -179.818 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' D' D ' 328' ' ' PHE . . . . . 0.411 ' CE2' ' HA ' ' B' ' 335' ' ' ARG . 86.2 m-85 -114.08 -168.64 1.38 Allowed 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.292 -0.88 . . . . 0.34 109.561 -179.842 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' D' D ' 329' ' ' THR . . . . . 0.419 ' HA ' ' O ' ' B' ' 330' ' ' LEU . 23.8 p -153.46 165.07 36.98 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.294 -0.879 . . . . 1.05 109.174 179.931 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' D' D ' 330' ' ' LEU . . . . . 0.407 ' O ' ' HA ' ' B' ' 329' ' ' THR . 14.9 tp -151.43 131.23 13.23 Favored 'General case' 0 N--CA 1.489 1.476 0 O-C-N 121.134 -0.978 . . . . 1.07 109.869 -179.768 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' D' D ' 331' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -87.39 120.75 29.0 Favored 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.341 -0.849 . . . . 0.93 109.234 179.54 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' D' D ' 332' ' ' ILE . . . . . . . . . . . . . 59.5 mt -103.46 111.26 32.51 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.574 0 O-C-N 121.149 -0.97 . . . . 1.07 109.656 -179.778 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' D' D ' 333' ' ' ARG . . . . . 0.433 ' NH1' ' CG ' ' D' ' 333' ' ' ARG . 0.0 OUTLIER -72.77 139.67 47.24 Favored 'General case' 0 N--CA 1.489 1.49 0 O-C-N 121.334 -0.854 . . . . 3.42 109.454 179.778 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' D' D ' 334' ' ' GLY . . . . . . . . . . . . . . . 85.76 136.62 4.1 Favored Glycine 0 N--CA 1.49 2.283 0 N-CA-C 109.658 -1.377 . . . . 0.41 109.658 179.925 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' D' D ' 335' ' ' ARG . . . . . 0.494 ' NH1' ' HG3' ' D' ' 335' ' ' ARG . 0.3 OUTLIER -80.13 -36.08 35.8 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.31 -1.112 . . . . 3.58 109.623 -179.951 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' D' D ' 336' ' ' GLU . . . . . . . . . . . . . 53.1 tt0 -58.72 -57.14 14.32 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.223 -0.923 . . . . 2.26 110.057 -179.666 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' D' D ' 337' ' ' ARG . . . . . 0.539 ' NH1' ' HG3' ' D' ' 337' ' ' ARG . 0.6 OUTLIER -60.07 -30.27 69.11 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.188 -0.945 . . . . 3.64 109.862 -179.608 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' D' D ' 338' ' ' PHE . . . . . . . . . . . . . 88.7 t80 -54.43 -62.89 1.36 Allowed 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.209 -0.932 . . . . 0.4 109.769 -179.756 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' D' D ' 339' ' ' GLU . . . . . . . . . . . . . 81.7 mt-10 -51.99 -31.32 28.93 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.279 -0.888 . . . . 1.99 110.155 -179.632 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' D' D ' 340' ' ' MET . . . . . . . . . . . . . 28.2 ttp -63.9 -53.6 47.95 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.101 -0.999 . . . . 1.13 110.098 -179.426 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' D' D ' 341' ' ' PHE . . . . . 0.414 ' CZ ' ' HA ' ' B' ' 345' ' ' ASN . 39.8 m-85 -62.17 -48.83 78.3 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.183 -0.948 . . . . 0.21 109.977 -179.532 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' D' D ' 342' ' ' ARG . . . . . . . . . . . . . 70.6 ttt180 -48.6 -38.47 20.87 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.185 -0.947 . . . . 3.15 109.827 -179.73 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' D' D ' 343' ' ' GLU . . . . . . . . . . . . . 43.7 tt0 -59.51 -49.29 78.37 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.218 -0.926 . . . . 2.35 109.927 -179.609 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' D' D ' 344' ' ' LEU . . . . . 0.447 ' O ' HD21 ' D' ' 348' ' ' LEU . 43.1 mt -61.26 -38.08 85.46 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.256 -0.902 . . . . 1.06 109.738 -179.659 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' D' D ' 345' ' ' ASN . . . . . . . . . . . . . 60.6 t-20 -57.09 -50.35 73.06 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.178 -0.951 . . . . 1.35 109.61 -179.787 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' D' D ' 346' ' ' GLU . . . . . . . . . . . . . 2.6 tt0 -60.56 -34.52 74.28 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.295 -0.878 . . . . 1.69 109.892 -179.774 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' D' D ' 347' ' ' ALA . . . . . . . . . . . . . . . -60.85 -51.48 69.12 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.243 -0.911 . . . . 1.03 110.07 -179.645 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' D' D ' 348' ' ' LEU . . . . . 0.487 ' N ' HD23 ' D' ' 348' ' ' LEU . 3.9 mm? -61.48 -45.05 95.88 Favored 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.158 -0.964 . . . . 1.04 109.948 -179.446 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' D' D ' 349' ' ' GLU . . . . . . . . . . . . . 39.2 mt-10 -57.91 -40.34 80.12 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.275 -0.891 . . . . 1.95 110.351 -179.327 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' D' D ' 350' ' ' LEU . . . . . 0.523 HD13 ' NE2' ' C' ' 354' ' ' GLN . 8.6 tt -63.73 -48.11 78.35 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.087 -1.008 . . . . 1.16 110.144 -179.369 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' D' D ' 351' ' ' LYS . . . . . . . . . . . . . 25.8 tttt -55.73 -41.8 74.41 Favored 'General case' 0 N--CA 1.488 1.451 0 O-C-N 121.244 -0.91 . . . . 1.97 109.291 -179.665 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' D' D ' 352' ' ' ASP . . . . . 0.433 ' OD2' ' NH2' ' B' ' 337' ' ' ARG . 23.5 m-20 -59.36 -48.35 81.96 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.294 -0.879 . . . . 1.17 109.806 179.802 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' D' D ' 353' ' ' ALA . . . . . . . . . . . . . . . -67.57 -9.56 43.85 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.22 -0.925 . . . . 1.21 110.101 -179.43 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' D' D ' 354' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -83.95 -28.26 27.94 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.063 -1.023 . . . . 1.68 109.532 -179.807 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' D' D ' 355' ' ' ALA . . . . . . . . . . . . . . . -73.79 -21.35 60.19 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.168 -0.957 . . . . 1.29 109.485 179.912 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' D' D ' 356' ' ' GLY . . . . . . . . . . . . . . . -81.97 30.97 2.86 Favored Glycine 0 N--CA 1.494 2.53 0 N-CA-C 110.505 -1.038 . . . . 1.28 110.505 -179.92 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' D' D ' 357' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -87.21 124.9 33.8 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 120.86 -1.377 . . . . 4.45 109.464 -179.964 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' D' D ' 358' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -49.96 155.49 1.55 Allowed Pre-proline 0 N--CA 1.49 1.543 0 O-C-N 121.228 -0.92 . . . . 5.71 109.41 179.911 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' D' D ' 359' ' ' PRO . . . . . . . . . . . . . 3.1 Cg_exo -61.65 138.79 77.34 Favored 'Trans proline' 0 C--N 1.309 -1.534 0 C-N-CA 122.242 1.961 . . . . 5.6 110.31 -179.918 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' D' D ' 360' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.251 0 CA-C-O 117.973 -1.459 . . . . 6.97 109.462 179.885 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 319' ' ' LYS . . . . . . . . . . . . . 17.6 mttm . . . . . 0 N--CA 1.49 1.528 0 CA-C-O 121.297 0.57 . . . . 7.95 109.581 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 320' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 63.21 78.11 0.3 Allowed 'General case' 0 N--CA 1.488 1.453 0 O-C-N 121.167 -0.958 . . . . 6.71 109.833 179.52 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 321' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -158.38 77.6 3.37 Favored Pre-proline 0 C--N 1.302 -1.477 0 O-C-N 121.258 -0.901 . . . . 6.5 109.027 179.482 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 322' ' ' PRO . . . . . . . . . . . . . 4.5 Cg_endo -71.95 19.44 0.29 Allowed 'Trans proline' 0 C--N 1.31 -1.466 0 C-N-CA 122.597 2.198 . . . . 3.3 111.945 -179.634 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 323' ' ' LEU . . . . . . . . . . . . . 24.3 mt -78.45 91.49 4.52 Favored 'General case' 0 N--CA 1.489 1.491 0 O-C-N 120.582 -1.324 . . . . 3.16 109.589 -179.839 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 324' ' ' ASP . . . . . 0.509 ' N ' ' OD1' ' A' ' 324' ' ' ASP . 0.6 OUTLIER -82.58 -150.44 0.09 Allowed 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.355 -0.841 . . . . 1.53 109.814 -179.887 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 325' ' ' GLY . . . . . . . . . . . . . . . -70.11 -159.36 2.55 Favored Glycine 0 N--CA 1.49 2.257 0 N-CA-C 109.732 -1.347 . . . . 0.67 109.732 -179.867 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 326' ' ' GLU . . . . . . . . . . . . . 4.0 mm-40 -58.66 -169.14 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.257 -1.143 . . . . 2.13 109.378 179.768 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 327' ' ' TYR . . . . . 0.521 ' CE2' ' HG2' ' C' ' 333' ' ' ARG . 40.9 m-85 -148.35 111.05 4.76 Favored 'General case' 0 C--N 1.302 -1.464 0 O-C-N 121.412 -0.805 . . . . 1.0 109.553 179.725 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 328' ' ' PHE . . . . . 0.442 ' CZ ' ' HD3' ' C' ' 335' ' ' ARG . 59.5 m-85 -113.08 -172.75 2.12 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.431 -0.793 . . . . 0.34 109.291 -179.936 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 329' ' ' THR . . . . . . . . . . . . . 60.0 p -152.92 171.74 17.85 Favored 'General case' 0 C--N 1.302 -1.461 0 O-C-N 121.196 -0.94 . . . . 1.05 108.895 179.847 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 330' ' ' LEU . . . . . . . . . . . . . 24.1 tp -151.86 130.17 12.05 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.378 -0.826 . . . . 1.07 109.71 -179.721 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 331' ' ' GLN . . . . . . . . . . . . . 1.5 tp60 -87.18 111.96 21.5 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.25 -0.906 . . . . 0.91 109.679 179.932 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 332' ' ' ILE . . . . . . . . . . . . . 63.6 mt -103.2 103.1 14.59 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.587 0 O-C-N 121.107 -0.996 . . . . 1.09 109.291 179.891 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 333' ' ' ARG . . . . . 0.581 ' HG2' ' CE2' ' C' ' 327' ' ' TYR . 0.0 OUTLIER -72.45 147.58 45.98 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.253 -0.904 . . . . 3.41 109.41 -179.879 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 334' ' ' GLY . . . . . . . . . . . . . . . 82.0 130.59 1.3 Allowed Glycine 0 N--CA 1.493 2.436 0 N-CA-C 109.452 -1.459 . . . . 0.4 109.452 -179.961 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 335' ' ' ARG . . . . . 0.428 ' HA ' ' CE2' ' C' ' 328' ' ' PHE . 0.2 OUTLIER -76.44 -31.42 57.85 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.133 -1.216 . . . . 3.55 110.022 -179.938 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 336' ' ' GLU . . . . . . . . . . . . . 4.8 tp10 -57.45 -62.88 1.47 Allowed 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.048 -1.033 . . . . 2.29 109.667 -179.627 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 337' ' ' ARG . . . . . 0.417 ' HG3' ' NH1' ' A' ' 337' ' ' ARG . 8.3 mtm-85 -59.99 -31.43 69.91 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.249 -0.907 . . . . 3.64 109.508 -179.765 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 338' ' ' PHE . . . . . . . . . . . . . 73.1 t80 -56.35 -56.02 26.23 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.304 -0.872 . . . . 0.41 109.851 -179.97 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 339' ' ' GLU . . . . . . . . . . . . . 93.6 mt-10 -52.74 -37.17 58.87 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.151 -0.968 . . . . 1.97 110.446 -179.568 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 340' ' ' MET . . . . . 0.443 ' SD ' ' OE1' ' D' ' 343' ' ' GLU . 28.2 ttp -63.76 -47.99 78.74 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.024 -1.047 . . . . 1.14 110.162 -179.238 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 341' ' ' PHE . . . . . . . . . . . . . 52.4 m-85 -62.43 -40.41 96.48 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.148 -0.97 . . . . 0.21 109.684 -179.515 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 342' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -51.12 -43.68 61.19 Favored 'General case' 0 N--CA 1.488 1.47 0 O-C-N 121.399 -0.813 . . . . 3.15 109.823 -179.939 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 343' ' ' GLU . . . . . 0.457 ' OE1' ' SD ' ' D' ' 340' ' ' MET . 1.8 tt0 -57.94 -46.84 84.43 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.374 -0.829 . . . . 2.35 109.706 -179.646 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 344' ' ' LEU . . . . . . . . . . . . . 41.4 mt -61.59 -33.71 74.36 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.176 -0.953 . . . . 1.06 109.247 179.906 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 345' ' ' ASN . . . . . 0.433 ' O ' ' HG3' ' A' ' 349' ' ' GLU . 13.3 t-20 -57.96 -55.68 31.77 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.558 -0.714 . . . . 1.36 109.517 179.979 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 346' ' ' GLU . . . . . . . . . . . . . 65.2 tt0 -63.63 -29.28 70.54 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.224 -0.922 . . . . 1.65 110.205 -179.756 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 347' ' ' ALA . . . . . . . . . . . . . . . -60.85 -61.44 2.58 Favored 'General case' 0 N--CA 1.494 1.759 0 O-C-N 120.983 -1.073 . . . . 1.03 109.983 -179.613 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 348' ' ' LEU . . . . . 0.419 ' N ' ' CD2' ' A' ' 348' ' ' LEU . 3.9 mm? -61.74 -40.47 95.2 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.256 -0.903 . . . . 1.04 109.546 -179.789 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 349' ' ' GLU . . . . . 0.433 ' HG3' ' O ' ' A' ' 345' ' ' ASN . 93.4 mt-10 -58.56 -34.13 70.69 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.244 -0.91 . . . . 1.94 110.15 -179.446 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 350' ' ' LEU . . . . . 0.471 ' O ' HD22 ' A' ' 350' ' ' LEU . 4.1 tt -65.35 -47.08 77.71 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.179 -0.951 . . . . 1.17 109.661 -179.833 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 351' ' ' LYS . . . . . . . . . . . . . 14.4 tttm -58.96 -41.77 88.27 Favored 'General case' 0 N--CA 1.489 1.497 0 O-C-N 121.166 -0.959 . . . . 1.97 109.845 -179.453 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 352' ' ' ASP . . . . . 0.452 ' O ' ' HB1' ' A' ' 355' ' ' ALA . 48.2 m-20 -53.45 -40.29 65.12 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.035 -1.041 . . . . 1.16 109.505 -179.837 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 353' ' ' ALA . . . . . . . . . . . . . . . -67.5 -31.45 71.59 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.161 -0.962 . . . . 1.22 109.727 -179.888 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 354' ' ' GLN . . . . . . . . . . . . . 3.7 tt0 -81.72 2.71 28.54 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.255 -0.903 . . . . 1.71 109.818 -179.767 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 355' ' ' ALA . . . . . 0.488 ' O ' ' N ' ' A' ' 357' ' ' LYS . . . -69.62 -87.27 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.06 -1.025 . . . . 1.3 109.501 179.965 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 356' ' ' GLY . . . . . . . . . . . . . . . -53.98 88.53 0.01 OUTLIER Glycine 0 N--CA 1.491 2.358 0 N-CA-C 109.593 -1.403 . . . . 1.3 109.593 179.923 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 357' ' ' LYS . . . . . 0.488 ' N ' ' O ' ' A' ' 355' ' ' ALA . 0.9 OUTLIER -88.81 18.36 4.83 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.11 -1.229 . . . . 4.46 109.552 179.997 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 358' ' ' GLU . . . . . . . . . . . . . 2.4 tt0 -49.27 135.49 16.35 Favored Pre-proline 0 N--CA 1.493 1.709 0 O-C-N 121.189 -0.945 . . . . 5.75 109.432 -179.822 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 359' ' ' PRO . . . . . . . . . . . . . 2.4 Cg_endo -61.94 -154.23 0.02 OUTLIER 'Trans proline' 0 C--N 1.313 -1.314 0 C-N-CA 121.933 1.755 . . . . 5.63 110.184 -179.987 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 360' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.296 0 CA-C-O 117.998 -1.446 . . . . 6.97 109.524 179.897 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' B' B ' 319' ' ' LYS . . . . . . . . . . . . . 16.5 mttm . . . . . 0 N--CA 1.49 1.527 0 N-CA-C 109.485 -0.561 . . . . 7.95 109.485 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' B' B ' 320' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 62.72 77.58 0.32 Allowed 'General case' 0 C--N 1.304 -1.412 0 O-C-N 121.251 -0.906 . . . . 6.73 109.811 179.373 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 321' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -158.11 78.01 3.43 Favored Pre-proline 0 N--CA 1.49 1.54 0 O-C-N 121.394 -0.816 . . . . 6.5 109.069 179.607 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 322' ' ' PRO . . . . . . . . . . . . . 5.7 Cg_endo -72.03 19.87 0.29 Allowed 'Trans proline' 0 C--N 1.314 -1.262 0 C-N-CA 122.899 2.399 . . . . 3.29 111.957 -179.562 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 323' ' ' LEU . . . . . . . . . . . . . 27.1 mt -78.7 92.18 4.75 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 120.499 -1.375 . . . . 3.18 109.43 -179.96 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 324' ' ' ASP . . . . . 0.477 ' N ' ' OD1' ' B' ' 324' ' ' ASP . 0.5 OUTLIER -83.08 -149.19 0.09 Allowed 'General case' 0 N--CA 1.488 1.436 0 O-C-N 121.171 -0.956 . . . . 1.53 109.837 -179.874 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' B' B ' 325' ' ' GLY . . . . . . . . . . . . . . . -71.74 -158.99 3.69 Favored Glycine 0 N--CA 1.49 2.272 0 N-CA-C 109.539 -1.424 . . . . 0.65 109.539 -179.829 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 326' ' ' GLU . . . . . . . . . . . . . 3.4 mm-40 -58.52 -169.36 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.173 -1.192 . . . . 2.13 109.354 179.911 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 327' ' ' TYR . . . . . 0.526 ' CE2' ' HG2' ' D' ' 333' ' ' ARG . 42.0 m-85 -148.13 111.51 4.96 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.373 -0.829 . . . . 0.99 109.446 179.637 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 328' ' ' PHE . . . . . . . . . . . . . 62.8 m-85 -113.08 -173.37 2.24 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.362 -0.836 . . . . 0.36 109.243 -179.904 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 329' ' ' THR . . . . . 0.485 ' HA ' ' O ' ' D' ' 330' ' ' LEU . 77.2 p -152.12 170.77 19.14 Favored 'General case' 0 C--N 1.302 -1.479 0 O-C-N 121.348 -0.845 . . . . 1.05 109.099 179.824 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 330' ' ' LEU . . . . . 0.449 ' O ' ' HA ' ' D' ' 329' ' ' THR . 28.3 tp -151.13 130.31 12.71 Favored 'General case' 0 C--N 1.303 -1.449 0 O-C-N 121.025 -1.047 . . . . 1.07 109.71 -179.661 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 331' ' ' GLN . . . . . . . . . . . . . 1.5 tp60 -87.48 112.28 22.04 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.384 -0.823 . . . . 0.91 109.641 -179.891 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 332' ' ' ILE . . . . . . . . . . . . . 63.6 mt -103.49 103.23 14.83 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.478 0 O-C-N 121.118 -0.989 . . . . 1.08 109.195 179.834 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 333' ' ' ARG . . . . . 0.539 ' HG2' ' NH1' ' B' ' 333' ' ' ARG . 0.0 OUTLIER -72.69 146.56 46.43 Favored 'General case' 0 N--CA 1.488 1.475 0 O-C-N 121.178 -0.951 . . . . 3.42 109.472 -179.924 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' B' B ' 334' ' ' GLY . . . . . . . . . . . . . . . 82.88 130.81 1.57 Allowed Glycine 0 N--CA 1.492 2.428 0 N-CA-C 109.583 -1.407 . . . . 0.4 109.583 179.995 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 335' ' ' ARG . . . . . 0.409 ' HG3' HH11 ' B' ' 335' ' ' ARG . 0.2 OUTLIER -76.37 -31.54 58.09 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.35 -1.088 . . . . 3.55 109.773 -179.657 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' B' B ' 336' ' ' GLU . . . . . . . . . . . . . 4.8 tp10 -57.01 -63.37 1.23 Allowed 'General case' 0 N--CA 1.488 1.454 0 O-C-N 121.092 -1.005 . . . . 2.28 109.881 -179.743 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 337' ' ' ARG . . . . . 0.401 HH11 ' HG3' ' B' ' 337' ' ' ARG . 9.1 mtm-85 -60.1 -31.42 70.02 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.233 -0.917 . . . . 3.64 109.686 -179.712 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 338' ' ' PHE . . . . . . . . . . . . . 72.4 t80 -56.37 -55.72 30.06 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.218 -0.926 . . . . 0.39 109.826 -179.903 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 339' ' ' GLU . . . . . . . . . . . . . 94.1 mt-10 -52.96 -37.33 61.05 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.256 -0.903 . . . . 1.98 110.426 -179.265 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 340' ' ' MET . . . . . . . . . . . . . 29.3 ttp -63.57 -47.88 79.7 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.133 -0.98 . . . . 1.14 110.041 -179.404 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 341' ' ' PHE . . . . . . . . . . . . . 50.9 m-85 -62.03 -40.95 97.47 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 120.963 -1.086 . . . . 0.22 109.818 -179.762 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 342' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -50.7 -43.29 57.66 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.287 -0.883 . . . . 3.15 109.904 -179.859 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 343' ' ' GLU . . . . . . . . . . . . . 1.7 tt0 -58.42 -46.5 86.36 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.303 -0.873 . . . . 2.35 109.665 -179.518 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 344' ' ' LEU . . . . . . . . . . . . . 39.5 mt -61.57 -33.55 74.07 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.324 -0.86 . . . . 1.05 109.07 179.966 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 345' ' ' ASN . . . . . . . . . . . . . 13.0 t-20 -57.88 -56.62 19.61 Favored 'General case' 0 N--CA 1.49 1.525 0 O-C-N 121.413 -0.805 . . . . 1.35 109.686 179.999 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 346' ' ' GLU . . . . . . . . . . . . . 61.9 tt0 -63.31 -29.06 70.45 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.239 -0.913 . . . . 1.66 110.199 -179.783 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 347' ' ' ALA . . . . . . . . . . . . . . . -60.76 -62.07 2.13 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 120.86 -1.15 . . . . 1.02 109.922 -179.622 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 348' ' ' LEU . . . . . 0.425 ' CD2' ' N ' ' B' ' 348' ' ' LEU . 3.9 mm? -61.2 -40.25 93.24 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.076 -1.015 . . . . 1.05 109.764 -179.651 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 349' ' ' GLU . . . . . . . . . . . . . 96.9 mt-10 -59.01 -33.97 71.33 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.295 -0.878 . . . . 1.95 110.077 -179.453 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 350' ' ' LEU . . . . . 0.476 ' C ' ' CD2' ' B' ' 350' ' ' LEU . 4.0 tt -65.2 -47.09 78.11 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.278 -0.889 . . . . 1.18 109.641 -179.78 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 351' ' ' LYS . . . . . . . . . . . . . 16.2 tttm -58.77 -41.75 87.34 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.303 -0.873 . . . . 1.96 109.788 -179.666 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 352' ' ' ASP . . . . . 0.475 ' O ' ' HB1' ' B' ' 355' ' ' ALA . 45.5 m-20 -54.22 -40.1 67.35 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.163 -0.961 . . . . 1.16 109.513 -179.667 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 353' ' ' ALA . . . . . . . . . . . . . . . -67.02 -31.66 72.35 Favored 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.266 -0.897 . . . . 1.21 109.501 179.928 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 354' ' ' GLN . . . . . . . . . . . . . 3.6 tt0 -82.01 3.45 26.59 Favored 'General case' 0 N--CA 1.488 1.455 0 O-C-N 121.159 -0.963 . . . . 1.69 109.891 -179.906 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 355' ' ' ALA . . . . . 0.476 ' O ' ' N ' ' B' ' 357' ' ' LYS . . . -69.8 -85.95 0.02 OUTLIER 'General case' 0 N--CA 1.489 1.486 0 O-C-N 121.09 -1.006 . . . . 1.3 109.552 -179.948 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 356' ' ' GLY . . . . . . . . . . . . . . . -55.25 89.02 0.01 OUTLIER Glycine 0 N--CA 1.491 2.329 0 N-CA-C 109.602 -1.399 . . . . 1.29 109.602 -179.887 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 357' ' ' LYS . . . . . 0.476 ' N ' ' O ' ' B' ' 355' ' ' ALA . 0.5 OUTLIER -89.34 18.36 5.27 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.225 -1.162 . . . . 4.45 109.694 179.992 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' B' B ' 358' ' ' GLU . . . . . . . . . . . . . 2.5 tt0 -49.46 137.16 16.82 Favored Pre-proline 0 N--CA 1.489 1.49 0 O-C-N 121.162 -0.961 . . . . 5.72 109.444 -179.782 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 359' ' ' PRO . . . . . . . . . . . . . 2.0 Cg_endo -62.64 -153.67 0.02 OUTLIER 'Trans proline' 0 C--N 1.311 -1.399 0 C-N-CA 122.014 1.81 . . . . 5.6 110.122 -179.792 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 360' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.334 0 N-CA-C 109.411 -1.476 . . . . 6.98 109.411 179.944 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' C' C ' 319' ' ' LYS . . . . . . . . . . . . . 3.2 mttm . . . . . 0 N--CA 1.49 1.553 0 CA-C-O 121.368 0.604 . . . . 7.03 109.657 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' C' C ' 320' ' ' LYS . . . . . 0.561 ' CB ' ' HD2' ' C' ' 322' ' ' PRO . 2.9 mtpt 55.37 -179.18 0.04 OUTLIER 'General case' 0 N--CA 1.488 1.472 0 O-C-N 121.316 -0.865 . . . . 6.84 110.048 179.406 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' C' C ' 321' ' ' LYS . . . . . 0.711 ' N ' ' CD ' ' C' ' 322' ' ' PRO . 1.9 ptmt -89.18 -23.7 0.28 Allowed Pre-proline 0 N--CA 1.5 2.064 0 N-CA-C 113.844 1.053 . . . . 6.78 113.844 -178.781 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' C' C ' 322' ' ' PRO . . . . . 0.711 ' CD ' ' N ' ' C' ' 321' ' ' LYS . 5.6 Cg_exo -60.11 -80.95 0.01 OUTLIER 'Trans proline' 0 C--N 1.323 -0.813 0 C-N-CA 121.009 1.14 . . . . 3.98 110.96 -178.766 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' C' C ' 323' ' ' LEU . . . . . . . . . . . . . 20.1 mt -80.35 83.52 6.17 Favored 'General case' 0 N--CA 1.488 1.441 0 O-C-N 120.779 -1.2 . . . . 4.31 109.287 -179.692 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 324' ' ' ASP . . . . . 0.425 ' OD1' ' O ' ' C' ' 321' ' ' LYS . 15.3 m-20 -82.76 -170.65 3.1 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.241 -0.912 . . . . 1.63 109.943 179.944 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' C' C ' 325' ' ' GLY . . . . . . . . . . . . . . . -73.41 -157.27 4.3 Favored Glycine 0 N--CA 1.491 2.361 0 N-CA-C 110.175 -1.17 . . . . 0.82 110.175 -179.971 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 326' ' ' GLU . . . . . 0.481 ' O ' ' CD1' ' C' ' 327' ' ' TYR . 1.7 mm-40 -59.91 -165.41 0.01 OUTLIER 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.503 -0.998 . . . . 2.17 109.645 179.999 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' C' C ' 327' ' ' TYR . . . . . 0.581 ' CE2' ' HG2' ' A' ' 333' ' ' ARG . 37.4 m-85 -150.41 113.61 4.87 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.341 -0.849 . . . . 1.03 109.678 179.745 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' C' C ' 328' ' ' PHE . . . . . 0.453 ' O ' HG21 ' C' ' 329' ' ' THR . 96.3 m-85 -113.62 -170.39 1.69 Allowed 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.317 -0.864 . . . . 0.37 109.356 179.695 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' C' C ' 329' ' ' THR . . . . . 0.453 HG21 ' O ' ' C' ' 328' ' ' PHE . 12.8 p -153.31 167.17 30.28 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.168 -0.957 . . . . 1.04 109.71 -179.748 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' C' C ' 330' ' ' LEU . . . . . . . . . . . . . 56.9 tp -148.57 130.35 15.11 Favored 'General case' 0 N--CA 1.488 1.452 0 O-C-N 121.148 -0.97 . . . . 1.09 109.518 -179.97 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 331' ' ' GLN . . . . . 0.437 ' OE1' ' O ' ' A' ' 328' ' ' PHE . 7.4 tp-100 -87.32 111.24 20.87 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.383 -0.823 . . . . 1.48 109.538 -179.922 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' C' C ' 332' ' ' ILE . . . . . . . . . . . . . 31.1 mt -103.7 101.43 12.23 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.624 0 O-C-N 121.009 -1.057 . . . . 1.08 109.615 179.858 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 333' ' ' ARG . . . . . 0.528 ' NH1' ' HG2' ' C' ' 333' ' ' ARG . 0.0 OUTLIER -73.67 137.23 43.98 Favored 'General case' 0 N--CA 1.489 1.476 0 O-C-N 121.151 -0.968 . . . . 3.36 109.113 179.539 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' C' C ' 334' ' ' GLY . . . . . . . . . . . . . . . 96.33 128.62 5.79 Favored Glycine 0 N--CA 1.488 2.131 0 N-CA-C 109.571 -1.412 . . . . 0.35 109.571 -179.985 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 335' ' ' ARG . . . . . 0.442 ' HD3' ' CZ ' ' A' ' 328' ' ' PHE . 3.6 ttp180 -75.87 -36.59 59.49 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.363 -1.081 . . . . 3.23 109.309 -179.983 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' C' C ' 336' ' ' GLU . . . . . . . . . . . . . 1.3 mt-10 -58.95 -60.28 4.11 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.218 -0.926 . . . . 2.62 109.875 -179.748 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 337' ' ' ARG . . . . . 0.471 ' NE ' ' HA ' ' C' ' 337' ' ' ARG . 10.5 mmm180 -60.04 -35.23 74.66 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.187 -0.946 . . . . 3.61 109.678 -179.731 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' C' C ' 338' ' ' PHE . . . . . 0.402 ' CD1' ' C ' ' C' ' 338' ' ' PHE . 16.8 t80 -56.44 -48.66 76.56 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.242 -0.911 . . . . 0.43 109.803 -179.816 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' C' C ' 339' ' ' GLU . . . . . . . . . . . . . 2.2 mt-10 -53.57 -37.52 63.01 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.056 -1.027 . . . . 2.05 110.44 -179.237 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 340' ' ' MET . . . . . . . . . . . . . 32.5 ttp -63.75 -47.32 81.49 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.062 -1.024 . . . . 1.1 109.84 -179.485 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 341' ' ' PHE . . . . . . . . . . . . . 56.8 m-85 -61.75 -45.05 95.59 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.1 -1.0 . . . . 0.21 109.982 -179.523 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 342' ' ' ARG . . . . . 0.423 ' CG ' ' NH1' ' C' ' 342' ' ' ARG . 0.0 OUTLIER -50.09 -42.34 50.03 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.255 -0.903 . . . . 3.42 109.962 -179.842 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' C' C ' 343' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -59.98 -51.71 68.5 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.262 -0.899 . . . . 2.14 110.173 -179.522 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' C' C ' 344' ' ' LEU . . . . . . . . . . . . . 42.1 mt -60.18 -30.99 69.71 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.128 -0.983 . . . . 1.09 109.68 -179.559 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 345' ' ' ASN . . . . . . . . . . . . . 14.3 t-20 -57.84 -56.61 19.69 Favored 'General case' 0 N--CA 1.488 1.428 0 O-C-N 121.242 -0.911 . . . . 1.38 109.442 179.93 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 346' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -62.05 -29.27 70.18 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.399 -0.813 . . . . 2.21 109.92 -179.898 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' C' C ' 347' ' ' ALA . . . . . . . . . . . . . . . -61.1 -60.33 3.94 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.206 -0.934 . . . . 1.03 110.104 -179.695 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 348' ' ' LEU . . . . . 0.528 HD23 ' N ' ' C' ' 348' ' ' LEU . 4.1 mm? -59.4 -48.54 81.26 Favored 'General case' 0 N--CA 1.495 1.795 0 O-C-N 121.017 -1.052 . . . . 1.06 109.872 -179.561 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' C' C ' 349' ' ' GLU . . . . . . . . . . . . . 5.3 mm-40 -57.85 -28.66 64.32 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.196 -0.94 . . . . 2.19 109.354 -179.845 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 350' ' ' LEU . . . . . 0.515 HD21 ' CD1' ' D' ' 350' ' ' LEU . 5.2 tt -64.1 -46.53 83.82 Favored 'General case' 0 N--CA 1.489 1.501 0 O-C-N 121.207 -0.933 . . . . 1.2 108.928 179.689 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' C' C ' 351' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -59.56 -45.55 91.5 Favored 'General case' 0 N--CA 1.487 1.379 0 O-C-N 121.576 -0.703 . . . . 1.92 109.132 179.83 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' C' C ' 352' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -56.86 -32.5 65.89 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.477 -0.764 . . . . 1.19 109.417 179.729 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 353' ' ' ALA . . . . . . . . . . . . . . . -66.2 -32.36 73.75 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.27 -0.893 . . . . 1.15 109.328 -179.992 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 354' ' ' GLN . . . . . . . . . . . . . 26.4 mt-30 -82.21 -11.92 58.41 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.181 -0.95 . . . . 1.7 108.923 179.324 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 355' ' ' ALA . . . . . . . . . . . . . . . -72.65 -8.18 54.04 Favored 'General case' 0 N--CA 1.489 1.479 0 O-C-N 121.319 -0.863 . . . . 1.3 109.538 -179.874 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 356' ' ' GLY . . . . . . . . . . . . . . . -70.46 -55.17 9.03 Favored Glycine 0 N--CA 1.49 2.282 0 N-CA-C 109.336 -1.506 . . . . 1.33 109.336 -179.84 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 357' ' ' LYS . . . . . . . . . . . . . 2.2 mttt -85.4 98.99 10.89 Favored 'General case' 0 C--N 1.304 -1.397 0 O-C-N 121.335 -1.097 . . . . 4.39 109.115 -179.953 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 358' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -46.07 132.7 7.2 Favored Pre-proline 0 N--CA 1.49 1.541 0 O-C-N 121.317 -0.864 . . . . 5.75 109.526 -179.705 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' C' C ' 359' ' ' PRO . . . . . . . . . . . . . 2.3 Cg_endo -63.79 94.04 0.18 Allowed 'Trans proline' 0 C--N 1.311 -1.442 0 C-N-CA 121.997 1.798 . . . . 5.54 110.206 179.999 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 360' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.207 0 CA-C-O 118.094 -1.392 . . . . 6.5 109.65 -179.913 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' D' D ' 319' ' ' LYS . . . . . . . . . . . . . 14.7 mttm . . . . . 0 N--CA 1.491 1.62 0 CA-C-O 121.235 0.54 . . . . 7.93 109.735 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' D' D ' 320' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 61.86 79.33 0.26 Allowed 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.242 -0.911 . . . . 6.7 109.642 179.648 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' D' D ' 321' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -158.97 78.54 3.01 Favored Pre-proline 0 C--N 1.301 -1.518 0 O-C-N 121.334 -0.854 . . . . 6.49 108.769 179.734 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' D' D ' 322' ' ' PRO . . . . . . . . . . . . . 5.7 Cg_endo -72.52 20.97 0.3 Allowed 'Trans proline' 0 C--N 1.309 -1.529 0 C-N-CA 122.838 2.359 . . . . 3.29 111.707 -179.454 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' D' D ' 323' ' ' LEU . . . . . . . . . . . . . 30.1 mt -79.41 92.27 5.2 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 120.511 -1.368 . . . . 3.16 109.333 -179.876 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' D' D ' 324' ' ' ASP . . . . . 0.474 ' OD1' ' N ' ' D' ' 324' ' ' ASP . 0.5 OUTLIER -83.82 -150.78 0.11 Allowed 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.291 -0.88 . . . . 1.54 109.69 -179.898 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' D' D ' 325' ' ' GLY . . . . . . . . . . . . . . . -69.98 -159.68 2.58 Favored Glycine 0 N--CA 1.489 2.217 0 N-CA-C 109.79 -1.324 . . . . 0.65 109.79 -179.896 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' D' D ' 326' ' ' GLU . . . . . . . . . . . . . 3.1 mm-40 -58.33 -169.29 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.306 -1.114 . . . . 2.13 109.428 -179.974 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' D' D ' 327' ' ' TYR . . . . . 0.433 ' CE2' ' HG2' ' B' ' 333' ' ' ARG . 42.6 m-85 -148.54 112.09 5.03 Favored 'General case' 0 N--CA 1.488 1.453 0 O-C-N 121.409 -0.807 . . . . 1.0 109.267 179.675 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' D' D ' 328' ' ' PHE . . . . . . . . . . . . . 58.0 m-85 -113.6 -173.25 2.23 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.533 -0.73 . . . . 0.34 109.281 -179.901 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' D' D ' 329' ' ' THR . . . . . 0.449 ' HA ' ' O ' ' B' ' 330' ' ' LEU . 76.5 p -152.28 170.57 19.72 Favored 'General case' 0 N--CA 1.488 1.472 0 O-C-N 121.276 -0.89 . . . . 1.05 109.004 -179.938 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' D' D ' 330' ' ' LEU . . . . . 0.485 ' O ' ' HA ' ' B' ' 329' ' ' THR . 32.2 tp -150.65 130.65 13.41 Favored 'General case' 0 C--N 1.302 -1.463 0 O-C-N 121.068 -1.02 . . . . 1.07 109.522 -179.901 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' D' D ' 331' ' ' GLN . . . . . . . . . . . . . 1.5 tp60 -87.83 112.27 22.29 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.263 -0.898 . . . . 0.93 109.545 179.968 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' D' D ' 332' ' ' ILE . . . . . . . . . . . . . 64.4 mt -103.33 102.85 14.25 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.45 0 O-C-N 121.217 -0.927 . . . . 1.07 109.415 179.835 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' D' D ' 333' ' ' ARG . . . . . 0.54 ' HG2' ' NH1' ' D' ' 333' ' ' ARG . 0.0 OUTLIER -72.33 144.42 48.31 Favored 'General case' 0 N--CA 1.488 1.463 0 O-C-N 121.361 -0.837 . . . . 3.42 109.724 -179.981 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' D' D ' 334' ' ' GLY . . . . . . . . . . . . . . . 84.75 130.98 2.21 Favored Glycine 0 N--CA 1.492 2.398 0 N-CA-C 109.605 -1.398 . . . . 0.41 109.605 179.933 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' D' D ' 335' ' ' ARG . . . . . 0.426 ' HG3' HH11 ' D' ' 335' ' ' ARG . 0.2 OUTLIER -76.47 -31.79 57.99 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.291 -1.123 . . . . 3.58 109.873 -179.93 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' D' D ' 336' ' ' GLU . . . . . . . . . . . . . 4.5 tp10 -57.13 -62.95 1.4 Allowed 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.107 -0.996 . . . . 2.26 109.651 -179.635 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' D' D ' 337' ' ' ARG . . . . . 0.404 HH11 ' HG3' ' D' ' 337' ' ' ARG . 7.9 mtm-85 -60.23 -31.93 70.64 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.353 -0.842 . . . . 3.64 109.732 -179.824 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' D' D ' 338' ' ' PHE . . . . . . . . . . . . . 72.2 t80 -56.47 -55.74 29.92 Favored 'General case' 0 C--N 1.302 -1.459 0 O-C-N 121.132 -0.98 . . . . 0.4 109.992 -179.858 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' D' D ' 339' ' ' GLU . . . . . . . . . . . . . 96.5 mt-10 -52.16 -37.97 56.18 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.291 -0.881 . . . . 1.99 110.335 -179.399 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' D' D ' 340' ' ' MET . . . . . 0.457 ' SD ' ' OE1' ' A' ' 343' ' ' GLU . 28.3 ttp -62.84 -47.95 81.18 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.208 -0.932 . . . . 1.13 110.199 -179.292 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' D' D ' 341' ' ' PHE . . . . . . . . . . . . . 50.3 m-85 -62.69 -40.75 98.1 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.195 -0.941 . . . . 0.21 109.747 -179.755 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' D' D ' 342' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -50.86 -43.38 59.4 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.219 -0.925 . . . . 3.15 109.926 -179.882 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' D' D ' 343' ' ' GLU . . . . . 0.443 ' OE1' ' SD ' ' A' ' 340' ' ' MET . 1.6 tt0 -58.14 -46.87 84.9 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.378 -0.826 . . . . 2.35 109.672 -179.618 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' D' D ' 344' ' ' LEU . . . . . . . . . . . . . 34.5 mt -61.35 -33.15 73.16 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.14 -0.975 . . . . 1.06 109.176 179.96 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' D' D ' 345' ' ' ASN . . . . . . . . . . . . . 12.2 t-20 -57.99 -56.31 23.62 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.449 -0.782 . . . . 1.35 109.723 179.972 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' D' D ' 346' ' ' GLU . . . . . . . . . . . . . 56.8 tt0 -63.63 -28.6 70.03 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.163 -0.96 . . . . 1.69 110.161 -179.518 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' D' D ' 347' ' ' ALA . . . . . . . . . . . . . . . -61.16 -61.65 2.41 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.051 -1.031 . . . . 1.03 109.846 -179.674 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' D' D ' 348' ' ' LEU . . . . . 0.414 ' CD2' ' N ' ' D' ' 348' ' ' LEU . 3.9 mm? -61.74 -40.9 96.73 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.17 -0.956 . . . . 1.04 109.896 -179.695 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' D' D ' 349' ' ' GLU . . . . . . . . . . . . . 96.8 mt-10 -58.49 -34.39 70.87 Favored 'General case' 0 N--CA 1.495 1.787 0 O-C-N 121.281 -0.887 . . . . 1.95 109.895 -179.737 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' D' D ' 350' ' ' LEU . . . . . 0.515 ' CD1' HD21 ' C' ' 350' ' ' LEU . 3.8 tt -64.75 -46.84 80.48 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.229 -0.919 . . . . 1.16 109.672 -179.688 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' D' D ' 351' ' ' LYS . . . . . . . . . . . . . 18.6 tttm -59.08 -41.97 89.3 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.317 -0.864 . . . . 1.97 109.987 -179.641 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' D' D ' 352' ' ' ASP . . . . . 0.472 ' O ' ' HB1' ' D' ' 355' ' ' ALA . 38.3 m-20 -53.83 -39.67 65.77 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.155 -0.966 . . . . 1.17 109.42 179.921 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' D' D ' 353' ' ' ALA . . . . . . . . . . . . . . . -67.24 -31.97 72.69 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.217 -0.927 . . . . 1.21 109.586 -179.995 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' D' D ' 354' ' ' GLN . . . . . . . . . . . . . 3.5 tt0 -82.1 3.64 26.18 Favored 'General case' 0 N--CA 1.488 1.463 0 O-C-N 121.209 -0.932 . . . . 1.68 109.667 -179.862 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' D' D ' 355' ' ' ALA . . . . . 0.472 ' HB1' ' O ' ' D' ' 352' ' ' ASP . . . -69.48 -86.22 0.02 OUTLIER 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.176 -0.952 . . . . 1.29 109.597 179.946 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' D' D ' 356' ' ' GLY . . . . . . . . . . . . . . . -55.68 88.63 0.01 OUTLIER Glycine 0 N--CA 1.491 2.364 0 N-CA-C 109.518 -1.433 . . . . 1.28 109.518 -179.881 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' D' D ' 357' ' ' LYS . . . . . 0.471 ' N ' ' O ' ' D' ' 355' ' ' ALA . 0.1 OUTLIER -89.14 18.86 4.63 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.218 -1.166 . . . . 4.45 109.688 -179.996 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' D' D ' 358' ' ' GLU . . . . . . . . . . . . . 2.3 tt0 -49.51 137.83 16.55 Favored Pre-proline 0 N--CA 1.49 1.567 0 O-C-N 121.226 -0.921 . . . . 5.71 109.343 -179.92 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' D' D ' 359' ' ' PRO . . . . . . . . . . . . . 2.1 Cg_endo -63.02 -153.84 0.02 OUTLIER 'Trans proline' 0 C--N 1.311 -1.405 0 C-N-CA 122.068 1.845 . . . . 5.6 110.091 -179.982 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' D' D ' 360' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.3 0 N-CA-C 109.298 -1.521 . . . . 6.97 109.298 179.868 . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 319' ' ' LYS . . . . . . . . . . . . . 64.2 mttt . . . . . 0 N--CA 1.489 1.498 0 N-CA-C 109.168 -0.679 . . . . 7.95 109.168 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 320' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 55.66 73.31 0.43 Allowed 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.234 -0.916 . . . . 6.71 109.091 -179.657 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 321' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -81.94 126.98 73.78 Favored Pre-proline 0 N--CA 1.49 1.566 0 O-C-N 121.415 -0.803 . . . . 6.5 109.383 -179.844 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 322' ' ' PRO . . . . . . . . . . . . . 1.3 Cg_endo -64.12 -80.97 0.01 OUTLIER 'Trans proline' 0 C--N 1.31 -1.455 0 C-N-CA 122.026 1.817 . . . . 3.3 110.295 179.837 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 323' ' ' LEU . . . . . . . . . . . . . 61.1 mt -79.72 102.05 8.78 Favored 'General case' 0 N--CA 1.488 1.445 0 O-C-N 121.338 -0.851 . . . . 3.16 109.832 -179.324 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 324' ' ' ASP . . . . . . . . . . . . . 5.7 m-20 -81.44 -152.43 0.09 Allowed 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.184 -0.948 . . . . 1.53 109.285 179.683 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 325' ' ' GLY . . . . . . . . . . . . . . . -68.58 -178.93 17.92 Favored Glycine 0 N--CA 1.49 2.251 0 N-CA-C 109.422 -1.471 . . . . 0.67 109.422 179.76 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 326' ' ' GLU . . . . . . . . . . . . . 2.8 mt-10 -59.62 176.2 0.29 Allowed 'General case' 0 N--CA 1.488 1.454 0 O-C-N 121.163 -1.198 . . . . 2.13 109.397 -179.986 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 327' ' ' TYR . . . . . 0.537 ' CE1' ' HG2' ' C' ' 333' ' ' ARG . 41.0 m-85 -150.54 112.68 4.6 Favored 'General case' 0 C--N 1.303 -1.449 0 O-C-N 121.071 -1.018 . . . . 1.0 109.56 179.753 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 328' ' ' PHE . . . . . . . . . . . . . 69.6 m-85 -112.99 -171.53 1.88 Allowed 'General case' 0 N--CA 1.488 1.475 0 O-C-N 121.386 -0.821 . . . . 0.34 109.083 179.952 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 329' ' ' THR . . . . . . . . . . . . . 35.3 p -152.39 168.88 24.04 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.254 -0.904 . . . . 1.05 109.387 179.908 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 330' ' ' LEU . . . . . 0.451 ' O ' ' HA ' ' C' ' 329' ' ' THR . 23.3 tp -152.15 132.54 13.75 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.207 -0.933 . . . . 1.07 109.679 -179.71 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 331' ' ' GLN . . . . . 0.42 ' OE1' ' O ' ' C' ' 328' ' ' PHE . 9.2 tp-100 -87.05 114.09 23.36 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.15 -0.969 . . . . 0.91 109.325 179.692 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 332' ' ' ILE . . . . . . . . . . . . . 57.9 mt -103.96 103.9 15.92 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.59 0 O-C-N 121.22 -0.925 . . . . 1.09 109.97 -179.572 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 333' ' ' ARG . . . . . 0.48 ' CG ' ' CE2' ' C' ' 327' ' ' TYR . 5.5 mpt_? -74.19 150.96 40.1 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.191 -0.943 . . . . 3.41 109.508 179.477 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 334' ' ' GLY . . . . . . . . . . . . . . . 74.39 131.25 0.22 Allowed Glycine 0 N--CA 1.491 2.349 0 N-CA-C 109.902 -1.279 . . . . 0.4 109.902 179.519 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 335' ' ' ARG . . . . . 0.513 ' NH1' ' HG2' ' A' ' 335' ' ' ARG . 1.9 ttt-85 -79.39 -27.96 41.86 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.47 -1.018 . . . . 3.55 109.585 179.976 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 336' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -58.13 -66.95 0.4 Allowed 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.344 -0.847 . . . . 2.29 109.781 -179.953 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 337' ' ' ARG . . . . . 0.48 ' NH2' ' OD1' ' C' ' 352' ' ' ASP . 3.0 mtt180 -60.17 -29.57 68.77 Favored 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.091 -1.006 . . . . 3.64 109.456 -179.817 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 338' ' ' PHE . . . . . . . . . . . . . 54.9 t80 -55.56 -60.09 3.92 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.129 -0.982 . . . . 0.41 109.802 -179.901 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 339' ' ' GLU . . . . . . . . . . . . . 1.6 mm-40 -50.41 -34.88 26.06 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.291 -0.881 . . . . 1.97 109.701 -179.609 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 340' ' ' MET . . . . . . . . . . . . . 41.8 ttp -63.3 -48.4 78.23 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.155 -0.966 . . . . 1.14 109.751 -179.83 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 341' ' ' PHE . . . . . . . . . . . . . 44.6 m-85 -62.21 -53.15 59.39 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.213 -0.929 . . . . 0.21 109.704 -179.956 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 342' ' ' ARG . . . . . 0.458 ' NH1' ' CG ' ' A' ' 342' ' ' ARG . 0.0 OUTLIER -45.68 -41.27 10.24 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.351 -0.843 . . . . 3.15 109.832 -179.881 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 343' ' ' GLU . . . . . . . . . . . . . 8.8 tp10 -59.37 -46.65 88.07 Favored 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.2 -0.937 . . . . 2.35 109.661 -179.816 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 344' ' ' LEU . . . . . . . . . . . . . 56.9 mt -62.06 -44.49 96.58 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.153 -0.967 . . . . 1.06 110.112 -179.586 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 345' ' ' ASN . . . . . . . . . . . . . 41.5 t-20 -55.68 -43.15 76.09 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.176 -0.953 . . . . 1.36 109.626 -179.625 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 346' ' ' GLU . . . . . . . . . . . . . 43.4 tt0 -61.13 -38.69 87.25 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.085 -1.009 . . . . 1.65 109.362 -179.921 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 347' ' ' ALA . . . . . 0.404 ' CB ' ' HB3' ' B' ' 347' ' ' ALA . . . -60.03 -50.27 74.39 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.305 -0.872 . . . . 1.03 109.898 -179.758 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 348' ' ' LEU . . . . . 0.529 ' N ' HD23 ' A' ' 348' ' ' LEU . 3.9 mm? -61.05 -47.3 86.99 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.235 -0.916 . . . . 1.04 110.065 -179.413 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 349' ' ' GLU . . . . . . . . . . . . . 1.6 mm-40 -57.54 -36.27 71.4 Favored 'General case' 0 N--CA 1.489 1.485 0 O-C-N 121.213 -0.929 . . . . 1.94 109.821 -179.347 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 350' ' ' LEU . . . . . 0.501 HD23 HD23 ' B' ' 350' ' ' LEU . 5.2 tt -62.07 -44.71 96.09 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.13 -0.981 . . . . 1.17 109.073 -179.992 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 351' ' ' LYS . . . . . . . . . . . . . 26.1 tttp -58.21 -44.83 88.35 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.31 -0.869 . . . . 1.97 109.239 179.762 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 352' ' ' ASP . . . . . 0.447 ' O ' ' HB1' ' A' ' 355' ' ' ALA . 5.4 m-20 -56.46 -41.16 76.03 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.256 -0.903 . . . . 1.16 109.461 179.893 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 353' ' ' ALA . . . . . . . . . . . . . . . -67.45 -32.83 73.95 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.35 -0.844 . . . . 1.22 109.32 -179.963 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 354' ' ' GLN . . . . . . . . . . . . . 7.4 tt0 -81.42 6.16 15.42 Favored 'General case' 0 N--CA 1.489 1.489 0 O-C-N 121.179 -0.951 . . . . 1.71 109.167 179.693 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 355' ' ' ALA . . . . . 0.447 ' HB1' ' O ' ' A' ' 352' ' ' ASP . . . -69.2 -91.0 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.048 -1.033 . . . . 1.3 109.626 -179.807 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 356' ' ' GLY . . . . . . . . . . . . . . . -74.41 105.58 1.88 Allowed Glycine 0 N--CA 1.493 2.457 0 N-CA-C 109.96 -1.256 . . . . 1.3 109.96 -179.688 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 357' ' ' LYS . . . . . 0.426 ' HE3' ' O ' ' A' ' 355' ' ' ALA . 0.0 OUTLIER -88.77 136.74 32.85 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.174 -1.192 . . . . 4.46 109.318 179.825 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 358' ' ' GLU . . . . . 0.56 ' CB ' ' HD3' ' A' ' 359' ' ' PRO . 3.0 mt-10 -52.5 -57.23 16.45 Favored Pre-proline 0 N--CA 1.489 1.513 0 O-C-N 121.097 -1.002 . . . . 5.75 109.751 179.896 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 359' ' ' PRO . . . . . 0.56 ' HD3' ' CB ' ' A' ' 358' ' ' GLU . 2.3 Cg_endo -61.38 112.79 1.53 Allowed 'Trans proline' 0 C--N 1.312 -1.355 0 C-N-CA 121.937 1.758 . . . . 5.63 110.343 -179.989 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 360' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.345 0 N-CA-C 109.613 -1.395 . . . . 6.97 109.613 179.899 . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' B' B ' 319' ' ' LYS . . . . . . . . . . . . . 60.6 mttt . . . . . 0 N--CA 1.488 1.474 0 N-CA-C 109.456 -0.572 . . . . 7.95 109.456 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' B' B ' 320' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 55.58 71.97 0.51 Allowed 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.197 -0.939 . . . . 6.73 109.365 179.982 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 321' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -80.65 127.49 75.23 Favored Pre-proline 0 N--CA 1.49 1.54 0 O-C-N 121.525 -0.734 . . . . 6.5 109.531 -179.881 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 322' ' ' PRO . . . . . . . . . . . . . 1.0 OUTLIER -64.86 -80.99 0.01 OUTLIER 'Trans proline' 0 C--N 1.313 -1.314 0 C-N-CA 122.082 1.855 . . . . 3.29 110.232 179.935 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 323' ' ' LEU . . . . . . . . . . . . . 63.3 mt -79.76 101.35 8.41 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.215 -0.928 . . . . 3.18 109.923 -179.494 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 324' ' ' ASP . . . . . . . . . . . . . 5.6 m-20 -80.43 -154.25 0.1 Allowed 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.26 -0.9 . . . . 1.53 109.368 179.511 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 325' ' ' GLY . . . . . . . . . . . . . . . -67.46 -179.21 13.25 Favored Glycine 0 N--CA 1.492 2.373 0 N-CA-C 109.417 -1.473 . . . . 0.65 109.417 179.769 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 326' ' ' GLU . . . . . . . . . . . . . 2.7 mt-10 -59.52 176.02 0.3 Allowed 'General case' 0 N--CA 1.489 1.489 0 O-C-N 121.147 -1.207 . . . . 2.13 109.631 -179.923 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 327' ' ' TYR . . . . . . . . . . . . . 41.3 m-85 -149.91 112.65 4.78 Favored 'General case' 0 N--CA 1.489 1.491 0 O-C-N 121.089 -1.007 . . . . 0.99 109.635 179.751 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 328' ' ' PHE . . . . . 0.446 ' O ' ' OE1' ' D' ' 331' ' ' GLN . 67.7 m-85 -113.57 -172.75 2.13 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.439 -0.788 . . . . 0.36 109.244 179.879 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 329' ' ' THR . . . . . . . . . . . . . 37.1 p -151.81 168.95 23.48 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.134 -0.979 . . . . 1.05 109.515 -179.799 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 330' ' ' LEU . . . . . . . . . . . . . 20.8 tp -152.29 132.66 13.71 Favored 'General case' 0 C--N 1.304 -1.398 0 O-C-N 121.039 -1.038 . . . . 1.07 109.532 -179.726 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 331' ' ' GLN . . . . . . . . . . . . . 9.0 tp-100 -87.03 114.01 23.27 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.33 -0.856 . . . . 0.91 109.354 179.727 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 332' ' ' ILE . . . . . . . . . . . . . 57.4 mt -103.94 103.54 15.37 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.633 0 O-C-N 121.151 -0.968 . . . . 1.08 110.11 -179.598 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 333' ' ' ARG . . . . . 0.494 ' CG ' ' CE1' ' D' ' 327' ' ' TYR . 5.7 mpt_? -73.65 150.8 41.07 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.193 -0.942 . . . . 3.42 109.399 179.798 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 334' ' ' GLY . . . . . . . . . . . . . . . 74.8 131.07 0.24 Allowed Glycine 0 N--CA 1.49 2.264 0 N-CA-C 109.857 -1.297 . . . . 0.4 109.857 179.417 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 335' ' ' ARG . . . . . 0.523 ' HG2' ' NH1' ' B' ' 335' ' ' ARG . 1.9 ttt-85 -79.46 -27.48 41.6 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.442 -1.034 . . . . 3.55 109.605 -179.976 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 336' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -58.42 -66.84 0.42 Allowed 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.341 -0.849 . . . . 2.28 109.63 -179.902 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 337' ' ' ARG . . . . . . . . . . . . . 3.0 mtt180 -60.23 -29.4 68.73 Favored 'General case' 0 N--CA 1.489 1.492 0 O-C-N 121.202 -0.936 . . . . 3.64 109.653 -179.841 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 338' ' ' PHE . . . . . . . . . . . . . 58.5 t80 -55.53 -60.0 4.04 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.257 -0.902 . . . . 0.39 109.872 -179.877 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 339' ' ' GLU . . . . . . . . . . . . . 1.9 mm-40 -50.66 -35.16 29.38 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.347 -0.845 . . . . 1.98 109.687 -179.615 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 340' ' ' MET . . . . . . . . . . . . . 43.4 ttp -63.19 -48.49 78.14 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.164 -0.96 . . . . 1.14 109.722 -179.702 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 341' ' ' PHE . . . . . . . . . . . . . 45.4 m-85 -62.56 -52.31 63.91 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.124 -0.985 . . . . 0.22 109.81 179.933 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 342' ' ' ARG . . . . . 0.436 ' NH1' ' CG ' ' B' ' 342' ' ' ARG . 0.0 OUTLIER -46.26 -40.98 12.4 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.266 -0.896 . . . . 3.15 109.693 -179.803 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' B' B ' 343' ' ' GLU . . . . . . . . . . . . . 8.9 tp10 -59.52 -46.47 88.75 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.255 -0.903 . . . . 2.35 109.611 -179.816 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 344' ' ' LEU . . . . . . . . . . . . . 57.7 mt -62.18 -44.88 95.62 Favored 'General case' 0 N--CA 1.49 1.525 0 O-C-N 121.177 -0.952 . . . . 1.05 110.219 -179.608 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 345' ' ' ASN . . . . . . . . . . . . . 43.1 t-20 -55.59 -42.64 75.08 Favored 'General case' 0 N--CA 1.489 1.476 0 O-C-N 121.177 -0.952 . . . . 1.35 109.694 -179.532 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 346' ' ' GLU . . . . . . . . . . . . . 40.9 tt0 -61.06 -39.02 88.28 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.251 -0.905 . . . . 1.66 109.391 -179.894 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 347' ' ' ALA . . . . . 0.404 ' HB3' ' CB ' ' A' ' 347' ' ' ALA . . . -60.21 -50.17 74.71 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.324 -0.86 . . . . 1.02 109.964 -179.857 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 348' ' ' LEU . . . . . 0.519 ' N ' HD23 ' B' ' 348' ' ' LEU . 3.9 mm? -60.81 -47.53 85.91 Favored 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.285 -0.884 . . . . 1.05 109.973 -179.369 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 349' ' ' GLU . . . . . . . . . . . . . 1.5 mm-40 -57.65 -35.56 70.69 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.222 -0.923 . . . . 1.95 109.983 -179.574 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 350' ' ' LEU . . . . . 0.501 HD23 HD23 ' A' ' 350' ' ' LEU . 5.2 tt -62.67 -44.69 95.6 Favored 'General case' 0 N--CA 1.489 1.505 0 O-C-N 120.968 -1.083 . . . . 1.18 108.999 179.799 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 351' ' ' LYS . . . . . . . . . . . . . 28.2 tttp -58.82 -44.69 90.9 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.195 -0.941 . . . . 1.96 109.428 179.647 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 352' ' ' ASP . . . . . 0.426 ' O ' ' HB1' ' B' ' 355' ' ' ALA . 4.5 m-20 -56.44 -41.85 77.15 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.261 -0.899 . . . . 1.16 109.286 179.659 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 353' ' ' ALA . . . . . . . . . . . . . . . -66.63 -32.77 74.31 Favored 'General case' 0 N--CA 1.494 1.749 0 O-C-N 121.27 -0.894 . . . . 1.21 109.47 179.656 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 354' ' ' GLN . . . . . . . . . . . . . 7.8 tt0 -80.96 5.26 16.83 Favored 'General case' 0 C--N 1.304 -1.387 0 O-C-N 121.222 -0.924 . . . . 1.69 109.38 179.951 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 355' ' ' ALA . . . . . 0.426 ' HB1' ' O ' ' B' ' 352' ' ' ASP . . . -68.96 -91.61 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.102 -0.999 . . . . 1.3 109.851 -179.698 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 356' ' ' GLY . . . . . . . . . . . . . . . -72.89 105.0 1.65 Allowed Glycine 0 N--CA 1.49 2.25 0 N-CA-C 109.911 -1.276 . . . . 1.29 109.911 -179.619 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 357' ' ' LYS . . . . . 0.413 ' HE3' ' O ' ' B' ' 355' ' ' ALA . 0.0 OUTLIER -88.79 136.13 33.16 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.382 -1.07 . . . . 4.45 109.37 179.84 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' B' B ' 358' ' ' GLU . . . . . 0.556 ' CB ' ' HD3' ' B' ' 359' ' ' PRO . 2.7 mt-10 -52.13 -57.07 16.54 Favored Pre-proline 0 N--CA 1.489 1.504 0 O-C-N 121.168 -0.958 . . . . 5.72 109.866 179.934 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 359' ' ' PRO . . . . . 0.556 ' HD3' ' CB ' ' B' ' 358' ' ' GLU . 2.3 Cg_endo -61.46 115.2 2.6 Favored 'Trans proline' 0 C--N 1.311 -1.413 0 C-N-CA 121.979 1.786 . . . . 5.6 110.349 -179.834 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 360' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.276 0 CA-C-O 117.979 -1.456 . . . . 6.98 109.491 179.892 . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' C' C ' 319' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.488 1.446 0 N-CA-C 109.498 -0.556 . . . . 7.03 109.498 . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 320' ' ' LYS . . . . . 0.452 ' O ' ' O ' ' C' ' 321' ' ' LYS . 0.1 OUTLIER -81.72 -19.12 42.14 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.416 -0.803 . . . . 6.84 109.742 -179.951 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' C' C ' 321' ' ' LYS . . . . . 0.452 ' O ' ' O ' ' C' ' 320' ' ' LYS . 11.8 mmtm 60.58 121.04 0.02 OUTLIER Pre-proline 0 N--CA 1.492 1.656 0 O-C-N 121.269 -0.894 . . . . 6.78 109.769 179.871 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' C' C ' 322' ' ' PRO . . . . . . . . . . . . . 1.0 OUTLIER -64.06 -80.98 0.01 OUTLIER 'Trans proline' 0 C--N 1.315 -1.208 0 C-N-CA 122.138 1.892 . . . . 3.98 110.551 179.824 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' C' C ' 323' ' ' LEU . . . . . . . . . . . . . 58.8 mt -79.87 95.21 6.0 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.107 -0.995 . . . . 4.31 109.419 -179.766 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 324' ' ' ASP . . . . . 0.47 ' N ' ' OD1' ' C' ' 324' ' ' ASP . 1.1 m-20 -79.33 -144.7 0.04 OUTLIER 'General case' 0 C--N 1.304 -1.405 0 O-C-N 121.174 -0.953 . . . . 1.63 108.858 179.8 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' C' C ' 325' ' ' GLY . . . . . 0.532 ' O ' ' CE1' ' C' ' 327' ' ' TYR . . . -68.72 175.12 31.07 Favored Glycine 0 N--CA 1.49 2.273 0 N-CA-C 109.711 -1.356 . . . . 0.82 109.711 -179.97 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' C' C ' 326' ' ' GLU . . . . . . . . . . . . . 11.6 mm-40 -58.13 -176.52 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.189 -1.183 . . . . 2.17 109.578 -179.993 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 327' ' ' TYR . . . . . 0.532 ' CE1' ' O ' ' C' ' 325' ' ' GLY . 59.5 m-85 -150.85 103.21 3.05 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.176 -0.953 . . . . 1.03 109.698 -179.877 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' C' C ' 328' ' ' PHE . . . . . 0.437 ' O ' HG21 ' C' ' 329' ' ' THR . 38.3 m-85 -102.13 -169.13 1.63 Allowed 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.294 -0.879 . . . . 0.37 109.432 -179.984 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' C' C ' 329' ' ' THR . . . . . 0.451 ' HA ' ' O ' ' A' ' 330' ' ' LEU . 68.1 p -154.41 170.4 21.46 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.107 -0.996 . . . . 1.04 109.259 179.991 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' C' C ' 330' ' ' LEU . . . . . . . . . . . . . 22.6 tp -151.31 124.76 8.91 Favored 'General case' 0 N--CA 1.489 1.495 0 O-C-N 121.272 -0.893 . . . . 1.09 109.746 -179.692 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 331' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -87.24 112.49 22.07 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.289 -0.882 . . . . 1.48 109.189 179.522 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' C' C ' 332' ' ' ILE . . . . . 0.452 HG22 ' HA ' ' C' ' 338' ' ' PHE . 94.2 mt -103.84 111.12 32.28 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.528 0 O-C-N 121.105 -0.997 . . . . 1.08 109.632 -179.895 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' C' C ' 333' ' ' ARG . . . . . 0.537 ' HG2' ' CE1' ' A' ' 327' ' ' TYR . 61.2 mtm180 -74.24 141.78 45.36 Favored 'General case' 0 C--N 1.301 -1.503 0 O-C-N 121.458 -0.776 . . . . 3.36 109.517 179.718 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' C' C ' 334' ' ' GLY . . . . . . . . . . . . . . . 86.73 132.85 3.43 Favored Glycine 0 N--CA 1.492 2.381 0 N-CA-C 109.667 -1.373 . . . . 0.35 109.667 179.921 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 335' ' ' ARG . . . . . . . . . . . . . 6.6 ttm180 -78.28 -27.21 47.36 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.264 -1.139 . . . . 3.23 109.437 179.889 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 336' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -58.02 -70.76 0.13 Allowed 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.411 -0.805 . . . . 2.62 110.126 -179.864 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' C' C ' 337' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -57.98 -30.66 66.21 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.328 -0.857 . . . . 3.61 109.677 -179.372 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' C' C ' 338' ' ' PHE . . . . . 0.452 ' HA ' HG22 ' C' ' 332' ' ' ILE . 77.8 t80 -53.38 -60.39 3.36 Favored 'General case' 0 C--N 1.303 -1.438 0 O-C-N 121.167 -0.958 . . . . 0.43 109.545 -179.797 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' C' C ' 339' ' ' GLU . . . . . . . . . . . . . 51.5 mt-10 -51.22 -32.41 23.94 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.391 -0.818 . . . . 2.05 109.954 -179.64 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 340' ' ' MET . . . . . . . . . . . . . 59.2 ttp -64.16 -51.12 65.38 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.222 -0.923 . . . . 1.1 109.643 -179.944 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 341' ' ' PHE . . . . . . . . . . . . . 49.3 m-85 -62.08 -49.86 74.25 Favored 'General case' 0 N--CA 1.489 1.495 0 O-C-N 121.184 -0.948 . . . . 0.21 110.022 -179.597 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 342' ' ' ARG . . . . . . . . . . . . . 22.7 tpt180 -49.32 -37.41 24.21 Favored 'General case' 0 N--CA 1.488 1.451 0 O-C-N 121.09 -1.006 . . . . 3.42 109.552 -179.879 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 343' ' ' GLU . . . . . . . . . . . . . 1.1 tp10 -59.18 -52.33 66.16 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.233 -0.917 . . . . 2.14 109.566 179.868 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 344' ' ' LEU . . . . . 0.452 ' O ' HD21 ' C' ' 348' ' ' LEU . 60.0 mt -62.59 -25.5 68.11 Favored 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.157 -0.964 . . . . 1.09 109.242 179.803 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' C' C ' 345' ' ' ASN . . . . . . . . . . . . . 16.2 t-20 -57.86 -56.8 17.28 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.414 -0.803 . . . . 1.38 109.383 -179.896 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 346' ' ' GLU . . . . . . . . . . . . . 20.8 tt0 -62.03 -29.45 70.29 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.34 -0.85 . . . . 2.21 110.042 -179.641 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 347' ' ' ALA . . . . . . . . . . . . . . . -61.29 -54.54 42.75 Favored 'General case' 0 N--CA 1.494 1.74 0 O-C-N 121.018 -1.051 . . . . 1.03 110.199 -179.311 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 348' ' ' LEU . . . . . 0.518 HD23 ' N ' ' C' ' 348' ' ' LEU . 4.2 mm? -61.7 -51.49 68.18 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.318 -0.864 . . . . 1.06 110.463 -179.402 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' C' C ' 349' ' ' GLU . . . . . . . . . . . . . 11.5 mt-10 -57.41 -33.37 67.79 Favored 'General case' 0 N--CA 1.494 1.757 0 O-C-N 121.11 -0.994 . . . . 2.19 110.244 -179.352 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 350' ' ' LEU . . . . . 0.58 ' CD2' ' CD1' ' D' ' 350' ' ' LEU . 9.3 tt -62.9 -42.86 99.93 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.116 -0.99 . . . . 1.2 109.365 -179.758 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' C' C ' 351' ' ' LYS . . . . . 0.497 ' HA ' ' HG2' ' C' ' 354' ' ' GLN . 38.4 tttp -60.14 -51.62 68.82 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.288 -0.882 . . . . 1.92 109.445 179.547 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' C' C ' 352' ' ' ASP . . . . . 0.48 ' OD1' ' NH2' ' A' ' 337' ' ' ARG . 18.1 m-20 -55.46 -37.91 68.37 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.297 -0.877 . . . . 1.19 109.84 179.887 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' C' C ' 353' ' ' ALA . . . . . . . . . . . . . . . -66.96 -38.91 86.98 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.298 -0.876 . . . . 1.15 109.958 -179.581 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 354' ' ' GLN . . . . . 0.497 ' HG2' ' HA ' ' C' ' 351' ' ' LYS . 10.9 pt20 -81.83 -11.6 58.89 Favored 'General case' 0 N--CA 1.489 1.484 0 O-C-N 121.186 -0.946 . . . . 1.7 109.708 -179.592 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' C' C ' 355' ' ' ALA . . . . . . . . . . . . . . . -72.52 -35.39 68.07 Favored 'General case' 0 N--CA 1.489 1.491 0 O-C-N 121.182 -0.949 . . . . 1.3 109.682 179.921 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 356' ' ' GLY . . . . . . . . . . . . . . . -80.57 9.76 48.51 Favored Glycine 0 N--CA 1.492 2.374 0 N-CA-C 110.177 -1.169 . . . . 1.33 110.177 -179.787 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 357' ' ' LYS . . . . . . . . . . . . . 3.4 tttp -84.78 100.85 11.8 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.131 -1.217 . . . . 4.39 109.254 179.784 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 358' ' ' GLU . . . . . . . . . . . . . 3.6 mt-10 -49.64 149.88 4.01 Favored Pre-proline 0 N--CA 1.49 1.572 0 O-C-N 121.195 -0.94 . . . . 5.75 109.019 179.93 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 359' ' ' PRO . . . . . . . . . . . . . 2.0 Cg_endo -67.05 -5.92 14.77 Favored 'Trans proline' 0 C--N 1.31 -1.468 0 C-N-CA 122.393 2.062 . . . . 5.54 110.301 -179.866 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 360' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.28 0 N-CA-C 109.327 -1.509 . . . . 6.5 109.327 179.887 . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' D' D ' 319' ' ' LYS . . . . . . . . . . . . . 54.6 mttt . . . . . 0 N--CA 1.492 1.647 0 N-CA-C 109.532 -0.544 . . . . 7.93 109.532 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' D' D ' 320' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 57.11 71.78 0.55 Allowed 'General case' 0 N--CA 1.489 1.478 0 O-C-N 121.249 -0.907 . . . . 6.7 109.279 -179.909 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' D' D ' 321' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -80.94 126.59 77.12 Favored Pre-proline 0 N--CA 1.493 1.682 0 O-C-N 121.386 -0.821 . . . . 6.49 109.35 -179.667 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' D' D ' 322' ' ' PRO . . . . . . . . . . . . . 0.9 OUTLIER -64.52 -80.87 0.01 OUTLIER 'Trans proline' 0 C--N 1.314 -1.276 0 C-N-CA 122.168 1.912 . . . . 3.29 110.101 -179.878 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' D' D ' 323' ' ' LEU . . . . . . . . . . . . . 62.6 mt -79.18 100.99 7.71 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.272 -0.893 . . . . 3.16 109.905 -179.779 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' D' D ' 324' ' ' ASP . . . . . . . . . . . . . 5.5 m-20 -80.41 -153.34 0.09 Allowed 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.284 -0.885 . . . . 1.54 109.359 179.635 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' D' D ' 325' ' ' GLY . . . . . . . . . . . . . . . -68.77 -178.84 18.56 Favored Glycine 0 N--CA 1.491 2.33 0 N-CA-C 109.443 -1.463 . . . . 0.65 109.443 -179.956 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' D' D ' 326' ' ' GLU . . . . . . . . . . . . . 2.6 mt-10 -59.29 176.46 0.24 Allowed 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.029 -1.277 . . . . 2.13 109.469 -179.934 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' D' D ' 327' ' ' TYR . . . . . 0.494 ' CE1' ' CG ' ' B' ' 333' ' ' ARG . 42.5 m-85 -150.53 112.49 4.55 Favored 'General case' 0 N--CA 1.488 1.442 0 O-C-N 121.204 -0.935 . . . . 1.0 109.421 179.913 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' D' D ' 328' ' ' PHE . . . . . . . . . . . . . 69.7 m-85 -114.06 -173.02 2.2 Favored 'General case' 0 N--CA 1.489 1.52 0 N-CA-C 108.985 -0.746 . . . . 0.34 108.985 179.802 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' D' D ' 329' ' ' THR . . . . . . . . . . . . . 39.7 p -151.44 169.65 21.52 Favored 'General case' 0 C--N 1.302 -1.473 0 O-C-N 121.288 -0.883 . . . . 1.05 109.379 -179.916 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' D' D ' 330' ' ' LEU . . . . . . . . . . . . . 19.5 tp -152.4 132.4 13.41 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.311 -0.868 . . . . 1.07 109.706 -179.767 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' D' D ' 331' ' ' GLN . . . . . 0.446 ' OE1' ' O ' ' B' ' 328' ' ' PHE . 9.0 tp-100 -86.83 113.77 22.92 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.313 -0.867 . . . . 0.93 109.306 179.639 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' D' D ' 332' ' ' ILE . . . . . . . . . . . . . 54.3 mt -103.72 102.97 14.46 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.746 0 O-C-N 121.242 -0.911 . . . . 1.07 110.235 -179.593 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' D' D ' 333' ' ' ARG . . . . . . . . . . . . . 5.6 mpt_? -73.45 150.92 41.31 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.027 -1.045 . . . . 3.42 109.639 179.615 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' D' D ' 334' ' ' GLY . . . . . . . . . . . . . . . 74.86 130.73 0.24 Allowed Glycine 0 N--CA 1.491 2.33 0 N-CA-C 109.836 -1.305 . . . . 0.41 109.836 179.57 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' D' D ' 335' ' ' ARG . . . . . 0.521 ' HG2' ' NH1' ' D' ' 335' ' ' ARG . 1.9 ttt-85 -79.06 -27.88 43.14 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.299 -1.118 . . . . 3.58 109.642 -179.997 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' D' D ' 336' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -57.71 -66.54 0.45 Allowed 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.21 -0.931 . . . . 2.26 109.695 -179.937 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' D' D ' 337' ' ' ARG . . . . . . . . . . . . . 2.9 mpt_? -60.73 -29.29 69.28 Favored 'General case' 0 N--CA 1.489 1.486 0 O-C-N 121.223 -0.923 . . . . 3.64 109.386 -179.772 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' D' D ' 338' ' ' PHE . . . . . . . . . . . . . 57.1 t80 -55.52 -60.55 3.26 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.19 -0.944 . . . . 0.4 109.611 -179.785 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' D' D ' 339' ' ' GLU . . . . . . . . . . . . . 2.2 mm-40 -49.91 -34.9 21.8 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.259 -0.901 . . . . 1.99 109.898 -179.745 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' D' D ' 340' ' ' MET . . . . . . . . . . . . . 42.0 ttp -63.36 -48.87 76.15 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.144 -0.972 . . . . 1.13 109.796 -179.663 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' D' D ' 341' ' ' PHE . . . . . . . . . . . . . 45.9 m-85 -62.39 -52.64 62.81 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.137 -0.977 . . . . 0.21 109.583 -179.875 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' D' D ' 342' ' ' ARG . . . . . 0.449 ' NH1' ' CG ' ' D' ' 342' ' ' ARG . 0.0 OUTLIER -45.78 -40.58 9.8 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.24 -0.913 . . . . 3.15 109.638 -179.896 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' D' D ' 343' ' ' GLU . . . . . . . . . . . . . 9.1 tp10 -59.67 -46.56 88.67 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.171 -0.956 . . . . 2.35 109.724 -179.835 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' D' D ' 344' ' ' LEU . . . . . 0.428 ' O ' HD21 ' D' ' 348' ' ' LEU . 57.1 mt -62.5 -44.92 95.19 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.289 -0.882 . . . . 1.06 110.186 -179.374 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' D' D ' 345' ' ' ASN . . . . . . . . . . . . . 44.9 t-20 -55.52 -42.47 74.58 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.176 -0.953 . . . . 1.35 109.632 -179.622 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' D' D ' 346' ' ' GLU . . . . . . . . . . . . . 33.7 tt0 -60.86 -39.49 89.36 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.204 -0.935 . . . . 1.69 109.614 -179.962 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' D' D ' 347' ' ' ALA . . . . . . . . . . . . . . . -60.5 -49.62 76.83 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.393 -0.817 . . . . 1.03 109.97 -179.861 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' D' D ' 348' ' ' LEU . . . . . 0.499 ' N ' HD23 ' D' ' 348' ' ' LEU . 3.9 mm? -60.93 -47.18 87.62 Favored 'General case' 0 N--CA 1.493 1.711 0 O-C-N 121.237 -0.914 . . . . 1.04 110.024 -179.327 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' D' D ' 349' ' ' GLU . . . . . . . . . . . . . 1.4 mm-40 -58.12 -36.01 72.32 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.11 -0.994 . . . . 1.95 109.796 -179.66 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' D' D ' 350' ' ' LEU . . . . . 0.58 ' CD1' ' CD2' ' C' ' 350' ' ' LEU . 5.2 tt -62.32 -44.54 96.26 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.124 -0.985 . . . . 1.16 109.01 -179.971 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' D' D ' 351' ' ' LYS . . . . . . . . . . . . . 28.4 tttp -59.09 -44.64 91.93 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.292 -0.88 . . . . 1.97 109.289 179.767 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' D' D ' 352' ' ' ASP . . . . . 0.437 ' O ' ' HB1' ' D' ' 355' ' ' ALA . 4.2 m-20 -56.66 -41.2 76.81 Favored 'General case' 0 N--CA 1.488 1.434 0 O-C-N 121.343 -0.848 . . . . 1.17 109.255 179.823 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' D' D ' 353' ' ' ALA . . . . . . . . . . . . . . . -67.63 -31.81 72.08 Favored 'General case' 0 N--CA 1.488 1.447 0 O-C-N 121.22 -0.925 . . . . 1.21 109.31 -179.799 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' D' D ' 354' ' ' GLN . . . . . . . . . . . . . 7.6 tt0 -81.51 5.35 18.11 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.442 -0.786 . . . . 1.68 109.485 179.897 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' D' D ' 355' ' ' ALA . . . . . 0.437 ' HB1' ' O ' ' D' ' 352' ' ' ASP . . . -69.47 -92.63 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.259 -0.901 . . . . 1.29 109.624 -179.781 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' D' D ' 356' ' ' GLY . . . . . . . . . . . . . . . -71.51 104.62 1.48 Allowed Glycine 0 N--CA 1.495 2.613 0 N-CA-C 109.911 -1.276 . . . . 1.28 109.911 -179.686 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' D' D ' 357' ' ' LYS . . . . . 0.434 ' HE3' ' O ' ' D' ' 355' ' ' ALA . 0.0 OUTLIER -88.42 136.08 33.16 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.125 -1.22 . . . . 4.45 109.239 179.622 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' D' D ' 358' ' ' GLU . . . . . 0.554 ' CB ' ' HD3' ' D' ' 359' ' ' PRO . 2.9 mt-10 -52.23 -56.7 19.76 Favored Pre-proline 0 N--CA 1.491 1.609 0 O-C-N 121.08 -1.013 . . . . 5.71 109.669 -179.915 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' D' D ' 359' ' ' PRO . . . . . 0.554 ' HD3' ' CB ' ' D' ' 358' ' ' GLU . 2.5 Cg_endo -61.47 117.01 3.78 Favored 'Trans proline' 0 C--N 1.312 -1.374 0 C-N-CA 121.96 1.773 . . . . 5.6 110.377 -179.894 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' D' D ' 360' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.286 0 CA-C-O 117.977 -1.457 . . . . 6.97 109.546 179.789 . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 319' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.49 1.534 0 N-CA-C 109.521 -0.548 . . . . 7.95 109.521 . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 320' ' ' LYS . . . . . 0.469 ' O ' ' HD3' ' A' ' 322' ' ' PRO . 0.7 OUTLIER 64.53 43.21 4.54 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.293 -0.88 . . . . 6.71 109.721 179.818 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 321' ' ' LYS . . . . . . . . . . . . . 33.8 mttt -82.05 114.19 48.89 Favored Pre-proline 0 N--CA 1.492 1.64 0 O-C-N 121.23 -0.919 . . . . 6.5 109.28 179.753 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 322' ' ' PRO . . . . . 0.469 ' HD3' ' O ' ' A' ' 320' ' ' LYS . 2.3 Cg_endo -68.54 -3.72 11.64 Favored 'Trans proline' 0 C--N 1.313 -1.291 0 C-N-CA 121.904 1.736 . . . . 3.3 110.514 -179.892 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 323' ' ' LEU . . . . . . . . . . . . . 42.4 mt -82.12 92.06 6.79 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.106 -0.996 . . . . 3.16 109.512 179.95 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 324' ' ' ASP . . . . . . . . . . . . . 3.5 m-20 -81.55 127.76 33.19 Favored 'General case' 0 N--CA 1.489 1.499 0 O-C-N 121.277 -0.889 . . . . 1.53 109.223 179.823 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 325' ' ' GLY . . . . . 0.5 ' O ' ' CD1' ' A' ' 327' ' ' TYR . . . -67.55 176.57 23.79 Favored Glycine 0 N--CA 1.49 2.273 0 N-CA-C 109.145 -1.582 . . . . 0.67 109.145 179.988 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 326' ' ' GLU . . . . . . . . . . . . . 19.9 mm-40 -56.87 171.52 0.33 Allowed 'General case' 0 N--CA 1.487 1.422 0 O-C-N 121.102 -1.234 . . . . 2.13 109.217 -179.882 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 327' ' ' TYR . . . . . 0.58 ' CE2' ' HG2' ' C' ' 333' ' ' ARG . 42.4 m-85 -148.14 109.24 4.29 Favored 'General case' 0 C--N 1.302 -1.499 0 O-C-N 121.317 -0.864 . . . . 1.0 109.318 -179.938 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 328' ' ' PHE . . . . . 0.413 ' CE1' ' HA ' ' C' ' 335' ' ' ARG . 81.5 m-85 -110.65 -170.22 1.6 Allowed 'General case' 0 N--CA 1.488 1.446 0 O-C-N 121.356 -0.84 . . . . 0.34 109.344 -179.901 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 329' ' ' THR . . . . . . . . . . . . . 73.2 p -153.7 162.22 41.43 Favored 'General case' 0 C--N 1.302 -1.462 0 O-C-N 121.267 -0.896 . . . . 1.05 109.3 -179.905 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 330' ' ' LEU . . . . . 0.472 ' O ' ' HA ' ' C' ' 329' ' ' THR . 15.8 tp -149.32 130.06 14.14 Favored 'General case' 0 N--CA 1.488 1.434 0 O-C-N 121.166 -0.959 . . . . 1.07 109.367 -179.752 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 331' ' ' GLN . . . . . . . . . . . . . 2.0 tp60 -86.03 121.64 28.93 Favored 'General case' 0 N--CA 1.489 1.482 0 O-C-N 121.35 -0.844 . . . . 0.91 109.54 -179.906 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 332' ' ' ILE . . . . . . . . . . . . . 72.1 mt -103.45 103.73 15.59 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.561 0 O-C-N 121.238 -0.914 . . . . 1.09 109.425 -179.999 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 333' ' ' ARG . . . . . 0.565 ' HG2' ' CE1' ' C' ' 327' ' ' TYR . 0.3 OUTLIER -72.68 146.24 46.66 Favored 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.258 -0.901 . . . . 3.41 109.461 -179.985 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 334' ' ' GLY . . . . . . . . . . . . . . . 75.68 119.67 0.13 Allowed Glycine 0 N--CA 1.491 2.319 0 N-CA-C 109.621 -1.392 . . . . 0.4 109.621 179.993 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 335' ' ' ARG . . . . . 0.442 ' O ' ' HB3' ' A' ' 338' ' ' PHE . 1.8 ttt180 -65.6 -27.31 68.31 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.308 -1.113 . . . . 3.55 109.612 179.951 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 336' ' ' GLU . . . . . . . . . . . . . 23.4 tt0 -57.37 -63.79 1.11 Allowed 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.198 -0.939 . . . . 2.29 109.656 -179.941 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 337' ' ' ARG . . . . . 0.538 ' HG3' ' NH1' ' A' ' 337' ' ' ARG . 0.6 OUTLIER -60.03 -27.15 66.68 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.193 -0.942 . . . . 3.64 109.376 -179.93 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 338' ' ' PHE . . . . . 0.442 ' HB3' ' O ' ' A' ' 335' ' ' ARG . 83.8 t80 -55.31 -61.61 2.22 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.38 -0.825 . . . . 0.41 109.841 -179.808 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 339' ' ' GLU . . . . . . . . . . . . . 18.0 mt-10 -51.54 -33.62 32.89 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.26 -0.9 . . . . 1.97 110.164 -179.543 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 340' ' ' MET . . . . . . . . . . . . . 38.0 ttp -64.38 -52.7 56.96 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.126 -0.984 . . . . 1.14 110.453 -179.353 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 341' ' ' PHE . . . . . . . . . . . . . 42.5 m-85 -62.1 -46.22 90.02 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.164 -0.96 . . . . 0.21 110.142 -179.284 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 342' ' ' ARG . . . . . 0.437 ' CG ' HH11 ' A' ' 342' ' ' ARG . 0.0 OUTLIER -48.17 -38.51 18.27 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.054 -1.029 . . . . 3.15 109.883 -179.678 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 343' ' ' GLU . . . . . . . . . . . . . 33.3 tt0 -59.76 -51.27 70.5 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.113 -0.992 . . . . 2.35 109.833 -179.757 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 344' ' ' LEU . . . . . 0.494 ' CD2' HD21 ' B' ' 344' ' ' LEU . 34.9 mt -61.57 -31.39 71.43 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.154 -0.966 . . . . 1.06 109.556 -179.817 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 345' ' ' ASN . . . . . . . . . . . . . 13.2 t-20 -57.82 -60.3 3.91 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.297 -0.877 . . . . 1.36 109.72 -179.868 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 346' ' ' GLU . . . . . . . . . . . . . 26.1 tt0 -61.25 -26.45 67.77 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.295 -0.878 . . . . 1.65 109.916 -179.723 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 347' ' ' ALA . . . . . . . . . . . . . . . -61.11 -58.98 6.12 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.196 -0.94 . . . . 1.03 109.966 -179.81 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 348' ' ' LEU . . . . . 0.49 ' CD1' ' NH2' ' C' ' 337' ' ' ARG . 3.8 mm? -62.22 -42.19 99.08 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.237 -0.914 . . . . 1.04 109.974 -179.541 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 349' ' ' GLU . . . . . . . . . . . . . 31.5 mt-10 -57.67 -37.51 73.54 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.209 -0.932 . . . . 1.94 110.209 -179.287 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 350' ' ' LEU . . . . . 0.528 HD21 ' CD1' ' B' ' 350' ' ' LEU . 6.0 tt -64.37 -44.38 91.58 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.142 -0.974 . . . . 1.17 109.943 -179.573 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 351' ' ' LYS . . . . . . . . . . . . . 40.1 tttp -57.96 -37.67 74.6 Favored 'General case' 0 N--CA 1.488 1.466 0 O-C-N 121.093 -1.004 . . . . 1.97 109.508 -179.676 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 352' ' ' ASP . . . . . . . . . . . . . 11.3 m-20 -55.34 -41.44 72.51 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.278 -0.889 . . . . 1.16 109.42 179.868 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 353' ' ' ALA . . . . . . . . . . . . . . . -67.81 -30.76 70.26 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.282 -0.886 . . . . 1.22 109.707 -179.866 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 354' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -80.55 1.56 29.08 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.154 -0.966 . . . . 1.71 109.631 -179.948 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 355' ' ' ALA . . . . . . . . . . . . . . . -69.13 -83.74 0.03 OUTLIER 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.24 -0.913 . . . . 1.3 109.334 179.96 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 356' ' ' GLY . . . . . . . . . . . . . . . -62.69 99.48 0.26 Allowed Glycine 0 N--CA 1.49 2.288 0 N-CA-C 109.54 -1.424 . . . . 1.3 109.54 179.996 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 357' ' ' LYS . . . . . . . . . . . . . 16.6 mttt -86.1 150.29 24.53 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.312 -1.11 . . . . 4.46 109.344 179.956 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 358' ' ' GLU . . . . . . . . . . . . . 2.8 mt-10 -49.5 161.86 0.47 Allowed Pre-proline 0 N--CA 1.49 1.538 0 O-C-N 121.166 -0.959 . . . . 5.75 109.533 -179.961 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 359' ' ' PRO . . . . . . . . . . . . . 3.1 Cg_exo -61.21 -156.1 0.02 OUTLIER 'Trans proline' 0 C--N 1.311 -1.427 0 C-N-CA 122.199 1.932 . . . . 5.63 110.351 -179.918 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 360' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.313 0 CA-C-O 117.992 -1.449 . . . . 6.97 109.545 -179.936 . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' B' B ' 319' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.49 1.554 0 CA-C-O 121.277 0.56 . . . . 7.95 109.492 . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 320' ' ' LYS . . . . . 0.472 ' O ' ' HD3' ' B' ' 322' ' ' PRO . 0.7 OUTLIER 64.35 43.37 4.73 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.303 -0.873 . . . . 6.73 109.762 179.934 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' B' B ' 321' ' ' LYS . . . . . . . . . . . . . 33.8 mttt -82.21 114.24 49.63 Favored Pre-proline 0 N--CA 1.492 1.632 0 O-C-N 121.166 -0.958 . . . . 6.5 109.2 179.796 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 322' ' ' PRO . . . . . 0.472 ' HD3' ' O ' ' B' ' 320' ' ' LYS . 2.3 Cg_endo -68.59 -3.6 11.44 Favored 'Trans proline' 0 C--N 1.312 -1.355 0 C-N-CA 121.941 1.761 . . . . 3.29 110.53 -179.853 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 323' ' ' LEU . . . . . . . . . . . . . 42.7 mt -82.2 92.19 6.85 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.141 -0.974 . . . . 3.18 109.523 179.916 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 324' ' ' ASP . . . . . . . . . . . . . 3.6 m-20 -81.86 126.48 31.94 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.295 -0.878 . . . . 1.53 109.367 179.892 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 325' ' ' GLY . . . . . 0.501 ' O ' ' CD2' ' B' ' 327' ' ' TYR . . . -65.78 176.58 15.4 Favored Glycine 0 N--CA 1.489 2.209 0 N-CA-C 109.233 -1.547 . . . . 0.65 109.233 179.801 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 326' ' ' GLU . . . . . . . . . . . . . 20.0 mm-40 -57.16 171.82 0.35 Allowed 'General case' 0 N--CA 1.487 1.421 0 O-C-N 121.101 -1.235 . . . . 2.13 109.138 179.982 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 327' ' ' TYR . . . . . 0.501 ' CD2' ' O ' ' B' ' 325' ' ' GLY . 41.7 m-85 -148.4 109.24 4.24 Favored 'General case' 0 N--CA 1.488 1.471 0 O-C-N 121.24 -0.913 . . . . 0.99 109.345 179.988 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 328' ' ' PHE . . . . . . . . . . . . . 81.3 m-85 -110.56 -170.23 1.6 Allowed 'General case' 0 N--CA 1.489 1.488 0 O-C-N 121.287 -0.883 . . . . 0.36 109.374 -179.869 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 329' ' ' THR . . . . . . . . . . . . . 73.6 p -153.68 162.17 41.48 Favored 'General case' 0 N--CA 1.488 1.443 0 O-C-N 121.254 -0.904 . . . . 1.05 109.312 -179.99 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 330' ' ' LEU . . . . . . . . . . . . . 15.9 tp -149.13 130.18 14.42 Favored 'General case' 0 N--CA 1.488 1.469 0 O-C-N 121.288 -0.883 . . . . 1.07 109.476 -179.869 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 331' ' ' GLN . . . . . . . . . . . . . 2.0 tp60 -86.02 121.52 28.76 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.283 -0.885 . . . . 0.91 109.563 -179.957 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 332' ' ' ILE . . . . . . . . . . . . . 71.7 mt -103.37 103.7 15.53 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.526 0 O-C-N 121.248 -0.907 . . . . 1.08 109.519 179.889 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 333' ' ' ARG . . . . . 0.505 ' HG2' ' CE1' ' D' ' 327' ' ' TYR . 0.3 OUTLIER -72.6 146.22 46.81 Favored 'General case' 0 N--CA 1.489 1.487 0 O-C-N 121.219 -0.925 . . . . 3.42 109.527 179.941 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' B' B ' 334' ' ' GLY . . . . . . . . . . . . . . . 75.78 119.56 0.13 Allowed Glycine 0 N--CA 1.49 2.242 0 N-CA-C 109.63 -1.388 . . . . 0.4 109.63 179.992 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 335' ' ' ARG . . . . . 0.485 ' HG3' ' CZ ' ' D' ' 328' ' ' PHE . 1.8 ttt180 -65.61 -27.39 68.37 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.267 -1.137 . . . . 3.55 109.462 -179.961 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 336' ' ' GLU . . . . . . . . . . . . . 23.5 tt0 -57.38 -63.73 1.13 Allowed 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.264 -0.897 . . . . 2.28 109.615 -179.873 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 337' ' ' ARG . . . . . 0.557 ' NH1' ' HG3' ' B' ' 337' ' ' ARG . 0.5 OUTLIER -59.88 -27.24 66.53 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.237 -0.914 . . . . 3.64 109.417 179.937 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' B' B ' 338' ' ' PHE . . . . . 0.433 ' HB3' ' O ' ' B' ' 335' ' ' ARG . 84.4 t80 -55.38 -61.48 2.31 Favored 'General case' 0 N--CA 1.488 1.455 0 O-C-N 121.273 -0.892 . . . . 0.39 109.865 -179.722 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 339' ' ' GLU . . . . . . . . . . . . . 18.0 mt-10 -51.67 -33.48 34.03 Favored 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.176 -0.953 . . . . 1.98 110.171 -179.533 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 340' ' ' MET . . . . . . . . . . . . . 38.1 ttp -64.5 -52.75 56.23 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.08 -1.012 . . . . 1.14 110.388 -179.312 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 341' ' ' PHE . . . . . . . . . . . . . 42.2 m-85 -61.96 -46.42 89.35 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.115 -0.99 . . . . 0.22 110.08 -179.285 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 342' ' ' ARG . . . . . 0.455 ' NH1' ' CG ' ' B' ' 342' ' ' ARG . 0.0 OUTLIER -47.98 -38.83 17.78 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.202 -0.936 . . . . 3.15 109.868 -179.691 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' B' B ' 343' ' ' GLU . . . . . . . . . . . . . 33.1 tt0 -59.45 -51.35 70.26 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.139 -0.976 . . . . 2.35 109.818 -179.731 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 344' ' ' LEU . . . . . 0.494 HD21 ' CD2' ' A' ' 344' ' ' LEU . 34.3 mt -61.57 -31.5 71.55 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.144 -0.972 . . . . 1.05 109.586 -179.757 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 345' ' ' ASN . . . . . . . . . . . . . 13.1 t-20 -57.86 -60.14 4.16 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.302 -0.874 . . . . 1.35 109.747 -179.849 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 346' ' ' GLU . . . . . . . . . . . . . 26.1 tt0 -61.28 -26.63 67.9 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.34 -0.85 . . . . 1.66 109.745 -179.736 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 347' ' ' ALA . . . . . . . . . . . . . . . -60.93 -59.17 5.8 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.125 -0.984 . . . . 1.02 109.934 -179.702 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 348' ' ' LEU . . . . . 0.436 HD21 ' O ' ' B' ' 344' ' ' LEU . 3.8 mm? -62.01 -42.15 98.85 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.212 -0.93 . . . . 1.05 110.042 -179.526 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 349' ' ' GLU . . . . . . . . . . . . . 31.6 mt-10 -57.81 -37.38 73.68 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.145 -0.972 . . . . 1.95 110.246 -179.303 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 350' ' ' LEU . . . . . 0.528 ' CD1' HD21 ' A' ' 350' ' ' LEU . 6.0 tt -64.45 -44.28 91.59 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.163 -0.96 . . . . 1.18 109.969 -179.565 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 351' ' ' LYS . . . . . . . . . . . . . 40.1 tttp -58.01 -37.73 74.85 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.161 -0.962 . . . . 1.96 109.43 -179.704 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 352' ' ' ASP . . . . . . . . . . . . . 11.4 m-20 -55.3 -41.44 72.34 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.219 -0.926 . . . . 1.16 109.45 179.829 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 353' ' ' ALA . . . . . . . . . . . . . . . -67.78 -30.75 70.27 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.29 -0.881 . . . . 1.21 109.705 -179.891 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 354' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -80.75 1.67 29.39 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.18 -0.95 . . . . 1.69 109.577 -179.863 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 355' ' ' ALA . . . . . . . . . . . . . . . -69.14 -83.69 0.03 OUTLIER 'General case' 0 N--CA 1.489 1.491 0 O-C-N 121.096 -1.003 . . . . 1.3 109.401 179.841 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 356' ' ' GLY . . . . . . . . . . . . . . . -62.6 99.32 0.24 Allowed Glycine 0 N--CA 1.49 2.29 0 N-CA-C 109.584 -1.407 . . . . 1.29 109.584 179.939 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 357' ' ' LYS . . . . . . . . . . . . . 16.7 mttt -86.1 150.24 24.57 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.232 -1.158 . . . . 4.45 109.321 179.976 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 358' ' ' GLU . . . . . . . . . . . . . 2.8 mt-10 -49.51 162.09 0.45 Allowed Pre-proline 0 N--CA 1.491 1.587 0 O-C-N 121.202 -0.937 . . . . 5.72 109.546 -179.889 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 359' ' ' PRO . . . . . . . . . . . . . 3.2 Cg_exo -61.23 -156.3 0.02 OUTLIER 'Trans proline' 0 C--N 1.31 -1.498 0 C-N-CA 122.236 1.958 . . . . 5.6 110.322 -179.909 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 360' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.229 0 CA-C-O 118.016 -1.436 . . . . 6.98 109.556 179.854 . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' C' C ' 319' ' ' LYS . . . . . 0.436 ' O ' ' HB2' ' C' ' 320' ' ' LYS . 0.2 OUTLIER . . . . . 0 N--CA 1.49 1.548 0 N-CA-C 109.48 -0.563 . . . . 7.03 109.48 . . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' C' C ' 320' ' ' LYS . . . . . 0.436 ' HB2' ' O ' ' C' ' 319' ' ' LYS . 0.0 OUTLIER 60.34 150.33 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.286 -0.884 . . . . 6.84 109.628 179.824 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' C' C ' 321' ' ' LYS . . . . . 0.546 ' N ' ' HD3' ' C' ' 322' ' ' PRO . 0.0 OUTLIER -158.02 57.09 1.15 Allowed Pre-proline 0 N--CA 1.489 1.49 0 O-C-N 121.288 -0.882 . . . . 6.78 109.671 179.832 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' C' C ' 322' ' ' PRO . . . . . 0.546 ' HD3' ' N ' ' C' ' 321' ' ' LYS . 2.9 Cg_endo -60.71 -151.47 0.01 OUTLIER 'Trans proline' 0 C--N 1.311 -1.424 0 C-N-CA 122.07 1.846 . . . . 3.98 109.914 179.653 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' C' C ' 323' ' ' LEU . . . . . . . . . . . . . 71.6 mt -78.68 117.03 19.44 Favored 'General case' 0 N--CA 1.488 1.458 0 O-C-N 121.108 -0.995 . . . . 4.31 109.012 179.733 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 324' ' ' ASP . . . . . . . . . . . . . 91.7 m-20 -78.95 142.34 36.78 Favored 'General case' 0 N--CA 1.488 1.47 0 O-C-N 121.276 -0.89 . . . . 1.63 109.664 -179.629 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 325' ' ' GLY . . . . . . . . . . . . . . . -68.1 176.74 25.7 Favored Glycine 0 N--CA 1.489 2.172 0 N-CA-C 109.284 -1.526 . . . . 0.82 109.284 179.872 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 326' ' ' GLU . . . . . . . . . . . . . 9.9 mm-40 -57.32 -177.65 0.03 OUTLIER 'General case' 0 N--CA 1.488 1.47 0 O-C-N 121.129 -1.218 . . . . 2.17 109.241 -179.976 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 327' ' ' TYR . . . . . 0.565 ' CE1' ' HG2' ' A' ' 333' ' ' ARG . 41.1 m-85 -148.95 108.16 3.92 Favored 'General case' 0 N--CA 1.488 1.464 0 O-C-N 121.395 -0.816 . . . . 1.03 109.257 179.906 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' C' C ' 328' ' ' PHE . . . . . 0.551 ' CD1' ' N ' ' C' ' 328' ' ' PHE . 5.0 m-85 -112.95 -168.41 1.32 Allowed 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.374 -0.829 . . . . 0.37 109.251 -179.887 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' C' C ' 329' ' ' THR . . . . . 0.472 ' HA ' ' O ' ' A' ' 330' ' ' LEU . 57.0 p -151.65 174.59 13.29 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.202 -0.936 . . . . 1.04 109.376 -179.926 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' C' C ' 330' ' ' LEU . . . . . . . . . . . . . 14.8 tp -151.28 125.93 9.59 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.186 -0.946 . . . . 1.09 109.695 -179.736 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 331' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -87.91 114.49 24.57 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.246 -0.909 . . . . 1.48 108.999 179.636 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' C' C ' 332' ' ' ILE . . . . . 0.549 HD12 ' CD2' ' C' ' 341' ' ' PHE . 11.2 mt -103.36 112.36 36.55 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.566 0 O-C-N 121.15 -0.969 . . . . 1.08 110.006 -179.73 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' C' C ' 333' ' ' ARG . . . . . 0.58 ' HG2' ' CE2' ' A' ' 327' ' ' TYR . 0.7 OUTLIER -72.6 154.46 40.75 Favored 'General case' 0 N--CA 1.488 1.44 0 O-C-N 121.283 -0.886 . . . . 3.36 109.127 179.443 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' C' C ' 334' ' ' GLY . . . . . . . . . . . . . . . 73.84 128.17 0.14 Allowed Glycine 0 N--CA 1.489 2.223 0 N-CA-C 109.552 -1.419 . . . . 0.35 109.552 179.956 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 335' ' ' ARG . . . . . 0.413 ' HA ' ' CE1' ' A' ' 328' ' ' PHE . 9.0 ttt180 -73.64 -40.0 64.08 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.324 -1.103 . . . . 3.23 109.656 -179.853 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' C' C ' 336' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -56.97 -48.84 77.45 Favored 'General case' 0 N--CA 1.494 1.739 0 O-C-N 121.262 -0.899 . . . . 2.62 109.684 -179.789 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' C' C ' 337' ' ' ARG . . . . . 0.518 ' HG2' ' NH1' ' C' ' 337' ' ' ARG . 0.0 OUTLIER -62.9 -37.76 88.24 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.139 -0.976 . . . . 3.61 109.502 179.822 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' C' C ' 338' ' ' PHE . . . . . 0.44 ' HA ' HG23 ' C' ' 332' ' ' ILE . 82.2 t80 -55.16 -51.18 67.3 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.35 -0.844 . . . . 0.43 109.861 -179.73 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' C' C ' 339' ' ' GLU . . . . . . . . . . . . . 10.3 mt-10 -52.55 -36.64 56.18 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.113 -0.992 . . . . 2.05 110.38 -179.557 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 340' ' ' MET . . . . . . . . . . . . . 35.5 ttp -63.77 -51.52 64.45 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.073 -1.017 . . . . 1.1 110.402 -179.262 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 341' ' ' PHE . . . . . 0.549 ' CD2' HD12 ' C' ' 332' ' ' ILE . 40.2 m-85 -61.84 -41.24 97.56 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.146 -0.971 . . . . 0.21 110.1 -179.281 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' C' C ' 342' ' ' ARG . . . . . . . . . . . . . 1.4 ttt180 -52.24 -40.97 62.36 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.093 -1.004 . . . . 3.42 109.526 179.934 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 343' ' ' GLU . . . . . . . . . . . . . 25.2 tt0 -58.95 -53.87 53.49 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.25 -0.906 . . . . 2.14 109.59 -179.743 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 344' ' ' LEU . . . . . 0.468 ' O ' HD21 ' C' ' 348' ' ' LEU . 30.6 mt -59.87 -26.08 65.58 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.217 -0.927 . . . . 1.09 108.939 179.915 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' C' C ' 345' ' ' ASN . . . . . . . . . . . . . 6.4 t-20 -59.52 -64.09 1.07 Allowed 'General case' 0 N--CA 1.488 1.453 0 O-C-N 121.414 -0.804 . . . . 1.38 109.534 179.823 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 346' ' ' GLU . . . . . . . . . . . . . 9.1 tp10 -62.77 -25.42 68.21 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.396 -0.815 . . . . 2.21 109.972 -179.743 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 347' ' ' ALA . . . . . . . . . . . . . . . -60.58 -57.32 13.21 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.185 -0.947 . . . . 1.03 109.862 -179.687 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 348' ' ' LEU . . . . . 0.485 HD23 ' N ' ' C' ' 348' ' ' LEU . 3.6 mm? -62.57 -45.0 94.93 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.184 -0.948 . . . . 1.06 110.045 -179.503 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' C' C ' 349' ' ' GLU . . . . . 0.421 ' O ' ' HB2' ' C' ' 352' ' ' ASP . 97.7 mt-10 -57.37 -34.4 68.79 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.267 -0.895 . . . . 2.19 110.157 -179.312 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' C' C ' 350' ' ' LEU . . . . . 0.526 HD23 ' CD1' ' D' ' 350' ' ' LEU . 7.9 tt -63.23 -44.55 94.93 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.067 -1.021 . . . . 1.2 109.209 -179.929 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' C' C ' 351' ' ' LYS . . . . . . . . . . . . . 62.9 tttm -60.65 -33.29 72.58 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.323 -0.861 . . . . 1.92 109.576 179.955 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 352' ' ' ASP . . . . . 0.421 ' HB2' ' O ' ' C' ' 349' ' ' GLU . 4.0 m-20 -52.75 -50.76 62.83 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.164 -0.96 . . . . 1.19 109.172 -179.979 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' C' C ' 353' ' ' ALA . . . . . . . . . . . . . . . -68.4 -23.3 64.63 Favored 'General case' 0 N--CA 1.488 1.447 0 O-C-N 121.316 -0.865 . . . . 1.15 108.968 179.564 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 354' ' ' GLN . . . . . . . . . . . . . 7.4 tt0 -83.06 1.83 38.18 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.413 -0.804 . . . . 1.7 109.87 -179.873 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 355' ' ' ALA . . . . . . . . . . . . . . . -67.35 -91.48 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.057 -1.027 . . . . 1.3 109.311 -179.885 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 356' ' ' GLY . . . . . . . . . . . . . . . -61.26 104.12 0.64 Allowed Glycine 0 N--CA 1.489 2.209 0 N-CA-C 109.288 -1.525 . . . . 1.33 109.288 179.83 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 357' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -86.16 101.95 13.46 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.175 -1.191 . . . . 4.39 109.562 -179.86 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' C' C ' 358' ' ' GLU . . . . . . . . . . . . . 4.6 mm-40 -49.91 119.64 10.36 Favored Pre-proline 0 N--CA 1.49 1.526 0 O-C-N 121.35 -0.843 . . . . 5.75 109.495 -179.993 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 359' ' ' PRO . . . . . . . . . . . . . 4.1 Cg_exo -59.8 -153.58 0.01 OUTLIER 'Trans proline' 0 C--N 1.313 -1.305 0 C-N-CA 121.928 1.752 . . . . 5.54 110.079 179.939 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 360' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.29 0 N-CA-C 109.525 -1.43 . . . . 6.5 109.525 179.991 . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' D' D ' 319' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.49 1.531 0 N-CA-C 109.492 -0.558 . . . . 7.93 109.492 . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' D' D ' 320' ' ' LYS . . . . . 0.478 ' O ' ' HD3' ' D' ' 322' ' ' PRO . 0.7 OUTLIER 64.57 43.19 4.5 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.367 -0.833 . . . . 6.7 109.692 179.827 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' D' D ' 321' ' ' LYS . . . . . . . . . . . . . 33.8 mttt -82.02 114.18 48.75 Favored Pre-proline 0 N--CA 1.49 1.56 0 O-C-N 121.264 -0.898 . . . . 6.49 109.282 179.739 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' D' D ' 322' ' ' PRO . . . . . 0.478 ' HD3' ' O ' ' D' ' 320' ' ' LYS . 2.3 Cg_endo -68.53 -3.61 11.42 Favored 'Trans proline' 0 C--N 1.313 -1.324 0 C-N-CA 121.903 1.735 . . . . 3.29 110.524 -179.865 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' D' D ' 323' ' ' LEU . . . . . . . . . . . . . 42.7 mt -82.13 92.03 6.78 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.119 -0.988 . . . . 3.16 109.432 179.939 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' D' D ' 324' ' ' ASP . . . . . . . . . . . . . 3.6 m-20 -81.67 127.36 32.83 Favored 'General case' 0 N--CA 1.489 1.489 0 O-C-N 121.211 -0.93 . . . . 1.54 109.195 179.818 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' D' D ' 325' ' ' GLY . . . . . 0.501 ' O ' ' CD2' ' D' ' 327' ' ' TYR . . . -67.04 176.79 21.3 Favored Glycine 0 N--CA 1.489 2.207 0 N-CA-C 109.167 -1.573 . . . . 0.65 109.167 179.908 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' D' D ' 326' ' ' GLU . . . . . . . . . . . . . 20.0 mm-40 -57.06 171.63 0.35 Allowed 'General case' 0 N--CA 1.487 1.418 0 O-C-N 121.159 -1.201 . . . . 2.13 109.229 -179.904 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' D' D ' 327' ' ' TYR . . . . . 0.505 ' CE1' ' HG2' ' B' ' 333' ' ' ARG . 42.1 m-85 -148.23 109.28 4.28 Favored 'General case' 0 C--N 1.303 -1.453 0 O-C-N 121.339 -0.85 . . . . 1.0 109.368 -179.998 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' D' D ' 328' ' ' PHE . . . . . 0.485 ' CZ ' ' HG3' ' B' ' 335' ' ' ARG . 81.6 m-85 -110.59 -170.11 1.58 Allowed 'General case' 0 N--CA 1.489 1.487 0 O-C-N 121.346 -0.846 . . . . 0.34 109.319 -179.867 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' D' D ' 329' ' ' THR . . . . . . . . . . . . . 73.4 p -153.8 162.14 41.49 Favored 'General case' 0 N--CA 1.488 1.449 0 O-C-N 121.222 -0.924 . . . . 1.05 109.271 -179.963 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' D' D ' 330' ' ' LEU . . . . . . . . . . . . . 16.0 tp -149.05 130.24 14.55 Favored 'General case' 0 N--CA 1.489 1.491 0 O-C-N 121.295 -0.878 . . . . 1.07 109.43 -179.753 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' D' D ' 331' ' ' GLN . . . . . . . . . . . . . 2.0 tp60 -86.24 121.6 29.06 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.251 -0.906 . . . . 0.93 109.474 -179.92 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' D' D ' 332' ' ' ILE . . . . . . . . . . . . . 71.9 mt -103.5 103.54 15.31 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.537 0 O-C-N 121.263 -0.898 . . . . 1.07 109.461 179.969 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' D' D ' 333' ' ' ARG . . . . . 0.471 ' HG2' ' CE1' ' B' ' 327' ' ' TYR . 0.3 OUTLIER -72.5 146.35 46.9 Favored 'General case' 0 N--CA 1.489 1.495 0 O-C-N 121.241 -0.912 . . . . 3.42 109.407 179.976 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' D' D ' 334' ' ' GLY . . . . . . . . . . . . . . . 75.76 119.39 0.13 Allowed Glycine 0 N--CA 1.491 2.364 0 N-CA-C 109.574 -1.411 . . . . 0.41 109.574 179.921 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' D' D ' 335' ' ' ARG . . . . . 0.437 ' O ' ' HB3' ' D' ' 338' ' ' PHE . 1.8 ttt180 -65.49 -27.49 68.52 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.245 -1.15 . . . . 3.58 109.513 179.911 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' D' D ' 336' ' ' GLU . . . . . . . . . . . . . 23.2 tt0 -57.24 -63.75 1.12 Allowed 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.209 -0.932 . . . . 2.26 109.643 -179.897 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' D' D ' 337' ' ' ARG . . . . . 0.556 ' NH1' ' HG3' ' D' ' 337' ' ' ARG . 0.6 OUTLIER -60.04 -27.16 66.7 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.225 -0.922 . . . . 3.64 109.374 179.999 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' D' D ' 338' ' ' PHE . . . . . 0.437 ' HB3' ' O ' ' D' ' 335' ' ' ARG . 83.8 t80 -55.39 -61.6 2.23 Favored 'General case' 0 N--CA 1.488 1.474 0 O-C-N 121.351 -0.843 . . . . 0.4 109.893 -179.8 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' D' D ' 339' ' ' GLU . . . . . . . . . . . . . 17.8 mt-10 -51.5 -33.72 32.8 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.173 -0.955 . . . . 1.99 110.131 -179.551 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' D' D ' 340' ' ' MET . . . . . . . . . . . . . 37.9 ttp -64.24 -52.85 56.75 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.143 -0.973 . . . . 1.13 110.382 -179.336 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' D' D ' 341' ' ' PHE . . . . . . . . . . . . . 42.5 m-85 -62.01 -46.16 90.44 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.223 -0.923 . . . . 0.21 110.147 -179.228 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' D' D ' 342' ' ' ARG . . . . . 0.453 ' NH1' ' CG ' ' D' ' 342' ' ' ARG . 0.0 OUTLIER -48.28 -38.63 19.26 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.113 -0.992 . . . . 3.15 109.869 -179.676 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' D' D ' 343' ' ' GLU . . . . . . . . . . . . . 33.1 tt0 -59.7 -51.32 70.27 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.121 -0.987 . . . . 2.35 109.779 -179.705 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' D' D ' 344' ' ' LEU . . . . . 0.467 ' CD2' HD23 ' C' ' 344' ' ' LEU . 34.1 mt -61.45 -31.35 71.3 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.176 -0.953 . . . . 1.06 109.667 -179.911 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' D' D ' 345' ' ' ASN . . . . . . . . . . . . . 13.0 t-20 -57.91 -60.21 4.06 Favored 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.297 -0.877 . . . . 1.35 109.758 -179.907 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' D' D ' 346' ' ' GLU . . . . . . . . . . . . . 25.9 tt0 -61.19 -26.76 67.94 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.279 -0.888 . . . . 1.69 109.782 -179.741 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' D' D ' 347' ' ' ALA . . . . . . . . . . . . . . . -60.83 -59.1 5.91 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.127 -0.983 . . . . 1.03 110.016 -179.743 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' D' D ' 348' ' ' LEU . . . . . 0.433 HD21 ' O ' ' D' ' 344' ' ' LEU . 3.8 mm? -62.17 -42.04 98.89 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.166 -0.959 . . . . 1.04 110.016 -179.533 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' D' D ' 349' ' ' GLU . . . . . . . . . . . . . 30.9 mt-10 -57.89 -37.31 73.76 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.195 -0.941 . . . . 1.95 110.182 -179.249 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' D' D ' 350' ' ' LEU . . . . . 0.526 ' CD1' HD23 ' C' ' 350' ' ' LEU . 6.0 tt -64.58 -44.28 91.19 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.106 -0.996 . . . . 1.16 109.904 -179.563 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' D' D ' 351' ' ' LYS . . . . . . . . . . . . . 40.1 tttp -57.95 -37.82 74.85 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.208 -0.932 . . . . 1.97 109.501 -179.746 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' D' D ' 352' ' ' ASP . . . . . . . . . . . . . 11.6 m-20 -55.22 -41.5 72.14 Favored 'General case' 0 N--CA 1.489 1.49 0 O-C-N 121.22 -0.925 . . . . 1.17 109.433 179.834 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' D' D ' 353' ' ' ALA . . . . . . . . . . . . . . . -67.89 -30.71 70.12 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.316 -0.865 . . . . 1.21 109.692 -179.837 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' D' D ' 354' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -80.67 1.7 28.96 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.112 -0.993 . . . . 1.68 109.59 -179.94 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' D' D ' 355' ' ' ALA . . . . . . . . . . . . . . . -69.14 -83.58 0.03 OUTLIER 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.173 -0.954 . . . . 1.29 109.354 179.873 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' D' D ' 356' ' ' GLY . . . . . . . . . . . . . . . -62.72 99.45 0.26 Allowed Glycine 0 N--CA 1.489 2.204 0 N-CA-C 109.577 -1.409 . . . . 1.28 109.577 179.979 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' D' D ' 357' ' ' LYS . . . . . . . . . . . . . 16.7 mttt -86.25 150.21 24.53 Favored 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.282 -1.128 . . . . 4.45 109.381 179.929 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' D' D ' 358' ' ' GLU . . . . . . . . . . . . . 2.8 mt-10 -49.5 161.97 0.46 Allowed Pre-proline 0 N--CA 1.49 1.556 0 O-C-N 121.266 -0.896 . . . . 5.71 109.56 -179.882 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' D' D ' 359' ' ' PRO . . . . . . . . . . . . . 3.1 Cg_exo -61.19 -156.21 0.02 OUTLIER 'Trans proline' 0 C--N 1.31 -1.457 0 C-N-CA 122.168 1.912 . . . . 5.6 110.388 -179.985 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' D' D ' 360' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.264 0 CA-C-O 117.958 -1.468 . . . . 6.97 109.502 -179.942 . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 319' ' ' LYS . . . . . 0.441 ' O ' ' N ' ' A' ' 321' ' ' LYS . 0.0 OUTLIER . . . . . 0 N--CA 1.488 1.472 0 N-CA-C 109.017 -0.735 . . . . 7.95 109.017 . . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 320' ' ' LYS . . . . . 0.401 ' CG ' ' N ' ' A' ' 321' ' ' LYS . 2.8 tptt 55.51 -92.63 0.03 OUTLIER 'General case' 0 N--CA 1.488 1.474 0 O-C-N 121.031 -1.043 . . . . 6.71 109.17 179.99 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 321' ' ' LYS . . . . . 0.441 ' N ' ' O ' ' A' ' 319' ' ' LYS . 0.2 OUTLIER -159.02 82.45 2.55 Favored Pre-proline 0 N--CA 1.491 1.596 0 O-C-N 121.349 -0.844 . . . . 6.5 109.642 179.64 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 322' ' ' PRO . . . . . 0.405 ' HD3' ' O ' ' A' ' 319' ' ' LYS . 1.9 Cg_endo -66.9 -4.33 11.13 Favored 'Trans proline' 0 C--N 1.309 -1.543 0 C-N-CA 122.481 2.121 . . . . 3.3 110.597 179.863 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 323' ' ' LEU . . . . . . . . . . . . . 47.1 mt -84.95 59.74 5.8 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.329 -0.857 . . . . 3.16 109.671 179.985 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 324' ' ' ASP . . . . . 0.426 ' OD1' ' N ' ' A' ' 324' ' ' ASP . 2.9 m-20 -81.23 -142.16 0.04 OUTLIER 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.217 -0.927 . . . . 1.53 109.52 -179.715 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 325' ' ' GLY . . . . . . . . . . . . . . . -66.88 -172.86 5.43 Favored Glycine 0 N--CA 1.49 2.296 0 N-CA-C 109.39 -1.484 . . . . 0.67 109.39 -179.936 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 326' ' ' GLU . . . . . 0.419 ' HB2' ' CE1' ' A' ' 328' ' ' PHE . 30.6 mm-40 -60.74 178.99 0.19 Allowed 'General case' 0 N--CA 1.489 1.489 0 O-C-N 121.404 -1.057 . . . . 2.13 109.779 -179.769 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 327' ' ' TYR . . . . . 0.632 ' CE2' ' CG ' ' C' ' 333' ' ' ARG . 44.2 m-85 -148.87 107.16 3.75 Favored 'General case' 0 N--CA 1.489 1.485 0 O-C-N 121.326 -0.859 . . . . 1.0 109.523 -179.967 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 328' ' ' PHE . . . . . 0.419 ' CE1' ' HB2' ' A' ' 326' ' ' GLU . 5.5 m-85 -112.93 -166.17 1.06 Allowed 'General case' 0 N--CA 1.488 1.45 0 O-C-N 121.533 -0.729 . . . . 0.34 109.081 -179.891 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 329' ' ' THR . . . . . 0.433 ' HA ' ' O ' ' C' ' 330' ' ' LEU . 36.5 p -155.32 178.5 10.15 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.109 -0.995 . . . . 1.05 109.552 179.768 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 330' ' ' LEU . . . . . 0.455 ' O ' ' HA ' ' C' ' 329' ' ' THR . 67.8 tp -151.98 130.15 11.94 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.241 -0.912 . . . . 1.07 109.024 179.937 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 331' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -87.54 109.2 19.45 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.365 -0.834 . . . . 0.91 109.688 -179.724 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 332' ' ' ILE . . . . . . . . . . . . . 52.7 mt -102.25 110.7 29.69 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.521 0 O-C-N 120.941 -1.099 . . . . 1.09 109.577 179.794 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 333' ' ' ARG . . . . . 0.518 ' NH1' ' HG2' ' A' ' 333' ' ' ARG . 0.0 OUTLIER -73.33 142.74 47.09 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.461 -0.774 . . . . 3.41 109.632 179.523 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 334' ' ' GLY . . . . . . . . . . . . . . . 82.64 132.78 1.8 Allowed Glycine 0 N--CA 1.488 2.106 0 N-CA-C 109.653 -1.379 . . . . 0.4 109.653 179.815 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 335' ' ' ARG . . . . . . . . . . . . . 10.2 ttp180 -79.95 -26.14 40.17 Favored 'General case' 0 C--N 1.302 -1.493 0 O-C-N 121.416 -1.049 . . . . 3.55 109.002 179.696 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 336' ' ' GLU . . . . . . . . . . . . . 2.2 tt0 -58.2 -68.77 0.22 Allowed 'General case' 0 N--CA 1.488 1.467 0 O-C-N 121.14 -0.975 . . . . 2.29 109.649 -179.732 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 337' ' ' ARG . . . . . . . . . . . . . 2.8 mmt180 -60.17 -27.45 67.12 Favored 'General case' 0 N--CA 1.489 1.481 0 O-C-N 121.115 -0.991 . . . . 3.64 109.421 179.752 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 338' ' ' PHE . . . . . . . . . . . . . 47.1 t80 -54.79 -58.72 6.45 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.254 -0.904 . . . . 0.41 109.604 179.914 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 339' ' ' GLU . . . . . . . . . . . . . 11.4 mt-10 -53.42 -31.82 46.93 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.176 -0.953 . . . . 1.97 109.996 -179.675 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 340' ' ' MET . . . . . . . . . . . . . 9.4 ttp -64.19 -50.64 67.32 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.249 -0.907 . . . . 1.14 109.953 -179.781 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 341' ' ' PHE . . . . . . . . . . . . . 48.2 m-85 -63.58 -50.38 69.68 Favored 'General case' 0 C--N 1.3 -1.57 0 O-C-N 121.246 -0.909 . . . . 0.21 110.001 -179.327 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 342' ' ' ARG . . . . . . . . . . . . . 71.5 ttt180 -48.87 -40.39 29.5 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.142 -0.974 . . . . 3.15 110.041 -179.373 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 343' ' ' GLU . . . . . . . . . . . . . 3.2 tt0 -61.57 -43.68 98.41 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.121 -0.987 . . . . 2.35 110.038 -179.441 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 344' ' ' LEU . . . . . 0.471 ' O ' HD21 ' A' ' 348' ' ' LEU . 45.9 mt -63.4 -41.69 98.74 Favored 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.084 -1.01 . . . . 1.06 109.587 179.985 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 345' ' ' ASN . . . . . . . . . . . . . 46.4 t30 -56.45 -49.19 75.31 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.149 -0.969 . . . . 1.36 109.932 -179.746 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 346' ' ' GLU . . . . . . . . . . . . . 11.5 tt0 -61.27 -30.16 70.3 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.177 -0.952 . . . . 1.65 109.686 -179.702 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 347' ' ' ALA . . . . . . . . . . . . . . . -63.28 -49.21 74.96 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.333 -0.854 . . . . 1.03 109.745 -179.983 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 348' ' ' LEU . . . . . 0.474 ' N ' ' CD2' ' A' ' 348' ' ' LEU . 4.3 mm? -62.66 -51.44 67.23 Favored 'General case' 0 N--CA 1.494 1.754 0 O-C-N 121.444 -0.785 . . . . 1.04 109.833 -179.789 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 349' ' ' GLU . . . . . . . . . . . . . 26.2 mt-10 -58.09 -30.83 66.55 Favored 'General case' 0 N--CA 1.488 1.446 0 O-C-N 121.352 -0.842 . . . . 1.94 109.738 -179.406 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 350' ' ' LEU . . . . . 0.461 ' O ' HD22 ' A' ' 350' ' ' LEU . 4.1 tt -63.93 -41.62 97.58 Favored 'General case' 0 C--N 1.304 -1.393 0 O-C-N 121.271 -0.893 . . . . 1.17 109.064 179.972 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 351' ' ' LYS . . . . . . . . . . . . . 15.8 tttt -60.41 -41.8 94.66 Favored 'General case' 0 N--CA 1.486 1.37 0 O-C-N 121.336 -0.853 . . . . 1.97 109.5 -179.863 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 352' ' ' ASP . . . . . . . . . . . . . 94.9 m-20 -55.71 -39.45 71.08 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.083 -1.01 . . . . 1.16 109.951 -179.8 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 353' ' ' ALA . . . . . . . . . . . . . . . -66.05 -40.13 90.7 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.079 -1.013 . . . . 1.22 109.815 -179.669 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 354' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -80.32 -7.31 59.0 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.127 -0.983 . . . . 1.71 109.573 -179.722 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 355' ' ' ALA . . . . . . . . . . . . . . . -70.92 -83.8 0.03 OUTLIER 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.032 -1.043 . . . . 1.3 109.822 -179.969 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 356' ' ' GLY . . . . . . . . . . . . . . . -71.05 89.96 0.41 Allowed Glycine 0 N--CA 1.49 2.283 0 N-CA-C 109.94 -1.264 . . . . 1.3 109.94 -179.779 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 357' ' ' LYS . . . . . . . . . . . . . 2.7 mttt -89.26 41.08 1.02 Allowed 'General case' 0 N--CA 1.487 1.38 0 O-C-N 121.403 -1.057 . . . . 4.46 109.11 179.601 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 358' ' ' GLU . . . . . . . . . . . . . 65.6 tt0 -47.91 108.43 0.91 Allowed Pre-proline 0 N--CA 1.49 1.567 0 O-C-N 121.167 -0.958 . . . . 5.75 109.562 -179.927 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 359' ' ' PRO . . . . . . . . . . . . . 2.7 Cg_endo -62.31 113.79 2.07 Favored 'Trans proline' 0 C--N 1.313 -1.318 0 C-N-CA 121.879 1.719 . . . . 5.63 109.74 179.634 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 360' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.488 2.165 0 CA-C-O 118.016 -1.436 . . . . 6.97 109.737 -179.928 . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' B' B ' 319' ' ' LYS . . . . . 0.421 ' O ' ' HD3' ' B' ' 322' ' ' PRO . 0.0 OUTLIER . . . . . 0 N--CA 1.491 1.615 0 N-CA-C 109.45 -0.574 . . . . 7.95 109.45 . . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 320' ' ' LYS . . . . . . . . . . . . . 1.9 tptt 56.07 -93.23 0.04 OUTLIER 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.326 -0.859 . . . . 6.73 109.345 179.783 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 321' ' ' LYS . . . . . 0.404 ' N ' ' O ' ' B' ' 319' ' ' LYS . 0.1 OUTLIER -159.15 81.11 2.64 Favored Pre-proline 0 N--CA 1.494 1.729 0 O-C-N 121.169 -0.957 . . . . 6.5 109.783 179.689 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' B' B ' 322' ' ' PRO . . . . . 0.421 ' HD3' ' O ' ' B' ' 319' ' ' LYS . 2.0 Cg_endo -63.92 -4.07 6.82 Favored 'Trans proline' 0 C--N 1.313 -1.299 0 C-N-CA 122.428 2.085 . . . . 3.29 110.96 179.834 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 323' ' ' LEU . . . . . . . . . . . . . 55.5 mt -84.69 61.66 6.88 Favored 'General case' 0 N--CA 1.489 1.525 0 O-C-N 121.067 -1.021 . . . . 3.18 109.835 -179.733 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 324' ' ' ASP . . . . . 0.424 ' N ' ' OD1' ' B' ' 324' ' ' ASP . 2.5 m-20 -82.03 -144.65 0.06 Allowed 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.261 -0.9 . . . . 1.53 109.352 179.792 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 325' ' ' GLY . . . . . 0.402 ' O ' ' CE1' ' B' ' 327' ' ' TYR . . . -65.35 -175.98 5.56 Favored Glycine 0 N--CA 1.487 2.053 0 N-CA-C 109.252 -1.539 . . . . 0.65 109.252 179.791 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 326' ' ' GLU . . . . . 0.406 ' HB2' ' CE1' ' B' ' 328' ' ' PHE . 26.2 mm-40 -59.02 178.12 0.13 Allowed 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.179 -1.189 . . . . 2.13 109.846 -179.809 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 327' ' ' TYR . . . . . 0.494 ' CE2' ' HG2' ' D' ' 333' ' ' ARG . 42.0 m-85 -147.38 108.04 4.14 Favored 'General case' 0 N--CA 1.488 1.457 0 O-C-N 121.149 -0.969 . . . . 0.99 109.699 -179.934 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 328' ' ' PHE . . . . . 0.406 ' CE1' ' HB2' ' B' ' 326' ' ' GLU . 4.9 m-85 -113.04 -166.46 1.08 Allowed 'General case' 0 N--CA 1.488 1.438 0 O-C-N 121.441 -0.787 . . . . 0.36 109.486 179.772 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 329' ' ' THR . . . . . 0.464 HG21 ' HA ' ' D' ' 331' ' ' GLN . 28.8 p -155.27 178.66 9.97 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.003 -1.061 . . . . 1.05 109.847 179.917 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 330' ' ' LEU . . . . . 0.452 ' O ' ' HA ' ' D' ' 329' ' ' THR . 62.9 tp -151.24 129.98 12.36 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.557 -0.714 . . . . 1.07 109.396 179.823 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 331' ' ' GLN . . . . . 0.444 ' HA ' HG21 ' D' ' 329' ' ' THR . 0.3 OUTLIER -88.45 110.81 21.14 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.126 -0.984 . . . . 0.91 109.557 -179.75 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' B' B ' 332' ' ' ILE . . . . . . . . . . . . . 50.7 mt -103.68 109.27 26.61 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.759 0 O-C-N 121.257 -0.902 . . . . 1.08 110.075 -179.516 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 333' ' ' ARG . . . . . 0.498 ' NH1' ' HG2' ' B' ' 333' ' ' ARG . 0.0 OUTLIER -72.1 142.72 49.17 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.086 -1.009 . . . . 3.42 109.349 179.798 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' B' B ' 334' ' ' GLY . . . . . . . . . . . . . . . 82.12 132.63 1.61 Allowed Glycine 0 N--CA 1.489 2.224 0 N-CA-C 109.814 -1.314 . . . . 0.4 109.814 179.68 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 335' ' ' ARG . . . . . . . . . . . . . 11.3 ttp180 -78.95 -26.71 43.55 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.488 -1.007 . . . . 3.55 109.437 179.77 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 336' ' ' GLU . . . . . . . . . . . . . 2.5 tt0 -58.04 -69.16 0.19 Allowed 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.191 -0.943 . . . . 2.28 109.578 179.864 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 337' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -59.86 -28.0 67.14 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.273 -0.892 . . . . 3.64 109.336 -179.898 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 338' ' ' PHE . . . . . . . . . . . . . 49.7 t80 -55.15 -59.58 4.57 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.214 -0.929 . . . . 0.39 109.534 179.775 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 339' ' ' GLU . . . . . . . . . . . . . 9.4 mt-10 -53.13 -33.08 50.78 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.199 -0.938 . . . . 1.98 109.748 -179.873 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 340' ' ' MET . . . . . . . . . . . . . 9.7 ttp -62.95 -51.33 67.33 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 120.955 -1.091 . . . . 1.14 109.808 -179.637 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 341' ' ' PHE . . . . . . . . . . . . . 48.7 m-85 -62.6 -48.78 77.94 Favored 'General case' 0 N--CA 1.488 1.465 0 O-C-N 121.171 -0.956 . . . . 0.22 109.968 -179.606 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 342' ' ' ARG . . . . . . . . . . . . . 70.7 ttt180 -48.62 -44.11 36.97 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.066 -1.021 . . . . 3.15 109.834 -179.791 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 343' ' ' GLU . . . . . . . . . . . . . 3.1 tt0 -58.05 -44.14 87.27 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.321 -0.862 . . . . 2.35 110.086 -179.309 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 344' ' ' LEU . . . . . 0.432 ' CD2' HD21 ' A' ' 344' ' ' LEU . 58.8 mt -63.85 -40.85 97.55 Favored 'General case' 0 N--CA 1.494 1.74 0 O-C-N 121.186 -0.946 . . . . 1.05 109.746 -179.982 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 345' ' ' ASN . . . . . 0.415 ' HA ' ' CZ ' ' D' ' 341' ' ' PHE . 48.6 t30 -57.02 -50.21 73.43 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.354 -0.841 . . . . 1.35 109.753 -179.852 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 346' ' ' GLU . . . . . . . . . . . . . 12.4 tt0 -61.58 -30.37 70.63 Favored 'General case' 0 N--CA 1.488 1.447 0 O-C-N 121.04 -1.038 . . . . 1.66 109.552 -179.876 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 347' ' ' ALA . . . . . . . . . . . . . . . -62.46 -48.85 77.8 Favored 'General case' 0 N--CA 1.493 1.692 0 O-C-N 121.2 -0.938 . . . . 1.02 110.038 -179.836 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 348' ' ' LEU . . . . . 0.504 ' N ' HD23 ' B' ' 348' ' ' LEU . 4.2 mm? -64.07 -50.87 66.65 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 120.996 -1.065 . . . . 1.05 109.584 -179.859 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 349' ' ' GLU . . . . . . . . . . . . . 29.3 mt-10 -56.5 -31.63 64.26 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.401 -0.812 . . . . 1.95 110.055 -179.321 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 350' ' ' LEU . . . . . 0.454 HD23 HD23 ' A' ' 350' ' ' LEU . 3.6 tt -63.88 -40.56 96.83 Favored 'General case' 0 N--CA 1.489 1.493 0 O-C-N 121.352 -0.842 . . . . 1.18 109.321 -179.934 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 351' ' ' LYS . . . . . . . . . . . . . 15.9 tttt -60.68 -41.99 96.19 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.199 -0.938 . . . . 1.96 109.452 179.949 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 352' ' ' ASP . . . . . . . . . . . . . 94.6 m-20 -56.0 -40.22 73.04 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.311 -0.868 . . . . 1.16 109.883 -179.723 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 353' ' ' ALA . . . . . . . . . . . . . . . -66.22 -40.34 90.22 Favored 'General case' 0 N--CA 1.494 1.74 0 O-C-N 121.073 -1.017 . . . . 1.21 109.572 -179.644 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 354' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -80.5 -5.66 56.99 Favored 'General case' 0 C--N 1.302 -1.471 0 O-C-N 121.323 -0.861 . . . . 1.69 109.817 -179.588 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 355' ' ' ALA . . . . . . . . . . . . . . . -73.08 -84.39 0.04 OUTLIER 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.096 -1.003 . . . . 1.3 110.04 179.927 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 356' ' ' GLY . . . . . . . . . . . . . . . -70.46 88.64 0.34 Allowed Glycine 0 N--CA 1.491 2.331 0 N-CA-C 110.231 -1.148 . . . . 1.29 110.231 -179.566 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 357' ' ' LYS . . . . . . . . . . . . . 3.7 mttt -88.42 38.87 0.88 Allowed 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.279 -1.13 . . . . 4.45 109.424 179.13 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 358' ' ' GLU . . . . . . . . . . . . . 59.3 tt0 -46.47 108.89 0.9 Allowed Pre-proline 0 N--CA 1.492 1.66 0 O-C-N 121.105 -0.997 . . . . 5.72 109.82 179.93 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 359' ' ' PRO . . . . . . . . . . . . . 1.8 Cg_endo -62.38 114.67 2.46 Favored 'Trans proline' 0 C--N 1.312 -1.385 0 C-N-CA 121.913 1.742 . . . . 5.6 109.783 -179.985 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 360' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.488 2.135 0 CA-C-O 117.87 -1.517 . . . . 6.98 109.578 -179.647 . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' C' C ' 319' ' ' LYS . . . . . 0.423 ' O ' ' CB ' ' C' ' 320' ' ' LYS . 4.1 mmtm . . . . . 0 N--CA 1.489 1.509 0 N-CA-C 109.119 -0.697 . . . . 7.03 109.119 . . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C ' 320' ' ' LYS . . . . . 0.423 ' CB ' ' O ' ' C' ' 319' ' ' LYS . 0.0 OUTLIER 69.8 6.84 5.93 Favored 'General case' 0 N--CA 1.488 1.445 0 O-C-N 121.383 -0.823 . . . . 6.84 109.418 -179.71 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' C' C ' 321' ' ' LYS . . . . . 0.574 ' CB ' ' HD3' ' C' ' 322' ' ' PRO . 0.7 OUTLIER -81.94 -58.42 0.47 Allowed Pre-proline 0 N--CA 1.493 1.691 0 O-C-N 121.187 -0.946 . . . . 6.78 110.052 -179.955 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' C' C ' 322' ' ' PRO . . . . . 0.574 ' HD3' ' CB ' ' C' ' 321' ' ' LYS . 1.8 Cg_endo -64.14 138.79 63.46 Favored 'Trans proline' 0 C--N 1.315 -1.205 0 C-N-CA 121.809 1.673 . . . . 3.98 109.971 -179.96 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' C' C ' 323' ' ' LEU . . . . . . . . . . . . . 14.1 mt -82.18 -159.86 0.33 Allowed 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.153 -0.967 . . . . 4.31 109.208 179.72 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C ' 324' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -81.83 126.7 32.18 Favored 'General case' 0 C--N 1.304 -1.4 0 O-C-N 120.958 -1.089 . . . . 1.63 108.955 179.872 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C ' 325' ' ' GLY . . . . . 0.459 ' O ' ' CE2' ' C' ' 327' ' ' TYR . . . -68.92 179.61 22.96 Favored Glycine 0 N--CA 1.492 2.394 0 N-CA-C 109.666 -1.374 . . . . 0.82 109.666 -179.394 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' C' C ' 326' ' ' GLU . . . . . . . . . . . . . 69.0 mm-40 -58.88 174.08 0.38 Allowed 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.199 -1.177 . . . . 2.17 109.098 179.728 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C ' 327' ' ' TYR . . . . . 0.504 ' CE1' ' HG2' ' A' ' 333' ' ' ARG . 47.9 m-85 -151.76 90.61 1.56 Allowed 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.005 -1.06 . . . . 1.03 109.961 -179.514 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' C' C ' 328' ' ' PHE . . . . . 0.489 ' O ' ' CG2' ' C' ' 329' ' ' THR . 37.4 m-85 -99.34 -159.57 0.75 Allowed 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.171 -0.955 . . . . 0.37 109.361 179.588 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' C' C ' 329' ' ' THR . . . . . 0.489 ' CG2' ' O ' ' C' ' 328' ' ' PHE . 75.7 p -157.55 -177.96 6.98 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.452 -0.78 . . . . 1.04 109.481 -179.948 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' C' C ' 330' ' ' LEU . . . . . 0.433 ' O ' ' HA ' ' A' ' 329' ' ' THR . 38.6 tp -154.45 127.61 8.37 Favored 'General case' 0 C--N 1.302 -1.492 0 O-C-N 121.32 -0.862 . . . . 1.09 109.798 -179.705 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' C' C ' 331' ' ' GLN . . . . . . . . . . . . . 37.5 tp60 -84.68 107.21 16.76 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.163 -0.961 . . . . 1.48 109.625 179.776 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C ' 332' ' ' ILE . . . . . 0.432 HD12 ' CD2' ' C' ' 341' ' ' PHE . 61.1 mt -104.63 107.88 23.52 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.56 0 O-C-N 121.148 -0.97 . . . . 1.08 109.8 -179.831 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' C' C ' 333' ' ' ARG . . . . . 0.632 ' CG ' ' CE2' ' A' ' 327' ' ' TYR . 6.8 mpt_? -74.14 139.52 44.57 Favored 'General case' 0 N--CA 1.488 1.43 0 O-C-N 121.454 -0.779 . . . . 3.36 109.757 179.969 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' C' C ' 334' ' ' GLY . . . . . . . . . . . . . . . 87.92 129.98 3.21 Favored Glycine 0 N--CA 1.494 2.528 0 N-CA-C 109.985 -1.246 . . . . 0.35 109.985 179.506 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C ' 335' ' ' ARG . . . . . 0.469 ' NH2' ' OE1' ' C' ' 339' ' ' GLU . 2.9 ttp180 -79.87 -28.76 39.91 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.522 -0.987 . . . . 3.23 110.002 -179.95 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' C' C ' 336' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -56.04 -72.7 0.07 Allowed 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.136 -0.977 . . . . 2.62 109.873 -179.388 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' C' C ' 337' ' ' ARG . . . . . . . . . . . . . 99.3 mtt180 -60.09 -27.47 67.03 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.355 -0.841 . . . . 3.61 109.566 179.942 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C ' 338' ' ' PHE . . . . . . . . . . . . . 45.7 t80 -53.15 -61.34 2.36 Favored 'General case' 0 N--CA 1.487 1.39 0 O-C-N 121.19 -0.944 . . . . 0.43 109.249 179.942 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C ' 339' ' ' GLU . . . . . 0.469 ' OE1' ' NH2' ' C' ' 335' ' ' ARG . 57.6 mt-10 -50.01 -30.74 11.22 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.406 -0.809 . . . . 2.05 109.823 -180.0 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' C' C ' 340' ' ' MET . . . . . . . . . . . . . 27.1 ttp -64.72 -51.04 64.52 Favored 'General case' 0 N--CA 1.496 1.833 0 O-C-N 121.361 -0.837 . . . . 1.1 109.995 -179.49 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C ' 341' ' ' PHE . . . . . 0.432 ' CD2' HD12 ' C' ' 332' ' ' ILE . 49.7 m-85 -63.82 -49.58 72.3 Favored 'General case' 0 N--CA 1.494 1.732 0 O-C-N 121.229 -0.919 . . . . 0.21 109.888 -179.507 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' C' C ' 342' ' ' ARG . . . . . . . . . . . . . 16.3 ttp180 -48.3 -43.16 32.68 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.172 -0.955 . . . . 3.42 109.804 -179.916 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C ' 343' ' ' GLU . . . . . . . . . . . . . 4.0 tt0 -59.4 -44.32 92.84 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.075 -1.016 . . . . 2.14 110.408 -179.361 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C ' 344' ' ' LEU . . . . . . . . . . . . . 46.2 mt -64.19 -37.03 85.99 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 120.802 -1.186 . . . . 1.09 109.96 -179.604 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C ' 345' ' ' ASN . . . . . . . . . . . . . 52.2 t-20 -56.68 -46.91 80.87 Favored 'General case' 0 C--N 1.301 -1.536 0 O-C-N 121.065 -1.022 . . . . 1.38 109.107 -179.825 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C ' 346' ' ' GLU . . . . . . . . . . . . . 32.6 tt0 -62.11 -30.65 71.16 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.281 -0.887 . . . . 2.21 109.518 179.737 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C ' 347' ' ' ALA . . . . . . . . . . . . . . . -61.66 -51.55 67.99 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.098 -1.001 . . . . 1.03 109.735 179.668 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C ' 348' ' ' LEU . . . . . 0.447 ' N ' ' CD2' ' C' ' 348' ' ' LEU . 4.4 mm? -61.88 -53.22 58.82 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.162 -0.961 . . . . 1.06 110.471 -179.249 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' C' C ' 349' ' ' GLU . . . . . 0.414 ' O ' ' HB2' ' C' ' 352' ' ' ASP . 9.6 mt-10 -57.23 -32.47 66.57 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.097 -1.002 . . . . 2.19 109.21 -179.727 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' C' C ' 350' ' ' LEU . . . . . 0.53 ' CD2' ' CD1' ' D' ' 350' ' ' LEU . 5.1 tt -62.48 -42.51 99.54 Favored 'General case' 0 C--N 1.301 -1.506 0 N-CA-C 109.383 -0.599 . . . . 1.2 109.383 179.926 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' C' C ' 351' ' ' LYS . . . . . 0.413 ' N ' HD21 ' C' ' 350' ' ' LEU . 0.0 OUTLIER -58.6 -34.06 70.69 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.158 -0.964 . . . . 1.92 109.593 179.983 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' C' C ' 352' ' ' ASP . . . . . 0.418 ' O ' ' HB1' ' C' ' 355' ' ' ALA . 7.9 m-20 -55.62 -40.3 71.94 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.254 -0.904 . . . . 1.19 109.015 179.98 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' C' C ' 353' ' ' ALA . . . . . . . . . . . . . . . -67.64 -27.41 66.85 Favored 'General case' 0 N--CA 1.488 1.467 0 O-C-N 121.244 -0.91 . . . . 1.15 109.114 179.809 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C ' 354' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -79.1 -1.09 34.29 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.469 -0.769 . . . . 1.7 109.773 -179.907 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' C' C ' 355' ' ' ALA . . . . . 0.418 ' HB1' ' O ' ' C' ' 352' ' ' ASP . . . -68.99 -91.49 0.01 OUTLIER 'General case' 0 N--CA 1.488 1.427 0 O-C-N 120.895 -1.128 . . . . 1.3 108.674 179.879 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' C' C ' 356' ' ' GLY . . . . . . . . . . . . . . . -73.47 113.76 4.39 Favored Glycine 0 N--CA 1.492 2.432 0 N-CA-C 108.857 -1.697 . . . . 1.33 108.857 179.205 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C ' 357' ' ' LYS . . . . . . . . . . . . . 3.5 pttp -87.8 132.92 33.99 Favored 'General case' 0 N--CA 1.491 1.625 0 O-C-N 121.166 -1.197 . . . . 4.39 110.118 -179.371 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C ' 358' ' ' GLU . . . . . 0.424 ' CG ' ' HD2' ' C' ' 359' ' ' PRO . 5.3 tt0 -47.1 140.18 6.75 Favored Pre-proline 0 N--CA 1.493 1.715 0 O-C-N 121.372 -0.83 . . . . 5.75 109.177 179.917 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' C' C ' 359' ' ' PRO . . . . . 0.424 ' HD2' ' CG ' ' C' ' 358' ' ' GLU . 5.3 Cg_exo -59.39 -153.64 0.01 OUTLIER 'Trans proline' 0 C--N 1.312 -1.392 0 C-N-CA 121.901 1.734 . . . . 5.54 109.979 179.781 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' C' C ' 360' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.261 0 N-CA-C 109.498 -1.441 . . . . 6.5 109.498 179.783 . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' D' D ' 319' ' ' LYS . . . . . 0.421 ' O ' ' N ' ' D' ' 321' ' ' LYS . 0.0 OUTLIER . . . . . 0 N--CA 1.492 1.668 0 N-CA-C 109.342 -0.614 . . . . 7.93 109.342 . . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' D' D ' 320' ' ' LYS . . . . . 0.404 ' CG ' ' N ' ' D' ' 321' ' ' LYS . 2.1 tptt 55.69 -93.28 0.04 OUTLIER 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.053 -1.029 . . . . 6.7 109.283 -179.602 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' D' D ' 321' ' ' LYS . . . . . 0.421 ' N ' ' O ' ' D' ' 319' ' ' LYS . 0.0 OUTLIER -158.59 83.24 2.61 Favored Pre-proline 0 N--CA 1.49 1.574 0 O-C-N 121.092 -1.005 . . . . 6.49 109.516 179.706 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' D' D ' 322' ' ' PRO . . . . . . . . . . . . . 1.0 OUTLIER -66.15 -3.01 7.82 Favored 'Trans proline' 0 C--N 1.312 -1.389 0 C-N-CA 122.357 2.038 . . . . 3.29 111.089 179.872 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' D' D ' 323' ' ' LEU . . . . . . . . . . . . . 55.1 mt -85.47 61.17 6.69 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.102 -0.999 . . . . 3.16 110.042 -179.846 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' D' D ' 324' ' ' ASP . . . . . 0.458 ' OD1' ' N ' ' D' ' 324' ' ' ASP . 1.6 m-20 -81.91 -144.02 0.06 Allowed 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.301 -0.874 . . . . 1.54 109.593 179.946 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' D' D ' 325' ' ' GLY . . . . . 0.442 ' O ' ' CE1' ' D' ' 327' ' ' TYR . . . -64.92 -177.31 5.82 Favored Glycine 0 N--CA 1.489 2.215 0 N-CA-C 109.489 -1.445 . . . . 0.65 109.489 179.893 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' D' D ' 326' ' ' GLU . . . . . 0.405 ' O ' ' CD1' ' D' ' 327' ' ' TYR . 24.9 mm-40 -57.65 179.77 0.06 Allowed 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.418 -1.048 . . . . 2.13 109.721 -179.711 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' D' D ' 327' ' ' TYR . . . . . 0.476 ' CE2' ' HG2' ' B' ' 333' ' ' ARG . 42.5 m-85 -149.01 108.8 4.03 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.353 -0.842 . . . . 1.0 109.674 -179.988 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' D' D ' 328' ' ' PHE . . . . . 0.423 ' CD1' ' N ' ' D' ' 328' ' ' PHE . 4.3 m-85 -114.02 -167.51 1.22 Allowed 'General case' 0 N--CA 1.489 1.499 0 O-C-N 121.473 -0.767 . . . . 0.34 108.986 179.813 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' D' D ' 329' ' ' THR . . . . . 0.452 ' HA ' ' O ' ' B' ' 330' ' ' LEU . 27.0 p -154.71 176.7 12.11 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.017 -1.052 . . . . 1.05 109.701 179.953 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' D' D ' 330' ' ' LEU . . . . . 0.457 ' O ' ' HA ' ' B' ' 329' ' ' THR . 64.5 tp -149.81 129.32 13.05 Favored 'General case' 0 N--CA 1.489 1.488 0 O-C-N 121.057 -1.027 . . . . 1.07 109.508 -179.786 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' D' D ' 331' ' ' GLN . . . . . 0.464 ' HA ' HG21 ' B' ' 329' ' ' THR . 0.0 OUTLIER -87.79 111.01 20.91 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.395 -0.816 . . . . 0.93 109.695 -179.882 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' D' D ' 332' ' ' ILE . . . . . . . . . . . . . 57.8 mt -103.57 111.89 34.99 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.595 0 O-C-N 121.308 -0.87 . . . . 1.07 109.793 179.987 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' D' D ' 333' ' ' ARG . . . . . 0.494 ' HG2' ' CE2' ' B' ' 327' ' ' TYR . 0.0 OUTLIER -73.86 141.13 46.12 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.145 -0.972 . . . . 3.42 109.4 179.72 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' D' D ' 334' ' ' GLY . . . . . . . . . . . . . . . 83.29 132.27 1.94 Allowed Glycine 0 N--CA 1.493 2.473 0 N-CA-C 109.866 -1.294 . . . . 0.41 109.866 179.921 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' D' D ' 335' ' ' ARG . . . . . . . . . . . . . 11.7 ttp180 -78.32 -25.86 46.67 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.206 -1.173 . . . . 3.58 109.12 179.668 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' D' D ' 336' ' ' GLU . . . . . . . . . . . . . 2.8 tt0 -58.93 -67.96 0.32 Allowed 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.318 -0.864 . . . . 2.26 109.991 -179.692 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' D' D ' 337' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -61.97 -26.46 68.22 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 120.857 -1.152 . . . . 3.64 109.026 179.951 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' D' D ' 338' ' ' PHE . . . . . . . . . . . . . 47.7 t80 -54.67 -60.9 2.72 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.344 -0.847 . . . . 0.4 109.303 179.553 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' D' D ' 339' ' ' GLU . . . . . . . . . . . . . 8.4 mt-10 -52.02 -34.03 41.13 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.247 -0.908 . . . . 1.99 109.848 -179.754 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' D' D ' 340' ' ' MET . . . . . . . . . . . . . 8.9 ttp -62.02 -50.26 72.76 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.2 -0.937 . . . . 1.13 109.923 -179.735 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' D' D ' 341' ' ' PHE . . . . . 0.415 ' CZ ' ' HA ' ' B' ' 345' ' ' ASN . 52.2 m-85 -63.73 -48.9 75.17 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 120.797 -1.19 . . . . 0.21 110.209 -179.638 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' D' D ' 342' ' ' ARG . . . . . . . . . . . . . 71.3 ttt180 -48.66 -44.96 38.13 Favored 'General case' 0 C--N 1.302 -1.498 0 O-C-N 121.296 -0.878 . . . . 3.15 109.834 -179.358 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' D' D ' 343' ' ' GLU . . . . . . . . . . . . . 3.0 tt0 -56.49 -45.48 80.95 Favored 'General case' 0 N--CA 1.489 1.494 0 O-C-N 121.204 -0.935 . . . . 2.35 109.902 -179.489 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' D' D ' 344' ' ' LEU . . . . . 0.409 ' O ' HD21 ' D' ' 348' ' ' LEU . 47.4 mt -62.94 -40.51 97.86 Favored 'General case' 0 N--CA 1.494 1.757 0 O-C-N 121.147 -0.971 . . . . 1.06 110.088 -179.712 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' D' D ' 345' ' ' ASN . . . . . . . . . . . . . 55.5 t30 -56.86 -49.47 75.4 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.173 -0.954 . . . . 1.35 109.71 -179.605 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' D' D ' 346' ' ' GLU . . . . . . . . . . . . . 9.2 tt0 -61.9 -29.91 70.53 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.365 -0.834 . . . . 1.69 109.747 -179.929 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' D' D ' 347' ' ' ALA . . . . . . . . . . . . . . . -62.52 -49.47 75.19 Favored 'General case' 0 N--CA 1.494 1.739 0 O-C-N 121.112 -0.993 . . . . 1.03 109.977 -179.984 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' D' D ' 348' ' ' LEU . . . . . 0.519 ' N ' HD23 ' D' ' 348' ' ' LEU . 4.2 mm? -63.23 -52.61 61.51 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.154 -0.966 . . . . 1.04 109.524 -179.683 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' D' D ' 349' ' ' GLU . . . . . . . . . . . . . 25.1 mt-10 -55.36 -31.18 61.54 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.494 -0.754 . . . . 1.95 109.948 -179.683 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' D' D ' 350' ' ' LEU . . . . . 0.53 ' CD1' ' CD2' ' C' ' 350' ' ' LEU . 4.4 tt -64.6 -41.3 96.31 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.316 -0.865 . . . . 1.16 109.106 179.982 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' D' D ' 351' ' ' LYS . . . . . . . . . . . . . 17.8 tttt -59.04 -44.01 91.72 Favored 'General case' 0 N--CA 1.489 1.497 0 O-C-N 121.278 -0.889 . . . . 1.97 109.648 -179.973 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' D' D ' 352' ' ' ASP . . . . . . . . . . . . . 86.6 m-20 -55.1 -40.32 70.32 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.421 -0.799 . . . . 1.17 110.125 -179.404 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' D' D ' 353' ' ' ALA . . . . . . . . . . . . . . . -66.19 -38.39 87.9 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.239 -0.913 . . . . 1.21 109.741 -179.658 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' D' D ' 354' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -81.76 -6.09 58.74 Favored 'General case' 0 C--N 1.302 -1.484 0 O-C-N 121.238 -0.914 . . . . 1.68 109.873 -179.541 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' D' D ' 355' ' ' ALA . . . . . . . . . . . . . . . -73.35 -85.71 0.03 OUTLIER 'General case' 0 N--CA 1.488 1.455 0 O-C-N 121.218 -0.926 . . . . 1.29 109.847 -179.747 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' D' D ' 356' ' ' GLY . . . . . . . . . . . . . . . -67.85 86.19 0.16 Allowed Glycine 0 N--CA 1.495 2.614 0 N-CA-C 110.265 -1.134 . . . . 1.28 110.265 -179.554 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' D' D ' 357' ' ' LYS . . . . . . . . . . . . . 2.8 mttt -87.99 39.11 0.88 Allowed 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.116 -1.226 . . . . 4.45 109.311 179.765 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' D' D ' 358' ' ' GLU . . . . . . . . . . . . . 50.0 tt0 -47.16 109.62 1.11 Allowed Pre-proline 0 N--CA 1.495 1.791 0 O-C-N 121.123 -0.986 . . . . 5.71 109.79 -179.884 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' D' D ' 359' ' ' PRO . . . . . . . . . . . . . 1.6 Cg_endo -62.21 113.79 2.05 Favored 'Trans proline' 0 C--N 1.315 -1.205 0 C-N-CA 122.064 1.843 . . . . 5.6 110.411 179.831 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' D' D ' 360' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.218 0 N-CA-C 109.172 -1.571 . . . . 6.97 109.172 179.631 . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 319' ' ' LYS . . . . . 0.418 ' O ' ' O ' ' A' ' 320' ' ' LYS . 0.9 OUTLIER . . . . . 0 N--CA 1.491 1.582 0 CA-C-O 121.304 0.574 . . . . 7.95 109.466 . . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 320' ' ' LYS . . . . . 0.418 ' O ' ' O ' ' A' ' 319' ' ' LYS . 0.1 OUTLIER 63.07 135.93 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.207 -0.933 . . . . 6.71 109.401 179.995 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 321' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -157.94 79.73 3.25 Favored Pre-proline 0 N--CA 1.49 1.538 0 O-C-N 121.285 -0.885 . . . . 6.5 109.491 -179.979 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 322' ' ' PRO . . . . . . . . . . . . . 3.4 Cg_exo -60.51 157.54 36.09 Favored 'Trans proline' 0 C--N 1.309 -1.518 0 C-N-CA 122.184 1.923 . . . . 3.3 110.1 179.964 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 323' ' ' LEU . . . . . . . . . . . . . 42.8 mt -80.87 113.97 19.44 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.205 -0.934 . . . . 3.16 109.715 -179.954 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 324' ' ' ASP . . . . . 0.412 ' HB2' ' OH ' ' A' ' 327' ' ' TYR . 26.9 m-20 -80.88 -156.67 0.14 Allowed 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.343 -0.848 . . . . 1.53 109.476 179.882 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 325' ' ' GLY . . . . . . . . . . . . . . . -68.86 -173.55 8.69 Favored Glycine 0 N--CA 1.49 2.264 0 N-CA-C 109.671 -1.371 . . . . 0.67 109.671 -179.956 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 326' ' ' GLU . . . . . . . . . . . . . 4.3 mm-40 -59.11 -174.09 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.258 -1.142 . . . . 2.13 109.499 179.976 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 327' ' ' TYR . . . . . 0.579 ' CE2' ' HG2' ' C' ' 333' ' ' ARG . 43.4 m-85 -149.52 106.11 3.53 Favored 'General case' 0 N--CA 1.488 1.444 0 O-C-N 121.289 -0.882 . . . . 1.0 109.56 179.837 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 328' ' ' PHE . . . . . 0.442 ' O ' ' NE2' ' C' ' 331' ' ' GLN . 22.6 m-85 -111.98 -167.57 1.2 Allowed 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.388 -0.82 . . . . 0.34 108.938 179.717 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 329' ' ' THR . . . . . 0.412 ' HA ' ' O ' ' C' ' 330' ' ' LEU . 77.7 p -153.59 -179.73 8.05 Favored 'General case' 0 C--N 1.303 -1.441 0 O-C-N 121.152 -0.968 . . . . 1.05 109.374 179.883 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 330' ' ' LEU . . . . . 0.42 ' O ' ' HA ' ' C' ' 329' ' ' THR . 52.1 tp -152.73 131.96 12.76 Favored 'General case' 0 N--CA 1.488 1.469 0 O-C-N 121.18 -0.95 . . . . 1.07 109.564 -179.892 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 331' ' ' GLN . . . . . . . . . . . . . 44.6 tp60 -87.99 106.64 18.27 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.359 -0.838 . . . . 0.91 109.5 179.933 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 332' ' ' ILE . . . . . 0.443 HG23 ' HA ' ' A' ' 338' ' ' PHE . 31.9 mt -103.49 103.1 14.63 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.541 0 O-C-N 121.129 -0.982 . . . . 1.09 109.534 179.926 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 333' ' ' ARG . . . . . 0.538 ' NH1' ' HG2' ' A' ' 333' ' ' ARG . 0.0 OUTLIER -72.46 151.49 42.51 Favored 'General case' 0 N--CA 1.488 1.464 0 O-C-N 121.265 -0.897 . . . . 3.41 109.445 179.861 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 334' ' ' GLY . . . . . . . . . . . . . . . 86.47 128.99 2.45 Favored Glycine 0 N--CA 1.491 2.315 0 N-CA-C 109.593 -1.403 . . . . 0.4 109.593 -179.984 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 335' ' ' ARG . . . . . 0.45 ' HA ' ' CE2' ' C' ' 328' ' ' PHE . 3.5 ttm180 -79.66 -39.09 32.2 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.278 -1.131 . . . . 3.55 109.586 179.988 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 336' ' ' GLU . . . . . . . . . . . . . 2.2 mt-10 -58.05 -61.42 2.56 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.225 -0.922 . . . . 2.29 109.7 -179.916 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 337' ' ' ARG . . . . . 0.457 ' NH1' ' CG ' ' A' ' 337' ' ' ARG . 0.0 OUTLIER -59.75 -29.33 68.08 Favored 'General case' 0 N--CA 1.489 1.494 0 O-C-N 121.168 -0.957 . . . . 3.64 109.528 -179.842 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 338' ' ' PHE . . . . . 0.443 ' HA ' HG23 ' A' ' 332' ' ' ILE . 48.3 t80 -55.69 -56.03 25.17 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.145 -0.972 . . . . 0.41 109.465 179.993 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 339' ' ' GLU . . . . . . . . . . . . . 24.0 mt-10 -50.24 -33.27 19.05 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.195 -0.941 . . . . 1.97 110.045 -179.647 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 340' ' ' MET . . . . . . . . . . . . . 32.1 ttp -63.19 -51.0 68.13 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.158 -0.963 . . . . 1.14 109.878 -179.713 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 341' ' ' PHE . . . . . . . . . . . . . 38.9 m-85 -62.67 -52.02 64.93 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.177 -0.952 . . . . 0.21 109.704 -179.741 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 342' ' ' ARG . . . . . . . . . . . . . 9.7 ttm180 -47.63 -36.65 11.21 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.188 -0.945 . . . . 3.15 109.438 -179.948 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 343' ' ' GLU . . . . . . . . . . . . . 32.2 tt0 -59.18 -49.61 77.18 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.219 -0.926 . . . . 2.35 109.433 -179.92 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 344' ' ' LEU . . . . . 0.429 ' O ' HD21 ' A' ' 348' ' ' LEU . 57.5 mt -62.42 -32.31 73.14 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.223 -0.923 . . . . 1.06 109.437 179.984 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 345' ' ' ASN . . . . . . . . . . . . . 9.6 t-20 -56.81 -54.93 40.77 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.302 -0.874 . . . . 1.36 109.618 -179.886 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 346' ' ' GLU . . . . . . . . . . . . . 43.8 tp10 -61.35 -31.66 71.54 Favored 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.274 -0.891 . . . . 1.65 109.813 -179.797 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 347' ' ' ALA . . . . . . . . . . . . . . . -59.91 -57.86 11.04 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.204 -0.935 . . . . 1.03 109.988 -179.73 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 348' ' ' LEU . . . . . 0.484 ' N ' ' CD2' ' A' ' 348' ' ' LEU . 4.2 mm? -61.59 -41.91 98.11 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.206 -0.934 . . . . 1.04 109.81 -179.584 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 349' ' ' GLU . . . . . . . . . . . . . 98.5 mt-10 -58.08 -34.93 70.69 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.264 -0.898 . . . . 1.94 110.007 -179.53 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 350' ' ' LEU . . . . . 0.539 HD21 ' CD1' ' B' ' 350' ' ' LEU . 5.7 tt -63.54 -46.46 85.89 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.111 -0.993 . . . . 1.17 109.523 -179.819 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 351' ' ' LYS . . . . . . . . . . . . . 42.4 tttt -59.38 -38.0 79.37 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.274 -0.891 . . . . 1.97 109.443 -179.978 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 352' ' ' ASP . . . . . 0.419 ' O ' ' HB1' ' A' ' 355' ' ' ALA . 23.0 m-20 -55.71 -36.14 66.86 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.199 -0.938 . . . . 1.16 109.671 -179.995 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 353' ' ' ALA . . . . . . . . . . . . . . . -66.88 -35.75 80.74 Favored 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.235 -0.916 . . . . 1.22 109.76 -179.745 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 354' ' ' GLN . . . . . . . . . . . . . 5.9 mt-30 -81.23 -3.9 53.81 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.215 -0.928 . . . . 1.71 109.657 -179.92 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 355' ' ' ALA . . . . . 0.419 ' HB1' ' O ' ' A' ' 352' ' ' ASP . . . -70.97 -82.72 0.04 OUTLIER 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.134 -0.979 . . . . 1.3 109.579 179.887 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 356' ' ' GLY . . . . . . . . . . . . . . . -59.08 93.39 0.05 OUTLIER Glycine 0 N--CA 1.491 2.302 0 N-CA-C 109.688 -1.365 . . . . 1.3 109.688 -179.941 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 357' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -86.81 134.25 33.57 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.235 -1.156 . . . . 4.46 109.301 179.836 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 358' ' ' GLU . . . . . . . . . . . . . 19.0 tt0 -49.53 133.42 18.86 Favored Pre-proline 0 N--CA 1.49 1.558 0 O-C-N 121.234 -0.917 . . . . 5.75 109.412 -179.816 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 359' ' ' PRO . . . . . . . . . . . . . 2.2 Cg_endo -62.69 167.76 11.23 Favored 'Trans proline' 0 C--N 1.313 -1.329 0 C-N-CA 122.074 1.849 . . . . 5.63 110.164 179.929 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 360' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.35 0 CA-C-O 118.004 -1.442 . . . . 6.97 109.54 179.932 . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' B' B ' 319' ' ' LYS . . . . . 0.412 ' O ' ' O ' ' B' ' 320' ' ' LYS . 0.9 OUTLIER . . . . . 0 N--CA 1.492 1.647 0 N-CA-C 109.451 -0.574 . . . . 7.95 109.451 . . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 320' ' ' LYS . . . . . 0.412 ' O ' ' O ' ' B' ' 319' ' ' LYS . 0.1 OUTLIER 63.14 135.85 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.247 -0.908 . . . . 6.73 109.383 -179.992 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' B' B ' 321' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -157.85 79.73 3.28 Favored Pre-proline 0 N--CA 1.489 1.478 0 O-C-N 121.229 -0.919 . . . . 6.5 109.558 179.984 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 322' ' ' PRO . . . . . . . . . . . . . 3.4 Cg_exo -60.49 157.44 36.45 Favored 'Trans proline' 0 C--N 1.311 -1.419 0 C-N-CA 122.161 1.907 . . . . 3.29 110.23 180.0 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 323' ' ' LEU . . . . . . . . . . . . . 43.5 mt -80.92 113.96 19.48 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.238 -0.914 . . . . 3.18 109.519 -179.741 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 324' ' ' ASP . . . . . 0.41 ' HB2' ' OH ' ' B' ' 327' ' ' TYR . 26.9 m-20 -81.01 -156.4 0.14 Allowed 'General case' 0 N--CA 1.489 1.488 0 O-C-N 121.284 -0.885 . . . . 1.53 109.608 179.896 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 325' ' ' GLY . . . . . . . . . . . . . . . -68.87 -173.47 8.64 Favored Glycine 0 N--CA 1.49 2.291 0 N-CA-C 109.562 -1.415 . . . . 0.65 109.562 -179.885 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 326' ' ' GLU . . . . . . . . . . . . . 4.3 mm-40 -59.21 -173.96 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.327 -1.102 . . . . 2.13 109.43 179.904 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 327' ' ' TYR . . . . . 0.499 ' CE2' ' HG2' ' D' ' 333' ' ' ARG . 43.1 m-85 -149.59 106.1 3.52 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.365 -0.835 . . . . 0.99 109.46 179.823 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 328' ' ' PHE . . . . . 0.482 ' CE1' ' HA ' ' D' ' 335' ' ' ARG . 22.5 m-85 -111.97 -167.74 1.22 Allowed 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.236 -0.915 . . . . 0.36 108.974 179.653 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 329' ' ' THR . . . . . . . . . . . . . 75.7 p -153.38 -179.55 7.85 Favored 'General case' 0 N--CA 1.488 1.453 0 O-C-N 121.195 -0.941 . . . . 1.05 109.331 179.899 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 330' ' ' LEU . . . . . . . . . . . . . 52.2 tp -152.93 131.87 12.53 Favored 'General case' 0 N--CA 1.489 1.484 0 O-C-N 121.274 -0.891 . . . . 1.07 109.484 -179.867 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 331' ' ' GLN . . . . . . . . . . . . . 44.6 tp60 -88.09 106.41 18.14 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.284 -0.885 . . . . 0.91 109.505 179.967 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 332' ' ' ILE . . . . . 0.439 HG23 ' HA ' ' B' ' 338' ' ' PHE . 31.5 mt -103.28 103.26 14.84 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.601 0 O-C-N 121.198 -0.939 . . . . 1.08 109.609 179.86 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 333' ' ' ARG . . . . . 0.547 ' HG2' ' CE2' ' D' ' 327' ' ' TYR . 0.0 OUTLIER -72.55 151.39 42.45 Favored 'General case' 0 N--CA 1.489 1.5 0 O-C-N 121.278 -0.889 . . . . 3.42 109.465 179.835 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' B' B ' 334' ' ' GLY . . . . . . . . . . . . . . . 86.6 128.96 2.48 Favored Glycine 0 N--CA 1.49 2.254 0 N-CA-C 109.556 -1.418 . . . . 0.4 109.556 -179.977 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 335' ' ' ARG . . . . . 0.44 ' O ' ' HB3' ' B' ' 338' ' ' PHE . 3.4 ttm180 -79.58 -39.29 32.06 Favored 'General case' 0 N--CA 1.489 1.495 0 O-C-N 121.3 -1.117 . . . . 3.55 109.506 -179.994 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 336' ' ' GLU . . . . . . . . . . . . . 2.2 mt-10 -57.89 -61.36 2.59 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.221 -0.924 . . . . 2.28 109.77 -179.921 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 337' ' ' ARG . . . . . 0.455 ' NH1' ' CG ' ' B' ' 337' ' ' ARG . 0.0 OUTLIER -59.82 -29.35 68.19 Favored 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.226 -0.921 . . . . 3.64 109.502 -179.871 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' B' B ' 338' ' ' PHE . . . . . 0.44 ' HB3' ' O ' ' B' ' 335' ' ' ARG . 48.0 t80 -55.54 -56.12 23.96 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.184 -0.948 . . . . 0.39 109.469 179.943 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 339' ' ' GLU . . . . . . . . . . . . . 23.9 mt-10 -50.36 -33.17 19.49 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.27 -0.894 . . . . 1.98 109.99 -179.657 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 340' ' ' MET . . . . . . . . . . . . . 32.3 ttp -63.39 -50.85 68.24 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.052 -1.03 . . . . 1.14 109.812 -179.73 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 341' ' ' PHE . . . . . . . . . . . . . 39.3 m-85 -62.74 -51.8 65.75 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.19 -0.944 . . . . 0.22 109.819 -179.812 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 342' ' ' ARG . . . . . . . . . . . . . 9.7 ttm180 -47.78 -36.83 12.26 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.245 -0.91 . . . . 3.15 109.522 -179.988 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 343' ' ' GLU . . . . . . . . . . . . . 32.5 tt0 -58.88 -49.72 76.72 Favored 'General case' 0 N--CA 1.489 1.486 0 O-C-N 121.214 -0.929 . . . . 2.35 109.47 179.957 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 344' ' ' LEU . . . . . 0.43 ' O ' HD21 ' B' ' 348' ' ' LEU . 56.8 mt -62.39 -32.34 73.14 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.174 -0.954 . . . . 1.05 109.466 179.947 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 345' ' ' ASN . . . . . . . . . . . . . 9.6 t-20 -56.81 -54.88 41.26 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.352 -0.842 . . . . 1.35 109.678 -179.87 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 346' ' ' GLU . . . . . . . . . . . . . 43.8 tp10 -61.37 -31.66 71.56 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.237 -0.914 . . . . 1.66 109.787 -179.849 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 347' ' ' ALA . . . . . . . . . . . . . . . -59.93 -57.8 11.29 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.235 -0.916 . . . . 1.02 109.974 -179.663 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 348' ' ' LEU . . . . . 0.474 ' CD2' ' N ' ' B' ' 348' ' ' LEU . 4.2 mm? -61.6 -41.91 98.11 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.198 -0.939 . . . . 1.05 109.828 -179.558 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 349' ' ' GLU . . . . . . . . . . . . . 98.5 mt-10 -57.97 -35.18 70.81 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.246 -0.909 . . . . 1.95 109.946 -179.492 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 350' ' ' LEU . . . . . 0.539 ' CD1' HD21 ' A' ' 350' ' ' LEU . 5.7 tt -63.33 -46.59 85.92 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.157 -0.964 . . . . 1.18 109.576 -179.836 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 351' ' ' LYS . . . . . . . . . . . . . 42.4 tttt -59.37 -37.86 78.98 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.294 -0.879 . . . . 1.96 109.398 -179.899 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 352' ' ' ASP . . . . . 0.414 ' O ' ' HB1' ' B' ' 355' ' ' ALA . 22.8 m-20 -55.72 -36.17 66.93 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.349 -0.844 . . . . 1.16 109.717 179.992 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 353' ' ' ALA . . . . . . . . . . . . . . . -66.91 -35.75 80.7 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.217 -0.927 . . . . 1.21 109.838 -179.752 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 354' ' ' GLN . . . . . . . . . . . . . 5.9 mt-30 -81.19 -4.09 54.31 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.115 -0.991 . . . . 1.69 109.543 -179.892 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 355' ' ' ALA . . . . . 0.414 ' HB1' ' O ' ' B' ' 352' ' ' ASP . . . -70.68 -82.52 0.04 OUTLIER 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.187 -0.946 . . . . 1.3 109.692 179.877 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 356' ' ' GLY . . . . . . . . . . . . . . . -59.35 93.6 0.05 OUTLIER Glycine 0 N--CA 1.491 2.34 0 N-CA-C 109.623 -1.391 . . . . 1.29 109.623 -179.926 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 357' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -86.88 134.16 33.55 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.259 -1.142 . . . . 4.45 109.265 179.816 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 358' ' ' GLU . . . . . . . . . . . . . 19.0 tt0 -49.49 133.57 18.54 Favored Pre-proline 0 N--CA 1.491 1.58 0 O-C-N 121.15 -0.969 . . . . 5.72 109.375 -179.81 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 359' ' ' PRO . . . . . . . . . . . . . 2.3 Cg_endo -62.83 167.75 11.46 Favored 'Trans proline' 0 C--N 1.312 -1.343 0 C-N-CA 121.962 1.775 . . . . 5.6 110.129 179.956 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 360' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.285 0 CA-C-O 117.961 -1.466 . . . . 6.98 109.507 179.954 . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' C' C ' 319' ' ' LYS . . . . . 0.431 ' O ' ' HB2' ' C' ' 320' ' ' LYS . 0.2 OUTLIER . . . . . 0 N--CA 1.49 1.571 0 N-CA-C 109.476 -0.565 . . . . 7.03 109.476 . . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' C' C ' 320' ' ' LYS . . . . . 0.431 ' HB2' ' O ' ' C' ' 319' ' ' LYS . 0.0 OUTLIER 63.93 62.74 0.86 Allowed 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.222 -0.924 . . . . 6.84 109.524 179.969 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' C' C ' 321' ' ' LYS . . . . . 0.531 ' CB ' ' HD3' ' C' ' 322' ' ' PRO . 0.0 OUTLIER -80.7 -54.25 0.79 Allowed Pre-proline 0 N--CA 1.49 1.573 0 O-C-N 121.341 -0.85 . . . . 6.78 110.542 -179.649 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' C' C ' 322' ' ' PRO . . . . . 0.531 ' HD3' ' CB ' ' C' ' 321' ' ' LYS . 5.0 Cg_exo -60.7 159.58 27.95 Favored 'Trans proline' 0 C--N 1.31 -1.459 0 C-N-CA 121.835 1.69 . . . . 3.98 110.452 -179.374 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' C' C ' 323' ' ' LEU . . . . . . . . . . . . . 78.9 mt -78.53 151.38 32.54 Favored 'General case' 0 N--CA 1.489 1.499 0 O-C-N 121.247 -0.908 . . . . 4.31 109.139 -179.949 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C ' 324' ' ' ASP . . . . . 0.464 ' HB2' ' OH ' ' C' ' 327' ' ' TYR . 2.5 m-20 -77.8 177.07 8.47 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.22 -0.925 . . . . 1.63 109.744 -179.563 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' C' C ' 325' ' ' GLY . . . . . 0.407 ' O ' ' O ' ' C' ' 326' ' ' GLU . . . -68.62 -169.58 5.68 Favored Glycine 0 N--CA 1.49 2.259 0 N-CA-C 109.761 -1.336 . . . . 0.82 109.761 -179.796 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' C' C ' 326' ' ' GLU . . . . . 0.522 ' O ' ' CD1' ' C' ' 327' ' ' TYR . 5.2 mt-10 -57.96 -163.85 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.285 -1.127 . . . . 2.17 109.428 179.998 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' C' C ' 327' ' ' TYR . . . . . 0.522 ' CD1' ' O ' ' C' ' 326' ' ' GLU . 40.3 m-85 -149.77 109.11 3.96 Favored 'General case' 0 N--CA 1.489 1.494 0 O-C-N 121.149 -0.97 . . . . 1.03 109.723 -179.973 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' C' C ' 328' ' ' PHE . . . . . 0.45 ' CE2' ' HA ' ' A' ' 335' ' ' ARG . 83.7 m-85 -113.89 -167.04 1.15 Allowed 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.401 -0.812 . . . . 0.37 109.137 179.81 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' C' C ' 329' ' ' THR . . . . . 0.432 HG21 ' O ' ' C' ' 328' ' ' PHE . 22.4 p -153.73 179.19 9.08 Favored 'General case' 0 N--CA 1.489 1.487 0 O-C-N 121.124 -0.985 . . . . 1.04 109.494 179.988 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' C' C ' 330' ' ' LEU . . . . . 0.412 ' O ' ' HA ' ' A' ' 329' ' ' THR . 54.1 tp -152.99 131.61 12.27 Favored 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.243 -0.911 . . . . 1.09 109.761 -179.802 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' C' C ' 331' ' ' GLN . . . . . 0.442 ' NE2' ' O ' ' A' ' 328' ' ' PHE . 0.0 OUTLIER -88.52 102.35 14.83 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.268 -0.895 . . . . 1.48 108.838 179.818 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' C' C ' 332' ' ' ILE . . . . . . . . . . . . . 53.6 mt -104.01 112.04 36.01 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.704 0 O-C-N 121.118 -0.988 . . . . 1.08 110.204 -179.606 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C ' 333' ' ' ARG . . . . . 0.579 ' HG2' ' CE2' ' A' ' 327' ' ' TYR . 1.4 mpp_? -75.18 163.94 27.01 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.294 -0.879 . . . . 3.36 109.656 179.407 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' C' C ' 334' ' ' GLY . . . . . . . . . . . . . . . 72.55 130.3 0.12 Allowed Glycine 0 N--CA 1.493 2.476 0 N-CA-C 110.344 -1.102 . . . . 0.35 110.344 179.172 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C ' 335' ' ' ARG . . . . . 0.472 ' O ' ' HB3' ' C' ' 338' ' ' PHE . 3.9 ttp180 -80.67 -37.98 29.88 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.401 -1.058 . . . . 3.23 109.414 179.684 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' C' C ' 336' ' ' GLU . . . . . . . . . . . . . 4.0 mt-10 -58.36 -60.98 2.94 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.218 -0.927 . . . . 2.62 109.676 -179.738 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C ' 337' ' ' ARG . . . . . 0.434 ' NH1' ' CG ' ' C' ' 337' ' ' ARG . 0.0 OUTLIER -59.47 -29.24 67.68 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.208 -0.932 . . . . 3.61 109.463 -179.789 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' C' C ' 338' ' ' PHE . . . . . 0.472 ' HB3' ' O ' ' C' ' 335' ' ' ARG . 47.6 t80 -54.87 -55.55 29.2 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.228 -0.92 . . . . 0.43 109.245 179.825 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' C' C ' 339' ' ' GLU . . . . . . . . . . . . . 85.4 mt-10 -50.84 -29.17 11.08 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.297 -0.877 . . . . 2.05 109.672 -179.985 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C ' 340' ' ' MET . . . . . . . . . . . . . 14.9 ttp -63.4 -53.83 46.29 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.132 -0.98 . . . . 1.1 109.64 -179.766 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C ' 341' ' ' PHE . . . . . . . . . . . . . 38.8 m-85 -62.76 -46.1 89.61 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.211 -0.931 . . . . 0.21 109.729 -179.783 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C ' 342' ' ' ARG . . . . . 0.441 ' CG ' ' NH1' ' C' ' 342' ' ' ARG . 0.0 OUTLIER -49.72 -42.45 46.01 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.215 -0.928 . . . . 3.42 109.621 -179.89 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' C' C ' 343' ' ' GLU . . . . . . . . . . . . . 23.1 tt0 -57.89 -47.26 83.32 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.134 -0.978 . . . . 2.14 109.298 -179.966 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C ' 344' ' ' LEU . . . . . 0.474 HD21 ' CD2' ' D' ' 344' ' ' LEU . 76.3 mt -62.61 -29.07 70.33 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.211 -0.93 . . . . 1.09 109.232 179.704 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' C' C ' 345' ' ' ASN . . . . . . . . . . . . . 13.1 t-20 -58.84 -58.33 9.1 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.491 -0.756 . . . . 1.38 109.837 179.998 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C ' 346' ' ' GLU . . . . . . . . . . . . . 6.6 tm-20 -60.8 -25.86 66.87 Favored 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.322 -0.861 . . . . 2.21 109.785 -179.644 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C ' 347' ' ' ALA . . . . . . . . . . . . . . . -63.84 -58.2 7.53 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.137 -0.977 . . . . 1.03 110.028 -179.945 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C ' 348' ' ' LEU . . . . . 0.46 HD21 ' O ' ' C' ' 344' ' ' LEU . 3.9 mm? -62.6 -49.61 74.54 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.202 -0.936 . . . . 1.06 110.582 -179.355 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' C' C ' 349' ' ' GLU . . . . . . . . . . . . . 54.3 mt-10 -56.97 -39.05 73.88 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.187 -0.946 . . . . 2.19 110.301 -179.096 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C ' 350' ' ' LEU . . . . . 0.528 ' CD2' ' CD1' ' D' ' 350' ' ' LEU . 7.1 tt -64.57 -30.42 71.44 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.046 -1.033 . . . . 1.2 109.653 -179.761 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' C' C ' 351' ' ' LYS . . . . . . . . . . . . . 10.2 tttt -59.34 -48.88 79.94 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.308 -0.87 . . . . 1.92 109.414 -179.854 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C ' 352' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -60.03 -47.06 87.41 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.331 -0.856 . . . . 1.19 109.588 179.867 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C ' 353' ' ' ALA . . . . . . . . . . . . . . . -66.41 -10.51 44.41 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.224 -0.922 . . . . 1.15 109.461 -179.787 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C ' 354' ' ' GLN . . . . . . . . . . . . . 4.9 tt0 -81.37 -65.77 0.97 Allowed 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.355 -0.841 . . . . 1.7 109.247 179.756 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C ' 355' ' ' ALA . . . . . . . . . . . . . . . -69.42 -8.87 50.54 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.254 -0.904 . . . . 1.3 109.293 179.895 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C ' 356' ' ' GLY . . . . . . . . . . . . . . . -80.48 4.37 68.75 Favored Glycine 0 N--CA 1.49 2.298 0 N-CA-C 109.55 -1.42 . . . . 1.33 109.55 179.76 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C ' 357' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -85.16 138.74 32.18 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.245 -1.15 . . . . 4.39 109.464 -179.717 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' C' C ' 358' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -49.87 140.57 15.36 Favored Pre-proline 0 N--CA 1.49 1.526 0 O-C-N 121.223 -0.923 . . . . 5.75 109.466 -179.814 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' C' C ' 359' ' ' PRO . . . . . . . . . . . . . 2.4 Cg_endo -62.42 100.67 0.23 Allowed 'Trans proline' 0 C--N 1.31 -1.473 0 C-N-CA 122.046 1.83 . . . . 5.54 110.001 179.88 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C ' 360' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.213 0 N-CA-C 109.559 -1.416 . . . . 6.5 109.559 -179.99 . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' D' D ' 319' ' ' LYS . . . . . 0.415 ' O ' ' O ' ' D' ' 320' ' ' LYS . 0.8 OUTLIER . . . . . 0 N--CA 1.489 1.519 0 N-CA-C 109.487 -0.56 . . . . 7.93 109.487 . . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' D' D ' 320' ' ' LYS . . . . . 0.415 ' O ' ' O ' ' D' ' 319' ' ' LYS . 0.1 OUTLIER 63.22 135.97 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.27 -0.894 . . . . 6.7 109.396 -179.907 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' D' D ' 321' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -158.06 79.53 3.23 Favored Pre-proline 0 N--CA 1.488 1.47 0 O-C-N 121.267 -0.896 . . . . 6.49 109.52 -179.994 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' D' D ' 322' ' ' PRO . . . . . . . . . . . . . 3.2 Cg_exo -60.41 157.26 36.88 Favored 'Trans proline' 0 C--N 1.31 -1.468 0 C-N-CA 122.22 1.947 . . . . 3.29 110.185 -179.893 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' D' D ' 323' ' ' LEU . . . . . . . . . . . . . 43.6 mt -80.66 113.86 19.15 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.306 -0.871 . . . . 3.16 109.657 -179.845 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' D' D ' 324' ' ' ASP . . . . . 0.413 ' HB2' ' OH ' ' D' ' 327' ' ' TYR . 26.7 m-20 -80.89 -156.58 0.14 Allowed 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.299 -0.876 . . . . 1.54 109.543 179.819 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' D' D ' 325' ' ' GLY . . . . . . . . . . . . . . . -68.75 -173.36 8.35 Favored Glycine 0 N--CA 1.491 2.315 0 N-CA-C 109.669 -1.372 . . . . 0.65 109.669 -179.969 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' D' D ' 326' ' ' GLU . . . . . 0.401 ' O ' ' CD1' ' D' ' 327' ' ' TYR . 4.3 mm-40 -59.23 -174.09 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.29 -1.124 . . . . 2.13 109.451 179.924 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' D' D ' 327' ' ' TYR . . . . . 0.547 ' CE2' ' HG2' ' B' ' 333' ' ' ARG . 43.7 m-85 -149.61 106.04 3.51 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.268 -0.895 . . . . 1.0 109.534 179.824 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' D' D ' 328' ' ' PHE . . . . . 0.433 ' CE1' ' HA ' ' B' ' 335' ' ' ARG . 23.4 m-85 -111.87 -167.5 1.19 Allowed 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.339 -0.85 . . . . 0.34 109.007 179.683 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' D' D ' 329' ' ' THR . . . . . . . . . . . . . 75.5 p -153.59 -179.76 8.08 Favored 'General case' 0 N--CA 1.488 1.452 0 O-C-N 121.158 -0.964 . . . . 1.05 109.424 179.925 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' D' D ' 330' ' ' LEU . . . . . . . . . . . . . 52.2 tp -152.75 131.91 12.71 Favored 'General case' 0 N--CA 1.488 1.467 0 O-C-N 121.205 -0.934 . . . . 1.07 109.532 -179.877 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' D' D ' 331' ' ' GLN . . . . . . . . . . . . . 44.6 tp60 -88.13 106.55 18.25 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.274 -0.891 . . . . 0.93 109.521 179.922 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' D' D ' 332' ' ' ILE . . . . . 0.437 HG23 ' HA ' ' D' ' 338' ' ' PHE . 31.9 mt -103.41 103.37 15.04 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.545 0 O-C-N 121.168 -0.957 . . . . 1.07 109.519 179.919 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' D' D ' 333' ' ' ARG . . . . . 0.555 ' HG2' ' NH1' ' D' ' 333' ' ' ARG . 0.0 OUTLIER -72.66 151.45 42.25 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.249 -0.907 . . . . 3.42 109.398 179.861 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' D' D ' 334' ' ' GLY . . . . . . . . . . . . . . . 86.56 128.87 2.46 Favored Glycine 0 N--CA 1.49 2.235 0 N-CA-C 109.595 -1.402 . . . . 0.41 109.595 -179.978 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' D' D ' 335' ' ' ARG . . . . . 0.482 ' HA ' ' CE1' ' B' ' 328' ' ' PHE . 3.4 ttm180 -79.54 -39.18 32.51 Favored 'General case' 0 N--CA 1.489 1.487 0 O-C-N 121.202 -1.175 . . . . 3.58 109.524 -179.975 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' D' D ' 336' ' ' GLU . . . . . . . . . . . . . 2.2 mt-10 -57.98 -61.4 2.57 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.252 -0.905 . . . . 2.26 109.731 -179.89 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' D' D ' 337' ' ' ARG . . . . . 0.44 HH11 ' CG ' ' D' ' 337' ' ' ARG . 0.0 OUTLIER -59.85 -29.35 68.23 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.18 -0.95 . . . . 3.64 109.504 -179.84 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' D' D ' 338' ' ' PHE . . . . . 0.437 ' HA ' HG23 ' D' ' 332' ' ' ILE . 48.2 t80 -55.53 -56.2 23.04 Favored 'General case' 0 N--CA 1.488 1.474 0 O-C-N 121.219 -0.926 . . . . 0.4 109.483 179.886 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' D' D ' 339' ' ' GLU . . . . . . . . . . . . . 24.1 mt-10 -50.09 -33.49 18.76 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.23 -0.919 . . . . 1.99 110.03 -179.716 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' D' D ' 340' ' ' MET . . . . . . . . . . . . . 32.2 ttp -63.13 -51.11 67.78 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.2 -0.938 . . . . 1.13 109.814 -179.674 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' D' D ' 341' ' ' PHE . . . . . . . . . . . . . 39.3 m-85 -62.46 -51.99 65.28 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.146 -0.971 . . . . 0.21 109.757 -179.741 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' D' D ' 342' ' ' ARG . . . . . . . . . . . . . 9.7 ttm180 -47.69 -36.76 11.69 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.156 -0.965 . . . . 3.15 109.483 -179.926 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' D' D ' 343' ' ' GLU . . . . . . . . . . . . . 32.7 tt0 -58.91 -49.64 77.03 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.278 -0.889 . . . . 2.35 109.504 179.935 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' D' D ' 344' ' ' LEU . . . . . 0.474 ' CD2' HD21 ' C' ' 344' ' ' LEU . 57.5 mt -62.47 -32.37 73.25 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.177 -0.952 . . . . 1.06 109.453 -179.996 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' D' D ' 345' ' ' ASN . . . . . . . . . . . . . 9.6 t-20 -56.77 -54.93 40.6 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.266 -0.896 . . . . 1.35 109.63 -179.858 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' D' D ' 346' ' ' GLU . . . . . . . . . . . . . 44.0 tp10 -61.4 -31.61 71.53 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.258 -0.902 . . . . 1.69 109.755 -179.746 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' D' D ' 347' ' ' ALA . . . . . . . . . . . . . . . -59.93 -57.82 11.21 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.236 -0.915 . . . . 1.03 109.988 -179.709 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' D' D ' 348' ' ' LEU . . . . . 0.478 ' CD2' ' N ' ' D' ' 348' ' ' LEU . 4.2 mm? -61.53 -42.0 98.18 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.219 -0.926 . . . . 1.04 109.885 -179.664 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' D' D ' 349' ' ' GLU . . . . . . . . . . . . . 98.5 mt-10 -57.9 -35.12 70.59 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.245 -0.91 . . . . 1.95 109.943 -179.541 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' D' D ' 350' ' ' LEU . . . . . 0.528 ' CD1' ' CD2' ' C' ' 350' ' ' LEU . 5.7 tt -63.39 -46.37 86.73 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.125 -0.985 . . . . 1.16 109.603 -179.814 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' D' D ' 351' ' ' LYS . . . . . . . . . . . . . 42.4 tttt -59.48 -37.87 79.36 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.253 -0.904 . . . . 1.97 109.475 -179.996 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' D' D ' 352' ' ' ASP . . . . . 0.414 ' O ' ' HB1' ' D' ' 355' ' ' ALA . 22.9 m-20 -55.76 -36.15 66.99 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.258 -0.901 . . . . 1.17 109.635 179.975 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' D' D ' 353' ' ' ALA . . . . . . . . . . . . . . . -66.95 -35.83 80.85 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.239 -0.913 . . . . 1.21 109.738 -179.739 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' D' D ' 354' ' ' GLN . . . . . . . . . . . . . 5.8 mt-30 -81.28 -3.88 53.85 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.229 -0.919 . . . . 1.68 109.595 -179.829 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' D' D ' 355' ' ' ALA . . . . . 0.414 ' HB1' ' O ' ' D' ' 352' ' ' ASP . . . -70.97 -82.52 0.04 OUTLIER 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.239 -0.913 . . . . 1.29 109.579 179.926 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' D' D ' 356' ' ' GLY . . . . . . . . . . . . . . . -59.37 93.54 0.05 OUTLIER Glycine 0 N--CA 1.49 2.295 0 N-CA-C 109.651 -1.379 . . . . 1.28 109.651 -179.873 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' D' D ' 357' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -86.71 134.03 33.62 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.341 -1.093 . . . . 4.45 109.377 179.796 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' D' D ' 358' ' ' GLU . . . . . . . . . . . . . 18.9 tt0 -49.35 133.38 17.54 Favored Pre-proline 0 N--CA 1.491 1.597 0 O-C-N 121.231 -0.918 . . . . 5.71 109.457 -179.871 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' D' D ' 359' ' ' PRO . . . . . . . . . . . . . 2.2 Cg_endo -62.67 167.61 11.43 Favored 'Trans proline' 0 C--N 1.311 -1.421 0 C-N-CA 122.075 1.85 . . . . 5.6 110.168 -179.994 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' D' D ' 360' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.326 0 N-CA-C 109.483 -1.447 . . . . 6.97 109.483 179.921 . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 319' ' ' LYS . . . . . . . . . . . . . 22.2 mttt . . . . . 0 N--CA 1.49 1.547 0 N-CA-C 109.596 -0.52 . . . . 7.95 109.596 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 320' ' ' LYS . . . . . . . . . . . . . 4.4 tttm 53.23 50.93 16.57 Favored 'General case' 0 N--CA 1.489 1.525 0 O-C-N 121.241 -0.912 . . . . 6.71 109.087 -179.997 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 321' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -157.47 84.6 2.84 Favored Pre-proline 0 N--CA 1.491 1.585 0 O-C-N 121.381 -0.824 . . . . 6.5 109.492 -179.786 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 322' ' ' PRO . . . . . . . . . . . . . 1.8 Cg_endo -68.68 -1.43 7.55 Favored 'Trans proline' 0 C--N 1.311 -1.43 0 C-N-CA 122.319 2.013 . . . . 3.3 110.567 179.722 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 323' ' ' LEU . . . . . . . . . . . . . 23.4 mt -84.16 47.6 1.35 Allowed 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.153 -0.967 . . . . 3.16 109.475 179.854 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 324' ' ' ASP . . . . . . . . . . . . . 49.4 m-20 -77.82 -175.76 4.1 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.261 -0.899 . . . . 1.53 109.349 -179.94 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 325' ' ' GLY . . . . . . . . . . . . . . . -68.61 -178.75 17.55 Favored Glycine 0 N--CA 1.489 2.172 0 N-CA-C 109.418 -1.473 . . . . 0.67 109.418 179.919 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 326' ' ' GLU . . . . . . . . . . . . . 20.8 mt-10 -58.46 -172.43 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.128 -1.219 . . . . 2.13 109.354 179.925 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 327' ' ' TYR . . . . . 0.574 ' CE1' ' HG2' ' C' ' 333' ' ' ARG . 48.0 m-85 -148.54 111.36 4.81 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.303 -0.873 . . . . 1.0 109.338 179.978 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 328' ' ' PHE . . . . . . . . . . . . . 94.5 m-85 -113.3 -169.88 1.58 Allowed 'General case' 0 N--CA 1.488 1.467 0 O-C-N 121.114 -0.991 . . . . 0.34 109.466 -179.706 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 329' ' ' THR . . . . . 0.491 ' HA ' ' O ' ' C' ' 330' ' ' LEU . 29.4 p -152.16 166.31 32.1 Favored 'General case' 0 C--N 1.303 -1.424 0 O-C-N 121.298 -0.876 . . . . 1.05 109.022 179.879 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 330' ' ' LEU . . . . . . . . . . . . . 49.2 tp -149.71 128.32 12.35 Favored 'General case' 0 C--N 1.303 -1.444 0 O-C-N 121.107 -0.996 . . . . 1.07 109.972 -179.396 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 331' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -86.74 109.92 19.55 Favored 'General case' 0 N--CA 1.488 1.471 0 O-C-N 121.321 -0.862 . . . . 0.91 109.184 179.681 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 332' ' ' ILE . . . . . . . . . . . . . 10.6 mt -103.65 108.44 24.54 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.536 0 O-C-N 121.203 -0.936 . . . . 1.09 109.766 -179.716 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 333' ' ' ARG . . . . . 0.521 ' NH1' ' HG3' ' A' ' 333' ' ' ARG . 37.8 mtm-85 -71.95 151.86 42.95 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.192 -0.942 . . . . 3.41 109.337 179.804 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 334' ' ' GLY . . . . . . . . . . . . . . . 79.8 129.85 0.77 Allowed Glycine 0 N--CA 1.491 2.335 0 N-CA-C 109.703 -1.359 . . . . 0.4 109.703 179.746 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 335' ' ' ARG . . . . . . . . . . . . . 9.6 ttm180 -79.92 -37.47 34.54 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.275 -1.132 . . . . 3.55 109.579 179.919 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 336' ' ' GLU . . . . . . . . . . . . . 4.2 mm-40 -57.15 -63.48 1.2 Allowed 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.325 -0.859 . . . . 2.29 109.807 -179.744 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 337' ' ' ARG . . . . . 0.408 HH11 ' HG2' ' A' ' 337' ' ' ARG . 5.0 mmt-85 -60.39 -30.44 69.59 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.266 -0.896 . . . . 3.64 109.788 -179.737 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 338' ' ' PHE . . . . . . . . . . . . . 25.8 t80 -55.26 -56.89 14.82 Favored 'General case' 0 N--CA 1.489 1.487 0 O-C-N 121.063 -1.023 . . . . 0.41 109.122 179.716 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 339' ' ' GLU . . . . . . . . . . . . . 32.1 mt-10 -51.32 -30.6 18.82 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.428 -0.795 . . . . 1.97 109.574 -179.755 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 340' ' ' MET . . . . . . . . . . . . . 41.5 ttp -63.66 -50.57 68.74 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.286 -0.884 . . . . 1.14 109.593 -179.834 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 341' ' ' PHE . . . . . 0.407 ' CZ ' ' HA ' ' C' ' 345' ' ' ASN . 75.7 m-85 -62.74 -46.49 87.81 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.205 -0.934 . . . . 0.21 109.718 -179.873 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 342' ' ' ARG . . . . . 0.433 HH11 ' HG3' ' A' ' 342' ' ' ARG . 0.3 OUTLIER -49.03 -42.69 39.11 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.257 -0.902 . . . . 3.15 109.987 -179.578 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 343' ' ' GLU . . . . . . . . . . . . . 25.1 tt0 -59.82 -44.62 93.94 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.38 -0.825 . . . . 2.35 109.846 -179.72 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 344' ' ' LEU . . . . . 0.412 ' O ' HD21 ' A' ' 348' ' ' LEU . 41.1 mt -62.49 -36.01 81.17 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.1 -1.0 . . . . 1.06 109.933 -179.661 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 345' ' ' ASN . . . . . . . . . . . . . 63.8 t-20 -57.41 -54.66 44.34 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.298 -0.876 . . . . 1.36 109.906 -179.626 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 346' ' ' GLU . . . . . . . . . . . . . 83.5 tt0 -60.92 -30.33 70.13 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.139 -0.976 . . . . 1.65 109.946 -179.59 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 347' ' ' ALA . . . . . . . . . . . . . . . -60.58 -56.34 22.5 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.176 -0.953 . . . . 1.03 110.014 -179.616 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 348' ' ' LEU . . . . . 0.462 ' N ' HD23 ' A' ' 348' ' ' LEU . 3.9 mm? -61.33 -48.93 79.08 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.16 -0.962 . . . . 1.04 110.073 -179.398 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 349' ' ' GLU . . . . . . . . . . . . . 80.6 mm-40 -57.13 -30.27 64.26 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.24 -0.912 . . . . 1.94 110.127 -179.453 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 350' ' ' LEU . . . . . 0.471 HD23 HD23 ' B' ' 350' ' ' LEU . 4.2 tt -64.28 -48.0 77.38 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.127 -0.983 . . . . 1.17 109.419 -179.984 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 351' ' ' LYS . . . . . . . . . . . . . 68.0 tttt -59.17 -48.83 80.15 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.277 -0.889 . . . . 1.97 109.538 -179.964 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 352' ' ' ASP . . . . . . . . . . . . . 3.4 m-20 -54.82 -29.36 54.62 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.251 -0.905 . . . . 1.16 109.478 -179.995 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 353' ' ' ALA . . . . . 0.416 ' O ' ' HB2' ' A' ' 357' ' ' LYS . . . -67.2 -37.98 84.56 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.276 -0.89 . . . . 1.22 109.512 179.945 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 354' ' ' GLN . . . . . . . . . . . . . 26.0 mt-30 -80.92 -2.42 47.53 Favored 'General case' 0 N--CA 1.488 1.461 0 O-C-N 121.252 -0.905 . . . . 1.71 109.475 -179.999 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 355' ' ' ALA . . . . . . . . . . . . . . . -71.93 -71.65 0.27 Allowed 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.251 -0.906 . . . . 1.3 109.794 179.873 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 356' ' ' GLY . . . . . . . . . . . . . . . -73.54 0.9 47.08 Favored Glycine 0 N--CA 1.491 2.306 0 N-CA-C 110.315 -1.114 . . . . 1.3 110.315 -179.513 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 357' ' ' LYS . . . . . 0.416 ' HB2' ' O ' ' A' ' 353' ' ' ALA . 4.9 tptp -86.03 12.09 10.25 Favored 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.067 -1.255 . . . . 4.46 109.558 -180.0 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 358' ' ' GLU . . . . . . . . . . . . . 23.6 mt-10 -49.86 149.17 4.87 Favored Pre-proline 0 N--CA 1.491 1.597 0 O-C-N 121.2 -0.938 . . . . 5.75 109.366 179.936 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 359' ' ' PRO . . . . . . . . . . . . . 1.2 Cg_endo -68.1 -5.01 13.68 Favored 'Trans proline' 0 C--N 1.309 -1.51 0 C-N-CA 122.202 1.934 . . . . 5.63 110.292 -179.868 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 360' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.286 0 CA-C-O 118.027 -1.43 . . . . 6.97 109.597 -179.903 . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' B' B ' 319' ' ' LYS . . . . . . . . . . . . . 21.6 mttt . . . . . 0 N--CA 1.49 1.546 0 CA-C-O 121.251 0.548 . . . . 7.95 109.532 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' B' B ' 320' ' ' LYS . . . . . . . . . . . . . 4.6 tttm 53.73 49.86 18.32 Favored 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.216 -0.927 . . . . 6.73 109.265 179.954 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 321' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -156.3 85.02 3.17 Favored Pre-proline 0 N--CA 1.489 1.522 0 O-C-N 121.28 -0.887 . . . . 6.5 109.531 -179.748 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 322' ' ' PRO . . . . . . . . . . . . . 1.9 Cg_endo -68.55 -1.04 6.75 Favored 'Trans proline' 0 C--N 1.311 -1.397 0 C-N-CA 122.29 1.993 . . . . 3.29 110.695 179.879 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 323' ' ' LEU . . . . . . . . . . . . . 23.1 mt -84.35 47.14 1.3 Allowed 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.082 -1.011 . . . . 3.18 109.428 -179.931 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 324' ' ' ASP . . . . . . . . . . . . . 47.2 m-20 -77.93 -176.67 4.59 Favored 'General case' 0 N--CA 1.489 1.493 0 O-C-N 121.317 -0.864 . . . . 1.53 109.461 -179.807 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 325' ' ' GLY . . . . . . . . . . . . . . . -67.56 -179.27 13.86 Favored Glycine 0 N--CA 1.489 2.185 0 N-CA-C 109.417 -1.473 . . . . 0.65 109.417 179.935 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 326' ' ' GLU . . . . . . . . . . . . . 20.0 mt-10 -58.33 -172.47 0.01 OUTLIER 'General case' 0 N--CA 1.488 1.475 0 O-C-N 121.174 -1.192 . . . . 2.13 109.449 179.836 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 327' ' ' TYR . . . . . 0.474 ' CE1' ' HG2' ' D' ' 333' ' ' ARG . 48.7 m-85 -148.86 112.04 4.93 Favored 'General case' 0 N--CA 1.488 1.454 0 O-C-N 121.286 -0.884 . . . . 0.99 109.322 179.891 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 328' ' ' PHE . . . . . 0.414 ' CE1' ' HB2' ' D' ' 335' ' ' ARG . 94.0 m-85 -113.5 -169.45 1.5 Allowed 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.246 -0.908 . . . . 0.36 109.514 -179.865 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 329' ' ' THR . . . . . . . . . . . . . 29.6 p -152.64 166.46 32.04 Favored 'General case' 0 N--CA 1.487 1.42 0 O-C-N 121.274 -0.891 . . . . 1.05 109.055 179.771 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 330' ' ' LEU . . . . . 0.402 ' O ' ' HA ' ' D' ' 329' ' ' THR . 49.3 tp -149.87 128.85 12.61 Favored 'General case' 0 C--N 1.302 -1.473 0 O-C-N 121.033 -1.042 . . . . 1.07 109.812 -179.46 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 331' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -87.3 109.69 19.69 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.398 -0.813 . . . . 0.91 109.184 179.773 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 332' ' ' ILE . . . . . . . . . . . . . 10.3 mt -103.61 108.67 25.03 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.499 0 O-C-N 121.16 -0.962 . . . . 1.08 109.778 -179.686 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 333' ' ' ARG . . . . . 0.509 ' NH1' ' HG3' ' B' ' 333' ' ' ARG . 39.3 mtm-85 -71.93 152.24 42.69 Favored 'General case' 0 N--CA 1.488 1.455 0 O-C-N 121.312 -0.868 . . . . 3.42 109.387 179.73 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 334' ' ' GLY . . . . . . . . . . . . . . . 78.46 129.83 0.57 Allowed Glycine 0 N--CA 1.49 2.236 0 N-CA-C 109.719 -1.352 . . . . 0.4 109.719 179.811 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 335' ' ' ARG . . . . . . . . . . . . . 9.6 ttm180 -79.77 -37.99 34.15 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.29 -1.123 . . . . 3.55 109.65 -179.938 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 336' ' ' GLU . . . . . . . . . . . . . 4.5 mm-40 -56.21 -63.68 1.11 Allowed 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.232 -0.917 . . . . 2.28 109.783 -179.8 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 337' ' ' ARG . . . . . 0.42 HH11 ' HG2' ' B' ' 337' ' ' ARG . 4.7 mmt-85 -60.53 -30.44 69.74 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.282 -0.886 . . . . 3.64 109.608 -179.634 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 338' ' ' PHE . . . . . . . . . . . . . 25.6 t80 -55.09 -57.49 11.51 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.185 -0.947 . . . . 0.39 109.015 179.599 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 339' ' ' GLU . . . . . . . . . . . . . 31.5 mt-10 -50.76 -30.78 14.92 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.313 -0.867 . . . . 1.98 109.695 -179.82 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 340' ' ' MET . . . . . . . . . . . . . 41.5 ttp -63.54 -50.94 67.57 Favored 'General case' 0 N--CA 1.488 1.468 0 O-C-N 121.325 -0.859 . . . . 1.14 109.58 -179.93 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 341' ' ' PHE . . . . . . . . . . . . . 76.6 m-85 -62.35 -46.78 87.11 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.086 -1.009 . . . . 0.22 109.685 -179.905 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 342' ' ' ARG . . . . . 0.435 ' HG3' HH11 ' B' ' 342' ' ' ARG . 0.2 OUTLIER -48.41 -43.37 34.07 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.294 -0.878 . . . . 3.15 109.795 -179.612 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' B' B ' 343' ' ' GLU . . . . . . . . . . . . . 26.0 tt0 -59.42 -44.79 92.81 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.298 -0.876 . . . . 2.35 109.895 -179.569 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 344' ' ' LEU . . . . . 0.416 ' O ' HD21 ' B' ' 348' ' ' LEU . 41.2 mt -62.17 -36.47 81.97 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.197 -0.939 . . . . 1.05 109.889 -179.618 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 345' ' ' ASN . . . . . 0.416 ' HA ' ' CZ ' ' D' ' 341' ' ' PHE . 62.7 t-20 -57.05 -54.86 41.98 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.203 -0.935 . . . . 1.35 109.982 -179.669 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 346' ' ' GLU . . . . . . . . . . . . . 83.7 tt0 -61.06 -30.49 70.36 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.14 -0.975 . . . . 1.66 109.842 -179.472 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 347' ' ' ALA . . . . . . . . . . . . . . . -60.31 -56.29 23.35 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.2 -0.937 . . . . 1.02 110.116 -179.741 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 348' ' ' LEU . . . . . 0.467 ' N ' HD23 ' B' ' 348' ' ' LEU . 3.9 mm? -61.66 -48.4 81.02 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.087 -1.008 . . . . 1.05 110.06 -179.366 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 349' ' ' GLU . . . . . . . . . . . . . 80.8 mm-40 -57.32 -30.66 64.95 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.158 -0.964 . . . . 1.95 110.079 -179.351 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 350' ' ' LEU . . . . . 0.471 HD23 HD23 ' A' ' 350' ' ' LEU . 4.2 tt -63.95 -47.98 78.3 Favored 'General case' 0 C--N 1.302 -1.465 0 O-C-N 121.204 -0.935 . . . . 1.18 109.398 -179.909 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 351' ' ' LYS . . . . . . . . . . . . . 68.3 tttt -59.15 -48.35 81.92 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.331 -0.856 . . . . 1.96 109.566 -179.973 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 352' ' ' ASP . . . . . . . . . . . . . 3.2 m-20 -55.26 -29.68 58.58 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.243 -0.911 . . . . 1.16 109.371 179.988 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 353' ' ' ALA . . . . . 0.43 ' O ' ' HB2' ' B' ' 357' ' ' LYS . . . -66.74 -38.3 86.38 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.329 -0.857 . . . . 1.21 109.487 -179.967 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 354' ' ' GLN . . . . . . . . . . . . . 25.6 mt-30 -80.75 -1.97 45.02 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.236 -0.915 . . . . 1.69 109.467 179.863 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 355' ' ' ALA . . . . . . . . . . . . . . . -72.21 -71.36 0.29 Allowed 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.238 -0.914 . . . . 1.3 109.633 179.972 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 356' ' ' GLY . . . . . . . . . . . . . . . -73.7 1.04 47.49 Favored Glycine 0 N--CA 1.494 2.546 0 N-CA-C 110.201 -1.16 . . . . 1.29 110.201 -179.561 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 357' ' ' LYS . . . . . 0.43 ' HB2' ' O ' ' B' ' 353' ' ' ALA . 4.8 tptp -86.24 12.44 9.86 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 120.931 -1.334 . . . . 4.45 109.596 -179.984 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 358' ' ' GLU . . . . . . . . . . . . . 21.5 mt-10 -50.19 149.23 5.35 Favored Pre-proline 0 N--CA 1.489 1.52 0 O-C-N 121.127 -0.983 . . . . 5.72 109.423 179.888 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 359' ' ' PRO . . . . . . . . . . . . . 1.2 Cg_endo -68.08 -5.09 13.86 Favored 'Trans proline' 0 C--N 1.31 -1.5 0 C-N-CA 122.208 1.939 . . . . 5.6 110.35 179.918 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 360' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 2.37 0 CA-C-O 118.009 -1.44 . . . . 6.98 109.619 -179.973 . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' C' C ' 319' ' ' LYS . . . . . 0.473 ' O ' ' O ' ' C' ' 320' ' ' LYS . 14.2 ttpt . . . . . 0 N--CA 1.489 1.511 0 N-CA-C 109.372 -0.603 . . . . 7.03 109.372 . . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C ' 320' ' ' LYS . . . . . 0.515 ' O ' ' HD3' ' C' ' 322' ' ' PRO . 17.0 ttpp 59.71 120.91 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.364 -0.835 . . . . 6.84 109.371 179.943 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' C' C ' 321' ' ' LYS . . . . . . . . . . . . . 20.5 mtmt -83.61 112.4 39.47 Favored Pre-proline 0 N--CA 1.492 1.647 0 O-C-N 121.347 -0.846 . . . . 6.78 109.783 -179.855 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C ' 322' ' ' PRO . . . . . 0.515 ' HD3' ' O ' ' C' ' 320' ' ' LYS . 3.9 Cg_endo -70.22 170.79 16.3 Favored 'Trans proline' 0 C--N 1.312 -1.375 0 C-N-CA 121.95 1.767 . . . . 3.98 110.038 179.859 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' C' C ' 323' ' ' LEU . . . . . . . . . . . . . 35.7 mt -80.53 104.98 11.44 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.158 -0.963 . . . . 4.31 108.845 179.323 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C ' 324' ' ' ASP . . . . . 0.423 ' OD1' ' N ' ' C' ' 324' ' ' ASP . 0.7 OUTLIER -78.58 153.15 31.42 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.222 -0.924 . . . . 1.63 109.376 -179.546 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' C' C ' 325' ' ' GLY . . . . . . . . . . . . . . . -68.51 -177.16 12.81 Favored Glycine 0 N--CA 1.489 2.198 0 N-CA-C 109.525 -1.43 . . . . 0.82 109.525 -179.82 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C ' 326' ' ' GLU . . . . . . . . . . . . . 34.3 mt-10 -58.18 -175.87 0.02 OUTLIER 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.369 -1.077 . . . . 2.17 109.608 -179.782 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C ' 327' ' ' TYR . . . . . 0.516 ' CE1' ' HG2' ' A' ' 333' ' ' ARG . 39.1 m-85 -148.11 111.41 4.93 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.387 -0.82 . . . . 1.03 109.399 179.973 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' C' C ' 328' ' ' PHE . . . . . . . . . . . . . 97.8 m-85 -113.98 -168.16 1.31 Allowed 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.155 -0.966 . . . . 0.37 109.629 -179.978 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C ' 329' ' ' THR . . . . . . . . . . . . . 9.4 p -153.13 165.83 34.4 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.392 -0.818 . . . . 1.04 108.962 -179.99 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C ' 330' ' ' LEU . . . . . 0.491 ' O ' ' HA ' ' A' ' 329' ' ' THR . 16.3 tp -151.94 126.31 9.36 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.202 -0.936 . . . . 1.09 109.858 -179.521 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' C' C ' 331' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -85.89 118.65 25.51 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.298 -0.876 . . . . 1.48 109.044 179.433 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' C' C ' 332' ' ' ILE . . . . . . . . . . . . . 83.1 mt -103.45 109.86 28.24 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.508 0 O-C-N 121.163 -0.961 . . . . 1.08 110.111 -179.452 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C ' 333' ' ' ARG . . . . . 0.574 ' HG2' ' CE1' ' A' ' 327' ' ' TYR . 10.9 mtt180 -72.8 128.74 36.41 Favored 'General case' 0 N--CA 1.489 1.479 0 O-C-N 121.284 -0.885 . . . . 3.36 109.289 179.674 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' C' C ' 334' ' ' GLY . . . . . . . . . . . . . . . 101.46 131.56 7.43 Favored Glycine 0 N--CA 1.489 2.212 0 N-CA-C 109.426 -1.47 . . . . 0.35 109.426 -179.913 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C ' 335' ' ' ARG . . . . . 0.461 ' O ' ' HB3' ' C' ' 338' ' ' PHE . 12.1 ttt180 -80.42 -37.28 32.4 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.239 -1.154 . . . . 3.23 109.991 -179.653 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' C' C ' 336' ' ' GLU . . . . . . . . . . . . . 6.2 mm-40 -58.51 -57.15 14.22 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.052 -1.03 . . . . 2.62 109.943 -179.586 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C ' 337' ' ' ARG . . . . . . . . . . . . . 2.0 mtp180 -59.96 -24.61 64.55 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.235 -0.916 . . . . 3.61 109.629 -179.603 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C ' 338' ' ' PHE . . . . . 0.461 ' HB3' ' O ' ' C' ' 335' ' ' ARG . 85.3 t80 -54.95 -63.08 1.27 Allowed 'General case' 0 N--CA 1.489 1.489 0 O-C-N 121.289 -0.882 . . . . 0.43 109.387 -179.973 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' C' C ' 339' ' ' GLU . . . . . . . . . . . . . 42.5 mt-10 -50.03 -30.17 10.18 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.287 -0.883 . . . . 2.05 109.917 -179.68 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C ' 340' ' ' MET . . . . . . . . . . . . . 27.4 ttp -64.22 -55.95 18.04 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.169 -0.957 . . . . 1.1 110.051 -179.882 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C ' 341' ' ' PHE . . . . . . . . . . . . . 52.9 m-85 -62.32 -51.4 67.8 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.157 -0.965 . . . . 0.21 109.76 -179.51 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C ' 342' ' ' ARG . . . . . . . . . . . . . 2.7 ttp180 -45.49 -40.85 8.93 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.268 -0.895 . . . . 3.42 109.577 179.999 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C ' 343' ' ' GLU . . . . . . . . . . . . . 16.9 tt0 -60.5 -48.62 80.95 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.208 -0.932 . . . . 2.14 110.297 -179.637 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C ' 344' ' ' LEU . . . . . 0.519 HD23 ' CD2' ' D' ' 344' ' ' LEU . 37.5 mt -60.51 -42.43 96.4 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 120.937 -1.102 . . . . 1.09 109.852 -179.481 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' C' C ' 345' ' ' ASN . . . . . 0.407 ' HA ' ' CZ ' ' A' ' 341' ' ' PHE . 44.4 t-20 -56.03 -47.9 76.97 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.161 -0.962 . . . . 1.38 109.436 179.906 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' C' C ' 346' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -62.42 -37.31 85.36 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.173 -0.955 . . . . 2.21 109.785 -179.756 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' C' C ' 347' ' ' ALA . . . . . . . . . . . . . . . -59.04 -55.4 35.53 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.137 -0.977 . . . . 1.03 110.251 -179.664 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C ' 348' ' ' LEU . . . . . 0.509 HD23 ' N ' ' C' ' 348' ' ' LEU . 4.1 mm? -60.13 -38.62 83.61 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.109 -0.994 . . . . 1.06 109.548 -179.578 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' C' C ' 349' ' ' GLU . . . . . . . . . . . . . 89.3 mt-10 -59.0 -41.68 88.25 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.352 -0.842 . . . . 2.19 110.206 -179.481 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C ' 350' ' ' LEU . . . . . 0.537 HD23 ' CD1' ' D' ' 350' ' ' LEU . 6.6 tt -63.21 -40.77 98.43 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.216 -0.928 . . . . 1.2 110.022 -179.439 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' C' C ' 351' ' ' LYS . . . . . . . . . . . . . 2.8 tttm -59.38 -41.27 88.95 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.242 -0.911 . . . . 1.92 109.886 -179.602 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C ' 352' ' ' ASP . . . . . . . . . . . . . 3.1 m-20 -56.08 -41.11 74.62 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.171 -0.955 . . . . 1.19 110.064 -179.774 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C ' 353' ' ' ALA . . . . . . . . . . . . . . . -67.91 -25.37 65.45 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.219 -0.926 . . . . 1.15 109.578 -179.881 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C ' 354' ' ' GLN . . . . . 0.464 ' O ' ' CG ' ' C' ' 354' ' ' GLN . 7.1 tt0 -80.77 -2.3 46.46 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.348 -0.845 . . . . 1.7 109.582 179.995 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' C' C ' 355' ' ' ALA . . . . . . . . . . . . . . . -69.29 -81.0 0.04 OUTLIER 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.27 -0.893 . . . . 1.3 109.563 179.927 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C ' 356' ' ' GLY . . . . . . . . . . . . . . . -64.79 96.89 0.23 Allowed Glycine 0 N--CA 1.491 2.319 0 N-CA-C 109.998 -1.241 . . . . 1.33 109.998 -179.64 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C ' 357' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -89.7 131.43 35.68 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.319 -1.106 . . . . 4.39 109.617 179.713 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' C' C ' 358' ' ' GLU . . . . . . . . . . . . . 4.9 mt-10 -52.17 116.52 8.55 Favored Pre-proline 0 N--CA 1.492 1.661 0 O-C-N 121.279 -0.888 . . . . 5.75 109.919 179.874 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C ' 359' ' ' PRO . . . . . . . . . . . . . 2.2 Cg_endo -63.51 -153.32 0.02 OUTLIER 'Trans proline' 0 C--N 1.314 -1.286 0 C-N-CA 122.072 1.848 . . . . 5.54 110.218 179.704 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C ' 360' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.318 0 CA-C-O 118.009 -1.44 . . . . 6.5 109.584 179.904 . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' D' D ' 319' ' ' LYS . . . . . . . . . . . . . 21.1 mttt . . . . . 0 N--CA 1.49 1.568 0 CA-C-O 121.26 0.552 . . . . 7.93 109.562 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' D' D ' 320' ' ' LYS . . . . . . . . . . . . . 4.5 tttm 53.34 51.08 16.12 Favored 'General case' 0 N--CA 1.488 1.449 0 O-C-N 121.262 -0.899 . . . . 6.7 109.041 -179.969 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' D' D ' 321' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -157.24 85.21 2.85 Favored Pre-proline 0 N--CA 1.49 1.573 0 O-C-N 121.361 -0.837 . . . . 6.49 109.598 -179.848 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' D' D ' 322' ' ' PRO . . . . . . . . . . . . . 1.8 Cg_endo -68.73 -1.08 6.98 Favored 'Trans proline' 0 C--N 1.31 -1.448 0 C-N-CA 122.438 2.092 . . . . 3.29 110.598 179.923 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' D' D ' 323' ' ' LEU . . . . . . . . . . . . . 22.3 mt -84.15 46.73 1.23 Allowed 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.086 -1.009 . . . . 3.16 109.496 179.865 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' D' D ' 324' ' ' ASP . . . . . . . . . . . . . 45.2 m-20 -77.64 -176.23 4.23 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.2 -0.938 . . . . 1.54 109.515 -179.811 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' D' D ' 325' ' ' GLY . . . . . . . . . . . . . . . -68.21 -178.77 15.82 Favored Glycine 0 N--CA 1.491 2.306 0 N-CA-C 109.337 -1.505 . . . . 0.65 109.337 179.943 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' D' D ' 326' ' ' GLU . . . . . . . . . . . . . 19.7 mt-10 -58.76 -172.38 0.01 OUTLIER 'General case' 0 C--N 1.302 -1.489 0 O-C-N 121.263 -1.139 . . . . 2.13 109.566 -179.996 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' D' D ' 327' ' ' TYR . . . . . 0.46 ' CE1' ' HG2' ' B' ' 333' ' ' ARG . 49.9 m-85 -148.84 111.7 4.84 Favored 'General case' 0 N--CA 1.488 1.455 0 O-C-N 121.167 -0.958 . . . . 1.0 109.285 179.935 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' D' D ' 328' ' ' PHE . . . . . . . . . . . . . 94.4 m-85 -113.45 -169.5 1.51 Allowed 'General case' 0 N--CA 1.487 1.405 0 O-C-N 121.337 -0.852 . . . . 0.34 109.459 -179.859 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' D' D ' 329' ' ' THR . . . . . 0.402 ' HA ' ' O ' ' B' ' 330' ' ' LEU . 25.7 p -152.69 166.95 30.54 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.285 -0.885 . . . . 1.05 108.937 179.953 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' D' D ' 330' ' ' LEU . . . . . . . . . . . . . 49.2 tp -150.1 128.51 12.17 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.151 -0.968 . . . . 1.07 109.737 -179.441 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' D' D ' 331' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -86.95 109.74 19.56 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.231 -0.918 . . . . 0.93 109.134 179.632 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' D' D ' 332' ' ' ILE . . . . . . . . . . . . . 10.7 mt -103.62 108.55 24.76 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.539 0 O-C-N 121.201 -0.937 . . . . 1.07 109.765 -179.647 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' D' D ' 333' ' ' ARG . . . . . 0.511 ' NH1' ' HG3' ' D' ' 333' ' ' ARG . 39.0 mtm-85 -72.0 152.51 42.41 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.267 -0.895 . . . . 3.42 109.375 179.736 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' D' D ' 334' ' ' GLY . . . . . . . . . . . . . . . 78.41 129.73 0.56 Allowed Glycine 0 N--CA 1.492 2.405 0 N-CA-C 109.635 -1.386 . . . . 0.41 109.635 179.889 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' D' D ' 335' ' ' ARG . . . . . 0.414 ' HB2' ' CE1' ' B' ' 328' ' ' PHE . 9.6 ttm180 -80.1 -37.04 34.52 Favored 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.343 -1.092 . . . . 3.58 109.421 -179.937 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' D' D ' 336' ' ' GLU . . . . . . . . . . . . . 4.7 mm-40 -56.76 -63.88 1.06 Allowed 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.254 -0.904 . . . . 2.26 109.726 -179.788 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' D' D ' 337' ' ' ARG . . . . . 0.412 ' HG2' HH11 ' D' ' 337' ' ' ARG . 5.5 mmt-85 -60.34 -29.93 69.2 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.201 -0.937 . . . . 3.64 109.803 -179.557 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' D' D ' 338' ' ' PHE . . . . . . . . . . . . . 25.7 t80 -55.82 -57.52 11.72 Favored 'General case' 0 N--CA 1.489 1.492 0 O-C-N 121.242 -0.911 . . . . 0.4 108.909 179.745 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' D' D ' 339' ' ' GLU . . . . . . . . . . . . . 31.0 mt-10 -50.48 -30.93 13.93 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.25 -0.906 . . . . 1.99 109.665 -179.961 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' D' D ' 340' ' ' MET . . . . . . . . . . . . . 41.8 ttp -63.26 -50.96 68.13 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.2 -0.937 . . . . 1.13 109.696 -179.811 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' D' D ' 341' ' ' PHE . . . . . 0.416 ' CZ ' ' HA ' ' B' ' 345' ' ' ASN . 76.8 m-85 -62.35 -46.67 87.63 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.258 -0.901 . . . . 0.21 109.661 -179.887 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' D' D ' 342' ' ' ARG . . . . . 0.427 ' HG3' HH11 ' D' ' 342' ' ' ARG . 0.2 OUTLIER -48.43 -43.63 34.52 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.348 -0.845 . . . . 3.15 109.871 -179.611 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' D' D ' 343' ' ' GLU . . . . . . . . . . . . . 26.2 tt0 -59.24 -44.56 92.34 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.223 -0.923 . . . . 2.35 109.976 -179.595 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' D' D ' 344' ' ' LEU . . . . . 0.519 ' CD2' HD23 ' C' ' 344' ' ' LEU . 42.2 mt -62.41 -36.38 82.16 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.239 -0.913 . . . . 1.06 109.879 -179.654 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' D' D ' 345' ' ' ASN . . . . . . . . . . . . . 62.3 t-20 -57.53 -54.71 43.78 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.221 -0.925 . . . . 1.35 109.923 -179.614 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' D' D ' 346' ' ' GLU . . . . . . . . . . . . . 84.3 tt0 -61.1 -30.33 70.29 Favored 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.127 -0.983 . . . . 1.69 109.815 -179.605 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' D' D ' 347' ' ' ALA . . . . . . . . . . . . . . . -60.6 -56.22 23.93 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.117 -0.989 . . . . 1.03 110.056 -179.652 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' D' D ' 348' ' ' LEU . . . . . 0.469 ' N ' HD23 ' D' ' 348' ' ' LEU . 3.9 mm? -61.54 -48.73 79.69 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.235 -0.915 . . . . 1.04 109.979 -179.491 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' D' D ' 349' ' ' GLU . . . . . . . . . . . . . 80.8 mm-40 -57.2 -30.21 64.36 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.114 -0.991 . . . . 1.95 110.068 -179.317 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' D' D ' 350' ' ' LEU . . . . . 0.537 ' CD1' HD23 ' C' ' 350' ' ' LEU . 4.2 tt -64.09 -48.19 77.14 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.03 -1.044 . . . . 1.16 109.34 179.945 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' D' D ' 351' ' ' LYS . . . . . . . . . . . . . 68.5 tttt -58.95 -48.43 81.53 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.287 -0.883 . . . . 1.97 109.551 -179.899 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' D' D ' 352' ' ' ASP . . . . . . . . . . . . . 3.1 m-20 -55.15 -29.24 57.38 Favored 'General case' 0 N--CA 1.488 1.467 0 O-C-N 121.217 -0.927 . . . . 1.17 109.478 179.963 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' D' D ' 353' ' ' ALA . . . . . 0.426 ' O ' ' HB2' ' D' ' 357' ' ' LYS . . . -67.33 -38.23 84.57 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.271 -0.893 . . . . 1.21 109.47 179.968 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' D' D ' 354' ' ' GLN . . . . . 0.477 ' NE2' HD12 ' C' ' 350' ' ' LEU . 25.5 mt-30 -80.94 -1.84 45.25 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.222 -0.924 . . . . 1.68 109.453 179.995 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' D' D ' 355' ' ' ALA . . . . . . . . . . . . . . . -72.12 -71.58 0.27 Allowed 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.36 -0.838 . . . . 1.29 109.62 179.837 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' D' D ' 356' ' ' GLY . . . . . . . . . . . . . . . -73.9 1.91 44.5 Favored Glycine 0 N--CA 1.492 2.39 0 N-CA-C 110.173 -1.171 . . . . 1.28 110.173 -179.504 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' D' D ' 357' ' ' LYS . . . . . 0.426 ' HB2' ' O ' ' D' ' 353' ' ' ALA . 5.0 tptp -86.96 12.32 11.49 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.03 -1.276 . . . . 4.45 109.452 179.988 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' D' D ' 358' ' ' GLU . . . . . . . . . . . . . 19.6 mt-10 -49.95 149.17 5.02 Favored Pre-proline 0 N--CA 1.49 1.548 0 O-C-N 121.214 -0.929 . . . . 5.71 109.378 179.967 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' D' D ' 359' ' ' PRO . . . . . . . . . . . . . 1.3 Cg_endo -68.28 -4.46 12.81 Favored 'Trans proline' 0 C--N 1.309 -1.505 0 C-N-CA 122.247 1.965 . . . . 5.6 110.33 -179.935 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' D' D ' 360' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.182 0 CA-C-O 118.049 -1.417 . . . . 6.97 109.601 -179.963 . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 319' ' ' LYS . . . . . 0.451 ' O ' ' HB2' ' A' ' 320' ' ' LYS . 4.8 mmtp . . . . . 0 N--CA 1.491 1.577 0 N-CA-C 109.576 -0.527 . . . . 7.95 109.576 . . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 320' ' ' LYS . . . . . 0.451 ' HB2' ' O ' ' A' ' 319' ' ' LYS . 19.0 mttt 61.66 -168.45 0.18 Allowed 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.334 -0.854 . . . . 6.71 109.434 -179.961 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 321' ' ' LYS . . . . . . . . . . . . . 9.5 mttt -158.51 71.14 3.82 Favored Pre-proline 0 N--CA 1.49 1.537 0 O-C-N 121.34 -0.85 . . . . 6.5 109.516 179.954 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 322' ' ' PRO . . . . . . . . . . . . . 4.1 Cg_exo -60.26 136.93 71.63 Favored 'Trans proline' 0 C--N 1.309 -1.535 0 C-N-CA 122.083 1.855 . . . . 3.3 110.169 179.923 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 323' ' ' LEU . . . . . . . . . . . . . 30.2 mt -80.5 115.24 19.92 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.268 -0.895 . . . . 3.16 109.337 179.984 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 324' ' ' ASP . . . . . . . . . . . . . 4.7 m-20 -79.36 144.41 34.21 Favored 'General case' 0 C--N 1.304 -1.404 0 O-C-N 121.268 -0.895 . . . . 1.53 109.358 179.909 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 325' ' ' GLY . . . . . 0.414 ' O ' ' CE2' ' A' ' 327' ' ' TYR . . . -68.34 177.37 25.3 Favored Glycine 0 N--CA 1.487 2.093 0 N-CA-C 109.181 -1.568 . . . . 0.67 109.181 179.941 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 326' ' ' GLU . . . . . . . . . . . . . 66.9 mm-40 -56.35 179.21 0.04 OUTLIER 'General case' 0 N--CA 1.489 1.489 0 O-C-N 121.172 -1.193 . . . . 2.13 109.312 -179.917 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 327' ' ' TYR . . . . . 0.605 ' CE1' ' CG ' ' C' ' 333' ' ' ARG . 43.1 m-85 -148.75 95.27 2.39 Favored 'General case' 0 N--CA 1.488 1.446 0 O-C-N 121.249 -0.907 . . . . 1.0 109.557 -179.898 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 328' ' ' PHE . . . . . 0.4 ' CE2' ' HG3' ' C' ' 335' ' ' ARG . 84.7 m-85 -103.35 -162.48 0.91 Allowed 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.255 -0.903 . . . . 0.34 109.62 -179.991 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 329' ' ' THR . . . . . . . . . . . . . 40.8 p -154.12 166.91 31.6 Favored 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.365 -0.834 . . . . 1.05 109.11 179.855 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 330' ' ' LEU . . . . . . . . . . . . . 18.9 tp -149.96 126.61 10.96 Favored 'General case' 0 N--CA 1.488 1.46 0 O-C-N 121.097 -1.002 . . . . 1.07 110.064 -179.561 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 331' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -88.07 112.62 22.86 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.353 -0.842 . . . . 0.91 108.95 179.399 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 332' ' ' ILE . . . . . . . . . . . . . 50.5 mt -103.49 109.45 27.06 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.595 0 O-C-N 121.216 -0.928 . . . . 1.09 109.792 -179.716 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 333' ' ' ARG . . . . . 0.545 ' HG2' ' CE1' ' C' ' 327' ' ' TYR . 80.8 mtt180 -72.73 149.46 43.71 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.37 -0.831 . . . . 3.41 109.449 179.803 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 334' ' ' GLY . . . . . . . . . . . . . . . 82.03 124.69 0.78 Allowed Glycine 0 N--CA 1.491 2.307 0 N-CA-C 109.398 -1.481 . . . . 0.4 109.398 -179.894 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 335' ' ' ARG . . . . . . . . . . . . . 60.6 ttt180 -75.53 -33.42 60.71 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.318 -1.107 . . . . 3.55 109.542 -179.894 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 336' ' ' GLU . . . . . . . . . . . . . 62.8 tt0 -58.32 -61.84 2.27 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.267 -0.896 . . . . 2.29 109.768 -179.886 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 337' ' ' ARG . . . . . . . . . . . . . 8.2 mmt180 -62.1 -33.18 73.95 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.122 -0.987 . . . . 3.64 109.783 -179.739 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 338' ' ' PHE . . . . . . . . . . . . . 45.7 t80 -54.38 -57.02 12.87 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.123 -0.986 . . . . 0.41 109.753 -179.631 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 339' ' ' GLU . . . . . . . . . . . . . 41.6 mt-10 -51.09 -35.1 33.37 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.234 -0.916 . . . . 1.97 109.989 -179.699 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 340' ' ' MET . . . . . . . . . . . . . 48.5 ttp -63.61 -49.14 74.47 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.262 -0.899 . . . . 1.14 110.092 -179.56 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 341' ' ' PHE . . . . . . . . . . . . . 44.3 m-85 -61.83 -45.97 91.51 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.239 -0.913 . . . . 0.21 109.835 -179.456 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 342' ' ' ARG . . . . . . . . . . . . . 5.7 ttt180 -49.91 -42.26 47.73 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.167 -0.958 . . . . 3.15 110.06 -179.658 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 343' ' ' GLU . . . . . . . . . . . . . 1.2 tp10 -59.04 -49.85 76.33 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.144 -0.972 . . . . 2.35 109.886 -179.613 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 344' ' ' LEU . . . . . 0.421 ' O ' HD21 ' A' ' 348' ' ' LEU . 61.5 mt -59.94 -30.95 69.42 Favored 'General case' 0 N--CA 1.489 1.495 0 O-C-N 121.222 -0.924 . . . . 1.06 109.403 -179.737 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 345' ' ' ASN . . . . . . . . . . . . . 64.4 t-20 -58.41 -59.3 5.56 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.271 -0.893 . . . . 1.36 109.74 -179.98 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 346' ' ' GLU . . . . . 0.465 ' OE1' ' NZ ' ' B' ' 351' ' ' LYS . 1.0 OUTLIER -61.48 -26.29 67.8 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.234 -0.917 . . . . 1.65 109.884 -179.577 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 347' ' ' ALA . . . . . . . . . . . . . . . -60.79 -57.93 10.59 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.173 -0.954 . . . . 1.03 110.018 -179.74 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 348' ' ' LEU . . . . . 0.437 ' N ' ' CD2' ' A' ' 348' ' ' LEU . 4.1 mm? -61.94 -44.5 96.63 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.211 -0.931 . . . . 1.04 110.122 -179.38 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 349' ' ' GLU . . . . . . . . . . . . . 12.0 mm-40 -58.34 -33.34 69.43 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.123 -0.985 . . . . 1.94 109.939 -179.462 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 350' ' ' LEU . . . . . 0.512 HD12 ' NE2' ' B' ' 354' ' ' GLN . 5.1 tt -64.47 -43.51 93.98 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.225 -0.922 . . . . 1.17 109.843 -179.761 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 351' ' ' LYS . . . . . 0.44 ' NZ ' ' OE1' ' B' ' 346' ' ' GLU . 19.8 tttp -59.15 -45.11 91.82 Favored 'General case' 0 N--CA 1.489 1.499 0 O-C-N 121.337 -0.852 . . . . 1.97 109.961 -179.643 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 352' ' ' ASP . . . . . . . . . . . . . 36.1 m-20 -58.66 -49.03 79.04 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.233 -0.917 . . . . 1.16 110.265 -179.584 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 353' ' ' ALA . . . . . . . . . . . . . . . -65.99 -11.05 45.11 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.087 -1.008 . . . . 1.22 109.893 -179.31 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 354' ' ' GLN . . . . . 0.487 ' NE2' HD12 ' B' ' 350' ' ' LEU . 1.7 mt-30 -83.98 -54.2 5.02 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.228 -0.92 . . . . 1.71 109.55 179.765 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 355' ' ' ALA . . . . . . . . . . . . . . . -71.41 -3.94 23.63 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.36 -0.838 . . . . 1.3 109.962 -179.731 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 356' ' ' GLY . . . . . . . . . . . . . . . -80.44 -9.03 86.97 Favored Glycine 0 N--CA 1.491 2.32 0 N-CA-C 109.763 -1.335 . . . . 1.3 109.763 -179.883 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 357' ' ' LYS . . . . . . . . . . . . . 20.0 mttt -90.35 103.32 16.02 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.237 -1.155 . . . . 4.46 109.56 179.946 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 358' ' ' GLU . . . . . 0.546 ' CB ' ' HD3' ' A' ' 359' ' ' PRO . 1.8 tt0 -49.81 -55.45 23.49 Favored Pre-proline 0 N--CA 1.489 1.495 0 O-C-N 121.153 -0.967 . . . . 5.75 109.685 179.949 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 359' ' ' PRO . . . . . 0.546 ' HD3' ' CB ' ' A' ' 358' ' ' GLU . 2.2 Cg_endo -62.71 144.87 94.69 Favored 'Trans proline' 0 C--N 1.311 -1.427 0 C-N-CA 121.86 1.706 . . . . 5.63 110.105 179.979 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 360' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.356 0 N-CA-C 109.418 -1.473 . . . . 6.97 109.418 179.992 . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' B' B ' 319' ' ' LYS . . . . . 0.441 ' O ' ' HB2' ' B' ' 320' ' ' LYS . 4.8 mmtp . . . . . 0 N--CA 1.49 1.557 0 CA-C-O 121.274 0.559 . . . . 7.95 109.501 . . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 320' ' ' LYS . . . . . 0.441 ' HB2' ' O ' ' B' ' 319' ' ' LYS . 18.9 mttt 61.09 -168.86 0.17 Allowed 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.216 -0.927 . . . . 6.73 109.49 -179.904 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 321' ' ' LYS . . . . . . . . . . . . . 10.0 mttt -158.22 70.5 3.94 Favored Pre-proline 0 N--CA 1.49 1.575 0 O-C-N 121.24 -0.913 . . . . 6.5 109.521 179.99 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 322' ' ' PRO . . . . . . . . . . . . . 4.4 Cg_exo -59.86 136.74 71.99 Favored 'Trans proline' 0 C--N 1.31 -1.474 0 C-N-CA 122.163 1.909 . . . . 3.29 110.204 179.823 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 323' ' ' LEU . . . . . . . . . . . . . 27.7 mt -80.37 115.81 20.11 Favored 'General case' 0 N--CA 1.489 1.48 0 O-C-N 121.193 -0.942 . . . . 3.18 109.321 -179.991 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 324' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 -79.66 142.46 35.52 Favored 'General case' 0 N--CA 1.489 1.491 0 O-C-N 121.206 -0.934 . . . . 1.53 109.5 179.991 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 325' ' ' GLY . . . . . 0.411 ' O ' ' CE2' ' B' ' 327' ' ' TYR . . . -65.97 176.96 15.67 Favored Glycine 0 N--CA 1.489 2.194 0 N-CA-C 109.264 -1.534 . . . . 0.65 109.264 179.765 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 326' ' ' GLU . . . . . . . . . . . . . 67.0 mm-40 -56.48 179.31 0.04 OUTLIER 'General case' 0 N--CA 1.489 1.5 0 O-C-N 121.16 -1.2 . . . . 2.13 109.261 -179.973 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 327' ' ' TYR . . . . . 0.585 ' CE1' ' HG2' ' D' ' 333' ' ' ARG . 44.1 m-85 -148.63 94.97 2.36 Favored 'General case' 0 N--CA 1.488 1.425 0 O-C-N 121.011 -1.056 . . . . 0.99 109.582 -179.956 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 328' ' ' PHE . . . . . . . . . . . . . 85.5 m-85 -103.19 -162.83 0.94 Allowed 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.265 -0.897 . . . . 0.36 109.534 -179.91 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 329' ' ' THR . . . . . . . . . . . . . 41.1 p -153.96 166.92 31.46 Favored 'General case' 0 N--CA 1.488 1.471 0 O-C-N 121.33 -0.856 . . . . 1.05 109.082 179.943 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 330' ' ' LEU . . . . . 0.41 ' O ' ' HA ' ' D' ' 329' ' ' THR . 18.6 tp -149.97 126.03 10.6 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.011 -1.056 . . . . 1.07 109.954 -179.579 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 331' ' ' GLN . . . . . 0.453 ' OE1' ' O ' ' D' ' 328' ' ' PHE . 0.2 OUTLIER -87.38 112.66 22.35 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.273 -0.892 . . . . 0.91 108.895 179.432 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' B' B ' 332' ' ' ILE . . . . . . . . . . . . . 50.3 mt -103.46 109.6 27.47 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.561 0 O-C-N 121.113 -0.992 . . . . 1.08 109.746 -179.699 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 333' ' ' ARG . . . . . 0.551 ' HG2' ' CE1' ' D' ' 327' ' ' TYR . 81.6 mtt180 -72.84 149.96 43.1 Favored 'General case' 0 N--CA 1.489 1.486 0 O-C-N 121.329 -0.857 . . . . 3.42 109.414 179.748 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 334' ' ' GLY . . . . . . . . . . . . . . . 81.4 124.81 0.7 Allowed Glycine 0 N--CA 1.491 2.36 0 N-CA-C 109.444 -1.463 . . . . 0.4 109.444 -179.893 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 335' ' ' ARG . . . . . . . . . . . . . 58.7 ttt180 -75.42 -33.15 60.92 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.22 -1.165 . . . . 3.55 109.644 -179.874 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 336' ' ' GLU . . . . . . . . . . . . . 61.3 tt0 -58.78 -61.77 2.37 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.241 -0.912 . . . . 2.28 109.704 -179.793 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 337' ' ' ARG . . . . . . . . . . . . . 7.8 mmt180 -61.78 -33.1 73.48 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.161 -0.962 . . . . 3.64 109.743 -179.762 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 338' ' ' PHE . . . . . . . . . . . . . 46.4 t80 -54.26 -57.54 10.79 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.171 -0.956 . . . . 0.39 109.794 -179.805 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 339' ' ' GLU . . . . . . . . . . . . . 41.3 mt-10 -51.02 -34.82 31.02 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.177 -0.952 . . . . 1.98 110.071 -179.686 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 340' ' ' MET . . . . . . . . . . . . . 47.8 ttp -63.91 -48.99 74.4 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.146 -0.971 . . . . 1.14 110.094 -179.505 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 341' ' ' PHE . . . . . . . . . . . . . 44.5 m-85 -61.96 -46.17 90.47 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.151 -0.968 . . . . 0.22 109.885 -179.56 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 342' ' ' ARG . . . . . . . . . . . . . 6.0 ttt180 -49.69 -42.36 45.52 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.213 -0.929 . . . . 3.15 110.051 -179.631 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 343' ' ' GLU . . . . . . . . . . . . . 1.1 tp10 -58.92 -49.62 77.11 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.077 -1.014 . . . . 2.35 109.882 -179.604 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 344' ' ' LEU . . . . . 0.414 ' O ' HD21 ' B' ' 348' ' ' LEU . 60.0 mt -60.29 -30.84 69.74 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.208 -0.932 . . . . 1.05 109.432 -179.677 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 345' ' ' ASN . . . . . 0.419 ' HA ' ' CZ ' ' D' ' 341' ' ' PHE . 64.4 t-20 -58.56 -59.05 5.99 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.354 -0.841 . . . . 1.35 109.735 179.978 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 346' ' ' GLU . . . . . 0.44 ' OE1' ' NZ ' ' A' ' 351' ' ' LYS . 1.1 tm-20 -61.64 -26.38 67.96 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.237 -0.914 . . . . 1.66 109.943 -179.642 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 347' ' ' ALA . . . . . . . . . . . . . . . -60.67 -57.7 11.6 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.187 -0.946 . . . . 1.02 110.116 -179.817 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 348' ' ' LEU . . . . . 0.47 HD11 ' NH2' ' D' ' 337' ' ' ARG . 4.1 mm? -62.06 -44.7 96.12 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.188 -0.945 . . . . 1.05 110.192 -179.448 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 349' ' ' GLU . . . . . . . . . . . . . 11.3 mm-40 -58.35 -33.09 69.16 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.222 -0.924 . . . . 1.95 109.979 -179.422 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 350' ' ' LEU . . . . . 0.501 HD23 HD23 ' A' ' 350' ' ' LEU . 5.2 tt -64.59 -43.34 94.12 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.258 -0.901 . . . . 1.18 109.858 -179.797 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 351' ' ' LYS . . . . . 0.465 ' NZ ' ' OE1' ' A' ' 346' ' ' GLU . 19.1 tttp -59.5 -44.57 93.07 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.365 -0.834 . . . . 1.96 109.917 -179.588 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 352' ' ' ASP . . . . . . . . . . . . . 37.2 m-20 -58.68 -49.24 78.27 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.242 -0.911 . . . . 1.16 110.178 -179.676 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 353' ' ' ALA . . . . . . . . . . . . . . . -65.8 -11.22 44.37 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.044 -1.035 . . . . 1.21 109.839 -179.438 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 354' ' ' GLN . . . . . 0.512 ' NE2' HD12 ' A' ' 350' ' ' LEU . 1.6 mt-30 -83.6 -54.59 4.83 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.189 -0.945 . . . . 1.69 109.464 179.962 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 355' ' ' ALA . . . . . . . . . . . . . . . -71.39 -3.68 22.17 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.366 -0.834 . . . . 1.3 109.915 -179.744 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 356' ' ' GLY . . . . . . . . . . . . . . . -80.49 -9.16 86.8 Favored Glycine 0 N--CA 1.491 2.333 0 N-CA-C 109.721 -1.352 . . . . 1.29 109.721 -179.775 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 357' ' ' LYS . . . . . . . . . . . . . 21.3 mttt -90.27 103.38 16.06 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.119 -1.224 . . . . 4.45 109.567 179.892 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 358' ' ' GLU . . . . . 0.548 ' CB ' ' HD3' ' B' ' 359' ' ' PRO . 1.8 tt0 -50.01 -55.43 24.35 Favored Pre-proline 0 N--CA 1.489 1.499 0 O-C-N 121.25 -0.907 . . . . 5.72 109.659 179.92 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 359' ' ' PRO . . . . . 0.548 ' HD3' ' CB ' ' B' ' 358' ' ' GLU . 2.2 Cg_endo -62.47 145.56 95.57 Favored 'Trans proline' 0 C--N 1.311 -1.4 0 C-N-CA 121.832 1.688 . . . . 5.6 110.028 -179.942 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 360' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.236 0 CA-C-O 118.03 -1.428 . . . . 6.98 109.568 -179.959 . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' C' C ' 319' ' ' LYS . . . . . . . . . . . . . 12.2 mttt . . . . . 0 N--CA 1.49 1.549 0 CA-C-O 121.383 0.611 . . . . 7.03 109.375 . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' C' C ' 320' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER 57.84 16.05 3.39 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.238 -0.914 . . . . 6.84 109.705 179.875 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' C' C ' 321' ' ' LYS . . . . . 0.619 ' N ' ' CD ' ' C' ' 322' ' ' PRO . 13.0 mmtt -81.35 -43.8 1.14 Allowed Pre-proline 0 N--CA 1.49 1.529 0 O-C-N 121.205 -0.935 . . . . 6.78 110.696 179.953 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' C' C ' 322' ' ' PRO . . . . . 0.619 ' CD ' ' N ' ' C' ' 321' ' ' LYS . 1.3 Cg_endo -65.89 -45.76 5.76 Favored 'Trans proline' 0 C--N 1.315 -1.205 0 C-N-CA 121.427 1.418 . . . . 3.98 110.554 -179.548 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' C' C ' 323' ' ' LEU . . . . . . . . . . . . . 32.7 mt -83.48 78.04 9.72 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.237 -0.914 . . . . 4.31 110.269 -179.412 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' C' C ' 324' ' ' ASP . . . . . 0.462 ' CB ' ' OH ' ' C' ' 327' ' ' TYR . 0.8 OUTLIER -83.6 177.14 8.54 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.347 -0.846 . . . . 1.63 109.325 179.26 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' C' C ' 325' ' ' GLY . . . . . . . . . . . . . . . -69.46 -171.49 8.17 Favored Glycine 0 N--CA 1.492 2.419 0 N-CA-C 109.678 -1.369 . . . . 0.82 109.678 179.776 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' C' C ' 326' ' ' GLU . . . . . . . . . . . . . 1.8 mm-40 -59.41 -175.06 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.193 -1.181 . . . . 2.17 109.527 179.932 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' C' C ' 327' ' ' TYR . . . . . 0.545 ' CE1' ' HG2' ' A' ' 333' ' ' ARG . 41.2 m-85 -149.94 105.79 3.44 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.245 -0.909 . . . . 1.03 109.76 179.847 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' C' C ' 328' ' ' PHE . . . . . . . . . . . . . 91.6 m-85 -111.7 -164.21 0.9 Allowed 'General case' 0 C--N 1.303 -1.436 0 O-C-N 121.42 -0.8 . . . . 0.37 109.185 179.757 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' C' C ' 329' ' ' THR . . . . . . . . . . . . . 11.3 p -153.94 160.46 42.11 Favored 'General case' 0 C--N 1.302 -1.478 0 O-C-N 121.397 -0.815 . . . . 1.04 109.064 179.776 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' C' C ' 330' ' ' LEU . . . . . . . . . . . . . 16.7 tp -148.96 125.64 11.09 Favored 'General case' 0 N--CA 1.488 1.471 0 O-C-N 121.252 -0.905 . . . . 1.09 109.644 -179.788 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' C' C ' 331' ' ' GLN . . . . . . . . . . . . . 1.5 tp60 -86.93 116.65 25.14 Favored 'General case' 0 N--CA 1.489 1.5 0 O-C-N 121.282 -0.887 . . . . 1.48 109.021 179.61 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' C' C ' 332' ' ' ILE . . . . . 0.5 HD12 ' CD2' ' C' ' 341' ' ' PHE . 59.6 mt -103.3 110.02 28.62 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.452 0 O-C-N 121.128 -0.983 . . . . 1.08 109.654 -179.796 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' C' C ' 333' ' ' ARG . . . . . 0.605 ' CG ' ' CE1' ' A' ' 327' ' ' TYR . 2.1 mpt_? -71.61 149.75 45.32 Favored 'General case' 0 C--N 1.304 -1.381 0 O-C-N 121.334 -0.854 . . . . 3.36 109.07 179.634 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' C' C ' 334' ' ' GLY . . . . . . . . . . . . . . . 80.98 130.09 0.99 Allowed Glycine 0 N--CA 1.489 2.189 0 N-CA-C 109.567 -1.413 . . . . 0.35 109.567 -179.942 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' C' C ' 335' ' ' ARG . . . . . 0.4 ' HG3' ' CE2' ' A' ' 328' ' ' PHE . 57.1 ttt180 -77.92 -36.88 48.91 Favored 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.401 -1.058 . . . . 3.23 109.52 -179.89 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' C' C ' 336' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -57.5 -58.28 8.98 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.371 -0.831 . . . . 2.62 110.169 -179.471 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' C' C ' 337' ' ' ARG . . . . . 0.54 ' HG3' ' NH1' ' C' ' 337' ' ' ARG . 0.1 OUTLIER -59.87 -31.92 70.23 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.173 -0.954 . . . . 3.61 109.797 -179.638 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' C' C ' 338' ' ' PHE . . . . . . . . . . . . . 79.7 t80 -54.07 -55.21 29.69 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.294 -0.879 . . . . 0.43 109.745 -179.72 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' C' C ' 339' ' ' GLU . . . . . . . . . . . . . 34.0 mt-10 -52.01 -35.71 47.66 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.299 -0.876 . . . . 2.05 109.977 -179.795 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' C' C ' 340' ' ' MET . . . . . . . . . . . . . 31.5 ttp -64.38 -51.2 64.47 Favored 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.307 -0.87 . . . . 1.1 110.304 -179.454 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' C' C ' 341' ' ' PHE . . . . . 0.5 ' CD2' HD12 ' C' ' 332' ' ' ILE . 33.1 m-85 -62.06 -40.06 94.5 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.056 -1.028 . . . . 0.21 110.365 -179.338 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' C' C ' 342' ' ' ARG . . . . . 0.513 ' NH1' ' HG3' ' C' ' 342' ' ' ARG . 0.0 OUTLIER -51.7 -48.61 63.46 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.022 -1.049 . . . . 3.42 110.091 -179.516 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' C' C ' 343' ' ' GLU . . . . . . . . . . . . . 1.6 tp10 -59.74 -43.81 94.06 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.274 -0.891 . . . . 2.14 110.247 -179.419 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' C' C ' 344' ' ' LEU . . . . . . . . . . . . . 53.6 mt -61.5 -34.53 75.66 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.157 -0.964 . . . . 1.09 109.839 -179.529 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' C' C ' 345' ' ' ASN . . . . . 0.4 ' O ' ' HG2' ' C' ' 349' ' ' GLU . 39.0 t-20 -58.82 -57.77 11.57 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.242 -0.911 . . . . 1.38 109.71 -179.997 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' C' C ' 346' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -60.61 -24.87 65.84 Favored 'General case' 0 N--CA 1.489 1.486 0 O-C-N 121.205 -0.934 . . . . 2.21 109.926 -179.603 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' C' C ' 347' ' ' ALA . . . . . . . . . . . . . . . -62.07 -59.62 4.81 Favored 'General case' 0 N--CA 1.489 1.501 0 O-C-N 121.095 -1.003 . . . . 1.03 109.65 -179.979 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' C' C ' 348' ' ' LEU . . . . . 0.514 HD23 ' N ' ' C' ' 348' ' ' LEU . 3.8 mm? -64.43 -48.35 75.66 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.271 -0.893 . . . . 1.06 110.328 -179.583 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' C' C ' 349' ' ' GLU . . . . . 0.4 ' HG2' ' O ' ' C' ' 345' ' ' ASN . 3.8 mm-40 -55.33 -34.11 63.92 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.119 -0.988 . . . . 2.19 109.482 -179.393 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' C' C ' 350' ' ' LEU . . . . . 0.528 HD23 ' CD1' ' D' ' 350' ' ' LEU . 5.0 tt -64.87 -36.98 86.11 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.301 -0.874 . . . . 1.2 109.073 179.695 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' C' C ' 351' ' ' LYS . . . . . . . . . . . . . 19.4 tttt -60.33 -47.57 85.47 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.494 -0.754 . . . . 1.92 109.306 179.913 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' C' C ' 352' ' ' ASP . . . . . . . . . . . . . 15.0 m-20 -55.88 -52.96 62.26 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.385 -0.822 . . . . 1.19 109.514 -179.988 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' C' C ' 353' ' ' ALA . . . . . . . . . . . . . . . -66.46 -14.49 62.3 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.188 -0.945 . . . . 1.15 109.59 -179.818 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' C' C ' 354' ' ' GLN . . . . . 0.53 ' NE2' ' CD1' ' D' ' 350' ' ' LEU . 0.9 OUTLIER -81.9 -29.89 32.16 Favored 'General case' 0 N--CA 1.488 1.432 0 O-C-N 121.285 -0.884 . . . . 1.7 109.056 179.822 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' C' C ' 355' ' ' ALA . . . . . 0.423 ' O ' ' C ' ' C' ' 356' ' ' GLY . . . -73.91 -63.04 1.3 Allowed 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.345 -0.847 . . . . 1.3 109.553 179.73 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' C' C ' 356' ' ' GLY . . . . . 0.423 ' C ' ' O ' ' C' ' 355' ' ' ALA . . . -41.93 -87.33 0.01 OUTLIER Glycine 0 N--CA 1.493 2.448 0 N-CA-C 109.757 -1.337 . . . . 1.33 109.757 -179.775 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' C' C ' 357' ' ' LYS . . . . . 0.492 ' O ' ' HD3' ' C' ' 359' ' ' PRO . 1.0 OUTLIER -86.44 91.49 8.54 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.21 -1.171 . . . . 4.39 109.265 -179.93 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' C' C ' 358' ' ' GLU . . . . . . . . . . . . . 3.3 tm-20 -45.17 103.91 0.37 Allowed Pre-proline 0 N--CA 1.492 1.634 0 O-C-N 121.388 -0.82 . . . . 5.75 109.719 -179.72 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' C' C ' 359' ' ' PRO . . . . . 0.504 ' HG2' ' CG ' ' C' ' 354' ' ' GLN . 1.4 Cg_endo -66.56 -81.06 0.01 OUTLIER 'Trans proline' 0 C--N 1.311 -1.428 0 C-N-CA 121.886 1.724 . . . . 5.54 109.684 179.622 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' C' C ' 360' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.2 0 CA-C-O 117.961 -1.466 . . . . 6.5 109.451 179.813 . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' D' D ' 319' ' ' LYS . . . . . 0.419 ' O ' ' HB2' ' D' ' 320' ' ' LYS . 4.5 mmtp . . . . . 0 N--CA 1.49 1.575 0 N-CA-C 109.459 -0.571 . . . . 7.93 109.459 . . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' D' D ' 320' ' ' LYS . . . . . 0.419 ' HB2' ' O ' ' D' ' 319' ' ' LYS . 19.6 mttt 60.71 -169.6 0.16 Allowed 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.341 -0.849 . . . . 6.7 109.339 -179.994 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' D' D ' 321' ' ' LYS . . . . . . . . . . . . . 10.0 mttt -157.83 70.54 4.15 Favored Pre-proline 0 N--CA 1.488 1.449 0 O-C-N 121.225 -0.922 . . . . 6.49 109.482 -179.946 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' D' D ' 322' ' ' PRO . . . . . . . . . . . . . 4.2 Cg_exo -60.16 136.76 70.92 Favored 'Trans proline' 0 C--N 1.31 -1.484 0 C-N-CA 122.135 1.89 . . . . 3.29 110.227 179.914 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' D' D ' 323' ' ' LEU . . . . . . . . . . . . . 25.0 mt -80.07 115.58 19.72 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.287 -0.883 . . . . 3.16 109.443 -179.991 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' D' D ' 324' ' ' ASP . . . . . . . . . . . . . 4.1 m-20 -79.45 143.47 34.94 Favored 'General case' 0 N--CA 1.488 1.47 0 O-C-N 121.274 -0.891 . . . . 1.54 109.312 179.999 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' D' D ' 325' ' ' GLY . . . . . 0.407 ' O ' ' CE2' ' D' ' 327' ' ' TYR . . . -67.19 176.59 22.32 Favored Glycine 0 N--CA 1.49 2.275 0 N-CA-C 109.12 -1.592 . . . . 0.65 109.12 179.899 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' D' D ' 326' ' ' GLU . . . . . . . . . . . . . 66.1 mm-40 -56.17 179.12 0.04 OUTLIER 'General case' 0 N--CA 1.488 1.436 0 O-C-N 121.126 -1.22 . . . . 2.13 109.222 -179.923 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' D' D ' 327' ' ' TYR . . . . . 0.551 ' CE1' ' HG2' ' B' ' 333' ' ' ARG . 43.8 m-85 -148.44 94.81 2.35 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.21 -0.931 . . . . 1.0 109.453 -179.875 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' D' D ' 328' ' ' PHE . . . . . 0.453 ' O ' ' OE1' ' B' ' 331' ' ' GLN . 85.6 m-85 -103.03 -162.54 0.92 Allowed 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.191 -0.943 . . . . 0.34 109.574 179.93 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' D' D ' 329' ' ' THR . . . . . 0.41 ' HA ' ' O ' ' B' ' 330' ' ' LEU . 40.3 p -154.24 166.79 32.05 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.316 -0.865 . . . . 1.05 108.951 179.895 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' D' D ' 330' ' ' LEU . . . . . . . . . . . . . 18.7 tp -149.78 125.96 10.69 Favored 'General case' 0 N--CA 1.488 1.443 0 O-C-N 121.029 -1.044 . . . . 1.07 109.824 -179.502 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' D' D ' 331' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -87.48 112.48 22.24 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.203 -0.936 . . . . 0.93 108.876 179.491 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' D' D ' 332' ' ' ILE . . . . . . . . . . . . . 47.2 mt -103.34 109.64 27.54 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.543 0 O-C-N 121.257 -0.902 . . . . 1.07 109.858 -179.68 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' D' D ' 333' ' ' ARG . . . . . 0.585 ' HG2' ' CE1' ' B' ' 327' ' ' TYR . 82.0 mtt180 -72.84 150.74 42.44 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.445 -0.784 . . . . 3.42 109.358 179.838 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' D' D ' 334' ' ' GLY . . . . . . . . . . . . . . . 80.75 125.18 0.63 Allowed Glycine 0 N--CA 1.491 2.308 0 N-CA-C 109.373 -1.491 . . . . 0.41 109.373 -179.833 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' D' D ' 335' ' ' ARG . . . . . . . . . . . . . 57.0 ttt180 -75.7 -33.65 60.35 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.366 -1.079 . . . . 3.58 109.535 -179.978 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' D' D ' 336' ' ' GLU . . . . . . . . . . . . . 60.8 tt0 -58.29 -62.2 2.01 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.255 -0.903 . . . . 2.26 109.77 -179.854 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' D' D ' 337' ' ' ARG . . . . . 0.47 ' NH2' HD11 ' B' ' 348' ' ' LEU . 7.4 mmt180 -61.23 -32.85 72.64 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.247 -0.908 . . . . 3.64 109.74 -179.771 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' D' D ' 338' ' ' PHE . . . . . . . . . . . . . 46.5 t80 -54.44 -57.64 10.54 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.289 -0.882 . . . . 0.4 109.72 -179.732 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' D' D ' 339' ' ' GLU . . . . . . . . . . . . . 41.2 mt-10 -50.99 -34.88 30.97 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.166 -0.959 . . . . 1.99 109.978 -179.666 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' D' D ' 340' ' ' MET . . . . . . . . . . . . . 46.7 ttp -63.84 -49.74 71.61 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.086 -1.009 . . . . 1.13 110.019 -179.496 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' D' D ' 341' ' ' PHE . . . . . 0.419 ' CZ ' ' HA ' ' B' ' 345' ' ' ASN . 44.7 m-85 -61.31 -46.6 89.61 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.126 -0.984 . . . . 0.21 110.007 -179.674 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' D' D ' 342' ' ' ARG . . . . . . . . . . . . . 6.0 ttt180 -49.39 -42.58 42.76 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.168 -0.958 . . . . 3.15 110.02 -179.625 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' D' D ' 343' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -58.65 -49.93 75.72 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.133 -0.979 . . . . 2.35 109.844 -179.518 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' D' D ' 344' ' ' LEU . . . . . 0.429 ' O ' HD21 ' D' ' 348' ' ' LEU . 60.2 mt -59.93 -30.89 69.36 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.175 -0.953 . . . . 1.06 109.504 -179.786 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' D' D ' 345' ' ' ASN . . . . . . . . . . . . . 64.3 t-20 -58.61 -59.29 5.63 Favored 'General case' 0 N--CA 1.488 1.455 0 O-C-N 121.204 -0.935 . . . . 1.35 109.82 179.955 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' D' D ' 346' ' ' GLU . . . . . . . . . . . . . 1.2 tm-20 -61.31 -26.71 67.98 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.29 -0.881 . . . . 1.69 109.981 -179.687 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' D' D ' 347' ' ' ALA . . . . . . . . . . . . . . . -60.29 -57.72 11.6 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.1 -1.0 . . . . 1.03 110.111 -179.723 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' D' D ' 348' ' ' LEU . . . . . 0.444 ' CD2' ' N ' ' D' ' 348' ' ' LEU . 4.1 mm? -62.12 -44.68 96.1 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.152 -0.968 . . . . 1.04 110.092 -179.348 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' D' D ' 349' ' ' GLU . . . . . . . . . . . . . 10.2 mm-40 -58.22 -33.31 69.17 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.209 -0.932 . . . . 1.95 110.018 -179.436 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' D' D ' 350' ' ' LEU . . . . . 0.53 ' CD1' ' NE2' ' C' ' 354' ' ' GLN . 5.3 tt -64.44 -43.89 92.86 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.147 -0.971 . . . . 1.16 109.716 -179.819 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' D' D ' 351' ' ' LYS . . . . . 0.432 ' O ' ' HB2' ' D' ' 354' ' ' GLN . 18.7 tttp -58.96 -44.72 91.54 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.371 -0.831 . . . . 1.97 110.015 -179.601 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' D' D ' 352' ' ' ASP . . . . . . . . . . . . . 35.2 m-20 -58.46 -48.9 79.24 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.297 -0.877 . . . . 1.17 110.307 -179.576 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' D' D ' 353' ' ' ALA . . . . . . . . . . . . . . . -66.43 -11.15 50.3 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.259 -0.901 . . . . 1.21 109.784 -179.351 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' D' D ' 354' ' ' GLN . . . . . 0.472 ' HG3' HD22 ' D' ' 350' ' ' LEU . 1.5 mt-30 -83.36 -54.63 4.84 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.211 -0.93 . . . . 1.68 109.484 179.829 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' D' D ' 355' ' ' ALA . . . . . . . . . . . . . . . -71.58 -3.58 22.23 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.288 -0.883 . . . . 1.29 109.852 -179.869 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' D' D ' 356' ' ' GLY . . . . . . . . . . . . . . . -80.44 -8.81 87.19 Favored Glycine 0 N--CA 1.49 2.245 0 N-CA-C 109.708 -1.357 . . . . 1.28 109.708 -179.802 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' D' D ' 357' ' ' LYS . . . . . . . . . . . . . 21.6 mttt -90.3 103.03 15.76 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.28 -1.129 . . . . 4.45 109.61 179.861 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' D' D ' 358' ' ' GLU . . . . . 0.549 ' N ' ' HD2' ' D' ' 359' ' ' PRO . 2.0 tt0 -49.76 -55.03 25.91 Favored Pre-proline 0 N--CA 1.489 1.513 0 O-C-N 121.188 -0.945 . . . . 5.71 109.681 179.979 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' D' D ' 359' ' ' PRO . . . . . 0.549 ' HD2' ' N ' ' D' ' 358' ' ' GLU . 2.3 Cg_endo -62.83 146.08 94.91 Favored 'Trans proline' 0 C--N 1.311 -1.436 0 C-N-CA 121.963 1.775 . . . . 5.6 110.004 179.888 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' D' D ' 360' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.252 0 N-CA-C 109.426 -1.47 . . . . 6.97 109.426 179.969 . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 319' ' ' LYS . . . . . . . . . . . . . 2.9 mmpp? . . . . . 0 N--CA 1.489 1.477 0 N-CA-C 109.467 -0.568 . . . . 7.95 109.467 . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 320' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 61.23 157.5 0.04 OUTLIER 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.37 -0.831 . . . . 6.71 109.381 -179.967 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 321' ' ' LYS . . . . . 0.594 ' CB ' ' HD3' ' A' ' 322' ' ' PRO . 0.1 OUTLIER -159.53 -65.5 0.02 OUTLIER Pre-proline 0 N--CA 1.49 1.538 0 O-C-N 121.154 -0.966 . . . . 6.5 109.728 179.777 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 322' ' ' PRO . . . . . 0.594 ' HD3' ' CB ' ' A' ' 321' ' ' LYS . 4.1 Cg_exo -57.74 -160.18 0.02 OUTLIER 'Trans proline' 0 C--N 1.314 -1.255 0 C-N-CA 121.555 1.503 . . . . 3.3 110.064 179.617 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 323' ' ' LEU . . . . . . . . . . . . . 37.4 mt -79.46 137.57 37.28 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.276 -0.89 . . . . 3.16 109.264 179.86 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 324' ' ' ASP . . . . . . . . . . . . . 5.2 m-20 -78.85 -147.99 0.04 OUTLIER 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.252 -0.905 . . . . 1.53 109.203 -179.948 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 325' ' ' GLY . . . . . . . . . . . . . . . -68.33 177.51 24.91 Favored Glycine 0 N--CA 1.488 2.15 0 N-CA-C 109.267 -1.533 . . . . 0.67 109.267 179.972 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 326' ' ' GLU . . . . . . . . . . . . . 2.9 mm-40 -57.34 -172.84 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.489 0 O-C-N 121.199 -1.177 . . . . 2.13 109.016 -179.999 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 327' ' ' TYR . . . . . 0.558 ' CE1' ' HG2' ' C' ' 333' ' ' ARG . 48.1 m-85 -148.98 102.42 3.26 Favored 'General case' 0 N--CA 1.488 1.444 0 O-C-N 121.168 -0.958 . . . . 1.0 109.395 179.985 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 328' ' ' PHE . . . . . . . . . . . . . 37.8 m-85 -106.87 -168.24 1.38 Allowed 'General case' 0 N--CA 1.489 1.479 0 O-C-N 121.406 -0.809 . . . . 0.34 109.282 -179.962 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 329' ' ' THR . . . . . . . . . . . . . 6.3 p -152.41 166.92 30.4 Favored 'General case' 0 N--CA 1.488 1.428 0 O-C-N 121.284 -0.885 . . . . 1.05 109.007 179.96 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 330' ' ' LEU . . . . . . . . . . . . . 16.9 tp -148.97 130.37 14.74 Favored 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.173 -0.954 . . . . 1.07 109.767 -179.605 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 331' ' ' GLN . . . . . . . . . . . . . 19.1 tp60 -88.42 111.78 22.17 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.326 -0.859 . . . . 0.91 109.53 179.785 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 332' ' ' ILE . . . . . . . . . . . . . 75.7 mt -103.96 111.41 33.51 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.702 0 O-C-N 121.121 -0.987 . . . . 1.09 109.603 179.836 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 333' ' ' ARG . . . . . 0.529 ' HG2' ' CE1' ' C' ' 327' ' ' TYR . 67.5 mtt180 -73.94 151.27 40.41 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.289 -0.882 . . . . 3.41 109.714 -179.983 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 334' ' ' GLY . . . . . . . . . . . . . . . 75.79 130.36 0.31 Allowed Glycine 0 N--CA 1.49 2.299 0 N-CA-C 109.545 -1.422 . . . . 0.4 109.545 179.914 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 335' ' ' ARG . . . . . 0.46 ' HB2' ' CZ ' ' C' ' 328' ' ' PHE . 33.1 ttt180 -78.21 -31.65 49.51 Favored 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.216 -1.167 . . . . 3.55 109.675 -179.819 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 336' ' ' GLU . . . . . . . . . . . . . 2.2 mt-10 -57.78 -62.01 2.11 Favored 'General case' 0 N--CA 1.493 1.675 0 O-C-N 121.19 -0.944 . . . . 2.29 109.776 -179.816 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 337' ' ' ARG . . . . . . . . . . . . . 1.9 mmt-85 -59.92 -32.05 70.42 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.238 -0.914 . . . . 3.64 109.529 -179.922 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 338' ' ' PHE . . . . . . . . . . . . . 64.5 t80 -56.44 -57.65 11.4 Favored 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.262 -0.899 . . . . 0.41 109.818 -179.991 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 339' ' ' GLU . . . . . . . . . . . . . 48.2 mt-10 -51.77 -31.92 28.86 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.231 -0.918 . . . . 1.97 109.947 -179.841 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 340' ' ' MET . . . . . . . . . . . . . 37.9 ttp -63.9 -50.66 67.88 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.239 -0.913 . . . . 1.14 109.729 -179.601 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 341' ' ' PHE . . . . . . . . . . . . . 39.2 m-85 -62.66 -41.86 99.3 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.297 -0.877 . . . . 0.21 109.949 -179.62 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 342' ' ' ARG . . . . . 0.531 ' HG2' ' NH1' ' A' ' 342' ' ' ARG . 0.1 OUTLIER -50.4 -42.43 53.63 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.093 -1.004 . . . . 3.15 109.771 -179.818 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 343' ' ' GLU . . . . . . . . . . . . . 2.3 tp10 -57.65 -45.72 85.11 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.211 -0.931 . . . . 2.35 109.705 -179.708 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 344' ' ' LEU . . . . . 0.419 ' O ' HD21 ' A' ' 348' ' ' LEU . 32.3 mt -62.36 -33.4 74.66 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.108 -0.995 . . . . 1.06 109.452 -179.973 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 345' ' ' ASN . . . . . . . . . . . . . 8.8 t-20 -56.72 -58.35 8.45 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.249 -0.907 . . . . 1.36 109.848 -179.797 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 346' ' ' GLU . . . . . . . . . . . . . 3.2 tt0 -60.42 -28.75 68.51 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.212 -0.93 . . . . 1.65 109.88 -179.539 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 347' ' ' ALA . . . . . . . . . . . . . . . -61.07 -59.84 4.72 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.122 -0.986 . . . . 1.03 110.132 -179.996 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 348' ' ' LEU . . . . . 0.419 HD21 ' O ' ' A' ' 344' ' ' LEU . 4.0 mm? -61.8 -43.74 98.26 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.27 -0.894 . . . . 1.04 110.058 -179.48 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 349' ' ' GLU . . . . . 0.42 ' OE2' ' NH1' ' C' ' 333' ' ' ARG . 1.8 mm-40 -56.7 -36.74 70.01 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.214 -0.929 . . . . 1.94 109.753 -179.393 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 350' ' ' LEU . . . . . 0.491 HD23 HD23 ' B' ' 350' ' ' LEU . 5.0 tt -63.2 -42.96 99.39 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.17 -0.956 . . . . 1.17 109.504 -179.738 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 351' ' ' LYS . . . . . . . . . . . . . 29.9 tttp -58.2 -35.55 71.8 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.142 -0.974 . . . . 1.97 109.132 179.89 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 352' ' ' ASP . . . . . . . . . . . . . 98.4 m-20 -57.07 -40.62 77.24 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.35 -0.844 . . . . 1.16 109.367 179.764 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 353' ' ' ALA . . . . . . . . . . . . . . . -67.74 -24.45 65.36 Favored 'General case' 0 N--CA 1.489 1.491 0 O-C-N 121.317 -0.865 . . . . 1.22 109.865 -179.838 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 354' ' ' GLN . . . . . . . . . . . . . 4.0 tt0 -81.02 -2.96 50.11 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.085 -1.009 . . . . 1.71 109.671 179.945 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 355' ' ' ALA . . . . . . . . . . . . . . . -69.3 -84.48 0.03 OUTLIER 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.186 -0.946 . . . . 1.3 109.432 -179.948 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 356' ' ' GLY . . . . . . . . . . . . . . . -61.17 99.06 0.19 Allowed Glycine 0 N--CA 1.491 2.343 0 N-CA-C 109.244 -1.542 . . . . 1.3 109.244 179.799 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 357' ' ' LYS . . . . . . . . . . . . . 6.4 mttm -86.46 157.36 19.82 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.342 -1.093 . . . . 4.46 109.815 -179.641 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 358' ' ' GLU . . . . . 0.485 ' HB2' ' HD2' ' A' ' 359' ' ' PRO . 15.0 pt-20 -50.76 159.74 0.89 Allowed Pre-proline 0 N--CA 1.494 1.775 0 O-C-N 121.213 -0.93 . . . . 5.75 109.631 179.921 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 359' ' ' PRO . . . . . 0.485 ' HD2' ' HB2' ' A' ' 358' ' ' GLU . 1.9 Cg_endo -63.39 -79.99 0.01 OUTLIER 'Trans proline' 0 C--N 1.313 -1.328 0 C-N-CA 122.123 1.882 . . . . 5.63 109.992 179.762 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 360' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.36 0 CA-C-O 118.016 -1.436 . . . . 6.97 109.715 -179.964 . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' B' B ' 319' ' ' LYS . . . . . . . . . . . . . 2.5 mmpp? . . . . . 0 N--CA 1.491 1.618 0 N-CA-C 109.075 -0.713 . . . . 7.95 109.075 . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' B' B ' 320' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 61.37 157.27 0.04 OUTLIER 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.392 -0.818 . . . . 6.73 109.483 -179.699 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 321' ' ' LYS . . . . . 0.592 ' CB ' ' HD3' ' B' ' 322' ' ' PRO . 0.1 OUTLIER -159.52 -65.75 0.02 OUTLIER Pre-proline 0 N--CA 1.489 1.503 0 O-C-N 121.263 -0.898 . . . . 6.5 109.748 179.699 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' B' B ' 322' ' ' PRO . . . . . 0.592 ' HD3' ' CB ' ' B' ' 321' ' ' LYS . 3.7 Cg_exo -57.52 -159.45 0.01 OUTLIER 'Trans proline' 0 C--N 1.315 -1.209 0 C-N-CA 121.714 1.609 . . . . 3.29 110.168 179.668 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 323' ' ' LEU . . . . . . . . . . . . . 37.4 mt -80.23 137.7 36.7 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.242 -0.911 . . . . 3.18 109.128 179.846 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 324' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 -79.12 -148.69 0.05 OUTLIER 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.226 -0.921 . . . . 1.53 109.358 -179.871 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 325' ' ' GLY . . . . . . . . . . . . . . . -67.16 177.71 19.23 Favored Glycine 0 N--CA 1.49 2.282 0 N-CA-C 109.22 -1.552 . . . . 0.65 109.22 179.879 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 326' ' ' GLU . . . . . . . . . . . . . 3.1 mm-40 -57.65 -172.81 0.01 OUTLIER 'General case' 0 N--CA 1.488 1.452 0 O-C-N 121.162 -1.199 . . . . 2.13 109.125 179.771 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 327' ' ' TYR . . . . . 0.549 ' CE1' ' HG2' ' D' ' 333' ' ' ARG . 48.8 m-85 -148.84 103.51 3.37 Favored 'General case' 0 N--CA 1.488 1.463 0 O-C-N 121.28 -0.887 . . . . 0.99 109.247 179.782 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 328' ' ' PHE . . . . . . . . . . . . . 38.4 m-85 -108.27 -168.79 1.41 Allowed 'General case' 0 N--CA 1.488 1.473 0 O-C-N 121.249 -0.907 . . . . 0.36 109.149 -179.998 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 329' ' ' THR . . . . . . . . . . . . . 6.7 p -151.8 167.13 29.24 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.213 -0.929 . . . . 1.05 109.27 179.985 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 330' ' ' LEU . . . . . . . . . . . . . 16.9 tp -149.08 130.65 14.89 Favored 'General case' 0 N--CA 1.488 1.437 0 O-C-N 121.15 -0.969 . . . . 1.07 109.74 -179.648 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 331' ' ' GLN . . . . . . . . . . . . . 19.6 tp60 -88.88 111.71 22.39 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.45 -0.781 . . . . 0.91 109.409 179.951 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 332' ' ' ILE . . . . . . . . . . . . . 75.5 mt -103.93 111.19 32.61 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.603 0 O-C-N 121.151 -0.968 . . . . 1.08 109.637 179.91 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 333' ' ' ARG . . . . . 0.542 ' HG2' ' CE1' ' D' ' 327' ' ' TYR . 67.5 mtt180 -73.71 151.47 40.7 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.187 -0.946 . . . . 3.42 109.648 -179.984 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 334' ' ' GLY . . . . . . . . . . . . . . . 75.79 130.17 0.3 Allowed Glycine 0 N--CA 1.491 2.316 0 N-CA-C 109.772 -1.331 . . . . 0.4 109.772 179.827 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 335' ' ' ARG . . . . . . . . . . . . . 34.8 ttt180 -78.12 -31.32 49.85 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.291 -1.123 . . . . 3.55 109.808 -179.924 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 336' ' ' GLU . . . . . . . . . . . . . 2.1 mt-10 -58.28 -61.71 2.37 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.058 -1.026 . . . . 2.28 109.789 -179.736 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 337' ' ' ARG . . . . . . . . . . . . . 1.6 mmt-85 -60.2 -31.69 70.39 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.174 -0.953 . . . . 3.64 109.601 -179.864 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 338' ' ' PHE . . . . . . . . . . . . . 64.9 t80 -56.32 -58.5 7.74 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.147 -0.97 . . . . 0.39 109.712 179.837 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 339' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -51.04 -32.07 20.55 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.172 -0.955 . . . . 1.98 109.893 -179.867 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 340' ' ' MET . . . . . . . . . . . . . 39.4 ttp -63.41 -50.95 67.83 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.095 -1.003 . . . . 1.14 109.795 -179.743 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 341' ' ' PHE . . . . . . . . . . . . . 40.1 m-85 -62.5 -41.84 99.09 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.253 -0.904 . . . . 0.22 109.99 -179.589 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 342' ' ' ARG . . . . . 0.541 ' NH1' ' HG2' ' B' ' 342' ' ' ARG . 0.1 OUTLIER -50.63 -41.86 55.56 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.153 -0.967 . . . . 3.15 109.902 -179.662 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' B' B ' 343' ' ' GLU . . . . . . . . . . . . . 2.3 tp10 -58.38 -46.22 86.79 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.162 -0.961 . . . . 2.35 109.565 -179.707 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 344' ' ' LEU . . . . . 0.428 ' O ' HD21 ' B' ' 348' ' ' LEU . 34.5 mt -61.51 -33.79 74.4 Favored 'General case' 0 N--CA 1.489 1.477 0 O-C-N 121.277 -0.889 . . . . 1.05 109.421 179.937 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 345' ' ' ASN . . . . . . . . . . . . . 9.0 t-20 -56.86 -57.5 12.23 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.235 -0.915 . . . . 1.35 110.066 -179.669 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 346' ' ' GLU . . . . . . . . . . . . . 3.2 tt0 -61.12 -28.41 69.08 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.263 -0.898 . . . . 1.66 109.697 -179.569 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 347' ' ' ALA . . . . . . . . . . . . . . . -61.28 -59.94 4.52 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.189 -0.945 . . . . 1.02 110.047 -179.785 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 348' ' ' LEU . . . . . 0.428 ' CD2' ' N ' ' B' ' 348' ' ' LEU . 4.0 mm? -61.71 -43.74 98.28 Favored 'General case' 0 N--CA 1.494 1.743 0 O-C-N 121.356 -0.84 . . . . 1.05 109.994 -179.49 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 349' ' ' GLU . . . . . . . . . . . . . 1.8 mm-40 -56.75 -36.61 69.96 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.24 -0.912 . . . . 1.95 109.958 -179.419 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 350' ' ' LEU . . . . . 0.491 HD23 HD23 ' A' ' 350' ' ' LEU . 5.0 tt -63.42 -42.88 98.72 Favored 'General case' 0 N--CA 1.489 1.484 0 O-C-N 121.108 -0.995 . . . . 1.18 109.428 -179.777 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 351' ' ' LYS . . . . . . . . . . . . . 30.4 tttp -57.96 -35.92 71.83 Favored 'General case' 0 N--CA 1.489 1.481 0 O-C-N 121.07 -1.019 . . . . 1.96 109.135 179.832 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 352' ' ' ASP . . . . . . . . . . . . . 98.4 m-20 -57.05 -40.49 76.89 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.351 -0.843 . . . . 1.16 109.403 179.8 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 353' ' ' ALA . . . . . . . . . . . . . . . -67.71 -24.54 65.4 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.308 -0.87 . . . . 1.21 109.71 -179.763 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 354' ' ' GLN . . . . . . . . . . . . . 3.8 tt0 -81.02 -3.04 50.42 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.222 -0.924 . . . . 1.69 109.704 -179.875 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 355' ' ' ALA . . . . . . . . . . . . . . . -69.06 -85.04 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.241 -0.912 . . . . 1.3 109.314 179.97 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 356' ' ' GLY . . . . . . . . . . . . . . . -60.46 99.05 0.16 Allowed Glycine 0 N--CA 1.492 2.391 0 N-CA-C 109.495 -1.442 . . . . 1.29 109.495 179.919 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 357' ' ' LYS . . . . . . . . . . . . . 5.6 mttm -86.67 156.9 19.8 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.25 -1.147 . . . . 4.45 109.848 -179.766 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 358' ' ' GLU . . . . . 0.496 ' HB2' ' HD2' ' B' ' 359' ' ' PRO . 15.6 pt-20 -50.28 159.7 0.8 Allowed Pre-proline 0 N--CA 1.49 1.526 0 O-C-N 121.316 -0.865 . . . . 5.72 109.527 179.862 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 359' ' ' PRO . . . . . 0.496 ' HD2' ' HB2' ' B' ' 358' ' ' GLU . 1.9 Cg_endo -63.3 -80.98 0.01 OUTLIER 'Trans proline' 0 C--N 1.309 -1.518 0 C-N-CA 122.241 1.961 . . . . 5.6 109.973 179.568 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 360' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.207 0 N-CA-C 109.309 -1.517 . . . . 6.98 109.309 179.973 . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' C' C ' 319' ' ' LYS . . . . . . . . . . . . . 13.2 mmtt . . . . . 0 N--CA 1.49 1.528 0 CA-C-O 121.232 0.539 . . . . 7.03 109.604 . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' C' C ' 320' ' ' LYS . . . . . . . . . . . . . 5.4 mttt 65.26 12.65 8.21 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.313 -0.867 . . . . 6.84 109.651 179.878 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' C' C ' 321' ' ' LYS . . . . . 0.513 ' CB ' ' HD2' ' C' ' 322' ' ' PRO . 0.0 OUTLIER -80.12 173.91 6.97 Favored Pre-proline 0 N--CA 1.49 1.57 0 O-C-N 121.314 -0.866 . . . . 6.78 109.109 179.913 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' C' C ' 322' ' ' PRO . . . . . 0.513 ' HD2' ' CB ' ' C' ' 321' ' ' LYS . 4.6 Cg_exo -56.99 -152.98 0.0 OUTLIER 'Trans proline' 0 C--N 1.309 -1.516 0 C-N-CA 121.983 1.789 . . . . 3.98 110.128 -179.823 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' C' C ' 323' ' ' LEU . . . . . . . . . . . . . 61.0 mt -79.16 123.69 27.63 Favored 'General case' 0 N--CA 1.489 1.525 0 O-C-N 121.217 -0.927 . . . . 4.31 109.4 -179.961 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' C' C ' 324' ' ' ASP . . . . . . . . . . . . . 11.3 m-20 -79.32 -133.41 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.327 -0.858 . . . . 1.63 109.329 -179.8 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' C' C ' 325' ' ' GLY . . . . . . . . . . . . . . . -65.99 -174.25 5.28 Favored Glycine 0 N--CA 1.49 2.275 0 N-CA-C 109.273 -1.531 . . . . 0.82 109.273 -179.958 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' C' C ' 326' ' ' GLU . . . . . . . . . . . . . 6.8 mm-40 -58.0 -179.0 0.05 OUTLIER 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.142 -1.21 . . . . 2.17 109.561 -179.788 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' C' C ' 327' ' ' TYR . . . . . 0.529 ' CE1' ' HG2' ' A' ' 333' ' ' ARG . 46.1 m-85 -148.61 107.79 3.91 Favored 'General case' 0 N--CA 1.488 1.443 0 O-C-N 121.327 -0.858 . . . . 1.03 109.267 -179.982 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' C' C ' 328' ' ' PHE . . . . . 0.46 ' CZ ' ' HB2' ' A' ' 335' ' ' ARG . 14.4 m-85 -113.66 -167.84 1.26 Allowed 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.345 -0.847 . . . . 0.37 109.433 179.914 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' C' C ' 329' ' ' THR . . . . . . . . . . . . . 29.5 p -151.46 169.54 21.78 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.341 -0.849 . . . . 1.04 109.282 -180.0 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' C' C ' 330' ' ' LEU . . . . . . . . . . . . . 28.3 tp -150.62 123.32 8.59 Favored 'General case' 0 C--N 1.304 -1.398 0 O-C-N 121.264 -0.898 . . . . 1.09 109.509 -179.787 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' C' C ' 331' ' ' GLN . . . . . . . . . . . . . 1.2 tt0 -86.71 115.56 24.23 Favored 'General case' 0 N--CA 1.489 1.48 0 O-C-N 121.317 -0.865 . . . . 1.48 108.974 179.599 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' C' C ' 332' ' ' ILE . . . . . . . . . . . . . 84.2 mt -103.2 111.78 34.24 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.511 0 O-C-N 121.178 -0.951 . . . . 1.08 109.62 -179.552 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' C' C ' 333' ' ' ARG . . . . . 0.558 ' HG2' ' CE1' ' A' ' 327' ' ' TYR . 5.6 mtp180 -73.35 144.38 46.51 Favored 'General case' 0 N--CA 1.487 1.422 0 O-C-N 121.274 -0.891 . . . . 3.36 109.443 179.8 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' C' C ' 334' ' ' GLY . . . . . . . . . . . . . . . 75.99 123.76 0.17 Allowed Glycine 0 N--CA 1.49 2.293 0 N-CA-C 109.572 -1.411 . . . . 0.35 109.572 179.864 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' C' C ' 335' ' ' ARG . . . . . 0.525 ' HG2' ' NH1' ' C' ' 335' ' ' ARG . 0.7 OUTLIER -70.59 -24.89 62.84 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.296 -1.12 . . . . 3.23 109.858 -179.728 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' C' C ' 336' ' ' GLU . . . . . . . . . . . . . 18.4 mt-10 -56.25 -67.8 0.27 Allowed 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.169 -0.957 . . . . 2.62 109.737 -179.553 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' C' C ' 337' ' ' ARG . . . . . 0.466 ' HD2' ' N ' ' C' ' 337' ' ' ARG . 11.4 mpt_? -60.11 -30.22 69.12 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.245 -0.91 . . . . 3.61 109.774 -179.823 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' C' C ' 338' ' ' PHE . . . . . . . . . . . . . 57.8 t80 -54.67 -59.75 4.29 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.325 -0.859 . . . . 0.43 109.984 -179.634 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' C' C ' 339' ' ' GLU . . . . . . . . . . . . . 14.8 mt-10 -51.14 -34.47 31.24 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.256 -0.903 . . . . 2.05 110.306 -179.567 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' C' C ' 340' ' ' MET . . . . . . . . . . . . . 53.8 ttp -63.62 -50.45 69.32 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.089 -1.007 . . . . 1.1 109.956 -179.611 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' C' C ' 341' ' ' PHE . . . . . . . . . . . . . 65.2 m-85 -61.56 -45.41 94.26 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.243 -0.911 . . . . 0.21 109.948 -179.593 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' C' C ' 342' ' ' ARG . . . . . . . . . . . . . 1.9 tmt_? -48.98 -42.69 38.61 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.282 -0.886 . . . . 3.42 110.025 -179.59 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' C' C ' 343' ' ' GLU . . . . . . . . . . . . . 28.8 tt0 -59.61 -47.04 87.13 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.153 -0.967 . . . . 2.14 110.24 -179.373 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' C' C ' 344' ' ' LEU . . . . . . . . . . . . . 73.4 mt -61.78 -34.58 76.14 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.142 -0.974 . . . . 1.09 110.218 -179.44 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' C' C ' 345' ' ' ASN . . . . . . . . . . . . . 39.1 t30 -57.64 -55.66 31.91 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.094 -1.004 . . . . 1.38 109.944 -179.526 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' C' C ' 346' ' ' GLU . . . . . 0.47 ' O ' ' HB2' ' C' ' 350' ' ' LEU . 3.5 tt0 -59.94 -27.34 66.69 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.164 -0.96 . . . . 2.21 109.638 -179.635 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' C' C ' 347' ' ' ALA . . . . . . . . . . . . . . . -62.76 -58.06 8.77 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.169 -0.957 . . . . 1.03 110.076 -179.917 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' C' C ' 348' ' ' LEU . . . . . 0.506 HD23 ' N ' ' C' ' 348' ' ' LEU . 4.2 mm? -62.52 -50.25 72.13 Favored 'General case' 0 N--CA 1.494 1.739 0 O-C-N 121.276 -0.89 . . . . 1.06 110.42 -179.289 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' C' C ' 349' ' ' GLU . . . . . . . . . . . . . 67.5 mm-40 -57.18 -33.42 67.44 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.124 -0.985 . . . . 2.19 109.831 -179.242 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' C' C ' 350' ' ' LEU . . . . . 0.523 HD23 ' CD2' ' D' ' 350' ' ' LEU . 5.4 tt -62.81 -40.22 96.71 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.236 -0.915 . . . . 1.2 109.383 -179.902 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' C' C ' 351' ' ' LYS . . . . . . . . . . . . . 1.5 tttm -62.13 -47.77 83.08 Favored 'General case' 0 N--CA 1.488 1.455 0 O-C-N 121.207 -0.933 . . . . 1.92 110.169 -179.801 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' C' C ' 352' ' ' ASP . . . . . . . . . . . . . 77.5 m-20 -51.35 -27.18 9.06 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.199 -0.938 . . . . 1.19 109.247 -179.6 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' C' C ' 353' ' ' ALA . . . . . . . . . . . . . . . -67.65 -42.95 81.42 Favored 'General case' 0 N--CA 1.488 1.469 0 O-C-N 121.323 -0.861 . . . . 1.15 109.312 179.742 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' C' C ' 354' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -80.54 1.32 30.04 Favored 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.355 -0.841 . . . . 1.7 109.667 -179.978 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' C' C ' 355' ' ' ALA . . . . . . . . . . . . . . . -67.89 -83.66 0.03 OUTLIER 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.138 -0.976 . . . . 1.3 109.096 179.842 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' C' C ' 356' ' ' GLY . . . . . . . . . . . . . . . -66.79 95.37 0.27 Allowed Glycine 0 N--CA 1.489 2.183 0 N-CA-C 109.138 -1.585 . . . . 1.33 109.138 179.67 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' C' C ' 357' ' ' LYS . . . . . . . . . . . . . 2.1 ttpt -86.72 100.84 12.77 Favored 'General case' 0 N--CA 1.488 1.444 0 O-C-N 121.234 -1.157 . . . . 4.39 109.495 -179.781 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' C' C ' 358' ' ' GLU . . . . . 0.553 ' N ' ' HD2' ' C' ' 359' ' ' PRO . 2.5 mm-40 -50.65 -55.6 25.37 Favored Pre-proline 0 N--CA 1.489 1.495 0 O-C-N 121.274 -0.891 . . . . 5.75 110.051 -179.907 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' C' C ' 359' ' ' PRO . . . . . 0.553 ' HD2' ' N ' ' C' ' 358' ' ' GLU . 2.2 Cg_endo -61.77 109.95 0.87 Allowed 'Trans proline' 0 C--N 1.311 -1.405 0 C-N-CA 121.98 1.786 . . . . 5.54 110.3 -179.822 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' C' C ' 360' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.304 0 CA-C-O 118.0 -1.445 . . . . 6.5 109.531 179.856 . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' D' D ' 319' ' ' LYS . . . . . . . . . . . . . 2.5 mmpp? . . . . . 0 N--CA 1.49 1.562 0 N-CA-C 109.11 -0.7 . . . . 7.93 109.11 . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' D' D ' 320' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 61.8 157.2 0.05 OUTLIER 'General case' 0 N--CA 1.489 1.478 0 O-C-N 121.303 -0.873 . . . . 6.7 109.529 -179.805 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' D' D ' 321' ' ' LYS . . . . . 0.6 ' CB ' ' HD3' ' D' ' 322' ' ' PRO . 0.1 OUTLIER -159.61 -65.61 0.02 OUTLIER Pre-proline 0 N--CA 1.492 1.642 0 O-C-N 121.25 -0.906 . . . . 6.49 109.686 179.666 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' D' D ' 322' ' ' PRO . . . . . 0.6 ' HD3' ' CB ' ' D' ' 321' ' ' LYS . 3.5 Cg_exo -57.82 -159.27 0.02 OUTLIER 'Trans proline' 0 C--N 1.315 -1.237 0 C-N-CA 121.539 1.492 . . . . 3.29 110.109 179.859 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' D' D ' 323' ' ' LEU . . . . . . . . . . . . . 42.0 mt -80.35 137.56 36.58 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.25 -0.906 . . . . 3.16 109.133 179.9 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' D' D ' 324' ' ' ASP . . . . . . . . . . . . . 3.8 m-20 -79.13 -148.52 0.04 OUTLIER 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.221 -0.925 . . . . 1.54 109.398 -179.827 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' D' D ' 325' ' ' GLY . . . . . . . . . . . . . . . -67.56 177.72 20.95 Favored Glycine 0 N--CA 1.49 2.262 0 N-CA-C 109.241 -1.543 . . . . 0.65 109.241 -179.887 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' D' D ' 326' ' ' GLU . . . . . . . . . . . . . 3.2 mm-40 -57.57 -173.02 0.01 OUTLIER 'General case' 0 N--CA 1.488 1.473 0 O-C-N 121.223 -1.163 . . . . 2.13 109.028 179.886 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' D' D ' 327' ' ' TYR . . . . . 0.542 ' CE1' ' HG2' ' B' ' 333' ' ' ARG . 47.2 m-85 -149.03 103.05 3.31 Favored 'General case' 0 N--CA 1.488 1.442 0 O-C-N 121.219 -0.926 . . . . 1.0 109.357 179.815 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' D' D ' 328' ' ' PHE . . . . . . . . . . . . . 39.5 m-85 -107.61 -168.5 1.39 Allowed 'General case' 0 N--CA 1.489 1.477 0 O-C-N 121.286 -0.884 . . . . 0.34 109.248 -179.953 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' D' D ' 329' ' ' THR . . . . . . . . . . . . . 7.1 p -152.04 166.97 29.95 Favored 'General case' 0 N--CA 1.488 1.457 0 O-C-N 121.259 -0.9 . . . . 1.05 109.144 179.942 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' D' D ' 330' ' ' LEU . . . . . . . . . . . . . 18.0 tp -148.9 130.75 15.16 Favored 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.184 -0.948 . . . . 1.07 109.778 -179.605 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' D' D ' 331' ' ' GLN . . . . . . . . . . . . . 19.3 tp60 -89.06 111.18 21.86 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.509 -0.744 . . . . 0.93 109.545 179.814 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' D' D ' 332' ' ' ILE . . . . . . . . . . . . . 74.0 mt -103.49 111.77 34.45 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.568 0 O-C-N 121.073 -1.017 . . . . 1.07 109.579 179.921 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' D' D ' 333' ' ' ARG . . . . . 0.549 ' HG2' ' CE1' ' B' ' 327' ' ' TYR . 68.2 mtt180 -74.07 151.56 40.14 Favored 'General case' 0 N--CA 1.488 1.451 0 O-C-N 121.221 -0.924 . . . . 3.42 109.7 179.901 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' D' D ' 334' ' ' GLY . . . . . . . . . . . . . . . 76.03 130.8 0.35 Allowed Glycine 0 N--CA 1.491 2.338 0 N-CA-C 109.663 -1.375 . . . . 0.41 109.663 179.798 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' D' D ' 335' ' ' ARG . . . . . . . . . . . . . 35.9 ttt180 -78.61 -31.99 47.31 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.309 -1.113 . . . . 3.58 109.715 -179.934 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' D' D ' 336' ' ' GLU . . . . . . . . . . . . . 2.1 mt-10 -57.44 -61.86 2.19 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.173 -0.954 . . . . 2.26 109.832 -179.732 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' D' D ' 337' ' ' ARG . . . . . . . . . . . . . 1.5 mmt-85 -60.3 -31.74 70.55 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.172 -0.955 . . . . 3.64 109.593 -179.831 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' D' D ' 338' ' ' PHE . . . . . . . . . . . . . 63.6 t80 -56.24 -58.19 9.01 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.347 -0.845 . . . . 0.4 109.739 179.898 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' D' D ' 339' ' ' GLU . . . . . . . . . . . . . 43.1 mt-10 -51.59 -31.67 25.72 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.257 -0.902 . . . . 1.99 109.901 -179.767 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' D' D ' 340' ' ' MET . . . . . . . . . . . . . 39.8 ttp -63.8 -50.68 68.02 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.244 -0.91 . . . . 1.13 109.768 -179.695 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' D' D ' 341' ' ' PHE . . . . . . . . . . . . . 40.3 m-85 -62.55 -41.92 99.2 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.234 -0.916 . . . . 0.21 110.086 -179.725 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' D' D ' 342' ' ' ARG . . . . . 0.553 ' NH1' ' HG2' ' D' ' 342' ' ' ARG . 0.2 OUTLIER -50.33 -42.56 53.03 Favored 'General case' 0 N--CA 1.492 1.675 0 O-C-N 121.125 -0.984 . . . . 3.15 109.843 -179.598 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' D' D ' 343' ' ' GLU . . . . . . . . . . . . . 2.2 tp10 -57.92 -45.65 86.2 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.239 -0.913 . . . . 2.35 109.652 -179.686 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' D' D ' 344' ' ' LEU . . . . . 0.421 ' O ' HD21 ' D' ' 348' ' ' LEU . 36.0 mt -62.04 -34.13 75.66 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.223 -0.923 . . . . 1.06 109.398 -179.956 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' D' D ' 345' ' ' ASN . . . . . . . . . . . . . 9.2 t-20 -56.54 -58.13 9.35 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.277 -0.889 . . . . 1.35 109.95 -179.876 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' D' D ' 346' ' ' GLU . . . . . . . . . . . . . 3.1 tt0 -60.19 -28.95 68.38 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.269 -0.894 . . . . 1.69 109.704 -179.484 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' D' D ' 347' ' ' ALA . . . . . . . . . . . . . . . -61.1 -59.77 4.82 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.228 -0.92 . . . . 1.03 110.108 -179.766 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' D' D ' 348' ' ' LEU . . . . . 0.425 ' CD2' ' N ' ' D' ' 348' ' ' LEU . 4.0 mm? -61.71 -44.28 97.24 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.138 -0.976 . . . . 1.04 109.959 -179.39 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' D' D ' 349' ' ' GLU . . . . . . . . . . . . . 1.8 mm-40 -56.14 -36.69 68.55 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.175 -0.953 . . . . 1.95 109.892 -179.381 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' D' D ' 350' ' ' LEU . . . . . 0.523 ' CD2' HD23 ' C' ' 350' ' ' LEU . 5.1 tt -63.34 -42.48 98.94 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.169 -0.957 . . . . 1.16 109.467 -179.716 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' D' D ' 351' ' ' LYS . . . . . . . . . . . . . 30.9 tttp -58.63 -35.79 73.05 Favored 'General case' 0 N--CA 1.489 1.486 0 O-C-N 121.135 -0.978 . . . . 1.97 109.076 179.884 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' D' D ' 352' ' ' ASP . . . . . . . . . . . . . 98.6 m-20 -56.82 -40.45 76.03 Favored 'General case' 0 N--CA 1.488 1.47 0 O-C-N 121.345 -0.847 . . . . 1.17 109.479 179.729 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' D' D ' 353' ' ' ALA . . . . . . . . . . . . . . . -68.03 -24.54 65.11 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.334 -0.854 . . . . 1.21 109.737 -179.756 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' D' D ' 354' ' ' GLN . . . . . . . . . . . . . 3.9 tt0 -80.95 -3.33 51.17 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.205 -0.934 . . . . 1.68 109.544 -179.914 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' D' D ' 355' ' ' ALA . . . . . . . . . . . . . . . -68.85 -84.9 0.02 OUTLIER 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.192 -0.942 . . . . 1.29 109.482 -179.994 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' D' D ' 356' ' ' GLY . . . . . . . . . . . . . . . -60.56 99.02 0.16 Allowed Glycine 0 N--CA 1.491 2.324 0 N-CA-C 109.292 -1.523 . . . . 1.28 109.292 -179.998 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' D' D ' 357' ' ' LYS . . . . . . . . . . . . . 4.6 mttm -87.22 156.45 19.66 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.2 -1.176 . . . . 4.45 109.908 -179.747 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' D' D ' 358' ' ' GLU . . . . . 0.48 ' HB2' ' HD2' ' D' ' 359' ' ' PRO . 16.1 pt-20 -49.6 159.39 0.7 Allowed Pre-proline 0 N--CA 1.489 1.498 0 O-C-N 121.565 -0.71 . . . . 5.71 109.781 -179.975 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' D' D ' 359' ' ' PRO . . . . . 0.48 ' HD2' ' HB2' ' D' ' 358' ' ' GLU . 1.6 Cg_endo -63.76 -80.54 0.01 OUTLIER 'Trans proline' 0 C--N 1.309 -1.546 0 C-N-CA 122.223 1.949 . . . . 5.6 109.846 179.705 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' D' D ' 360' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.305 0 CA-C-O 118.024 -1.431 . . . . 6.97 109.691 179.928 . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 319' ' ' LYS . . . . . . . . . . . . . 1.4 mtmt . . . . . 0 N--CA 1.49 1.537 0 N-CA-C 109.414 -0.588 . . . . 7.95 109.414 . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 320' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 63.01 -140.0 0.38 Allowed 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.153 -0.967 . . . . 6.71 109.58 179.884 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 321' ' ' LYS . . . . . . . . . . . . . 2.2 ttmt -155.47 103.68 2.19 Favored Pre-proline 0 N--CA 1.49 1.565 0 O-C-N 121.001 -1.062 . . . . 6.5 109.41 -179.79 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 322' ' ' PRO . . . . . . . . . . . . . 2.9 Cg_endo -69.18 5.93 1.3 Allowed 'Trans proline' 0 C--N 1.313 -1.318 0 C-N-CA 122.425 2.083 . . . . 3.3 111.494 -179.905 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 323' ' ' LEU . . . . . . . . . . . . . 11.3 mt -83.5 58.55 4.61 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 120.802 -1.186 . . . . 3.16 110.011 -179.682 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 324' ' ' ASP . . . . . . . . . . . . . 26.4 m-20 -80.83 165.5 21.8 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.061 -1.024 . . . . 1.53 109.365 179.648 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 325' ' ' GLY . . . . . . . . . . . . . . . -68.44 -179.7 19.0 Favored Glycine 0 N--CA 1.49 2.277 0 N-CA-C 109.349 -1.5 . . . . 0.67 109.349 179.924 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 326' ' ' GLU . . . . . . . . . . . . . 1.8 mm-40 -57.3 -173.19 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.219 -1.166 . . . . 2.13 109.241 179.969 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 327' ' ' TYR . . . . . 0.588 ' CE1' ' HG2' ' C' ' 333' ' ' ARG . 46.6 m-85 -149.14 105.31 3.5 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.129 -0.982 . . . . 1.0 109.767 -179.769 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 328' ' ' PHE . . . . . 0.565 ' CZ ' ' HD3' ' C' ' 335' ' ' ARG . 97.3 m-85 -112.28 -163.71 0.87 Allowed 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.388 -0.82 . . . . 0.34 109.407 179.801 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 329' ' ' THR . . . . . 0.44 ' HA ' ' O ' ' C' ' 330' ' ' LEU . 74.4 p -154.58 166.34 33.65 Favored 'General case' 0 N--CA 1.489 1.487 0 O-C-N 121.278 -0.889 . . . . 1.05 109.032 179.812 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 330' ' ' LEU . . . . . 0.411 ' O ' ' HA ' ' C' ' 329' ' ' THR . 32.9 tp -151.06 131.96 14.18 Favored 'General case' 0 N--CA 1.488 1.449 0 O-C-N 121.119 -0.988 . . . . 1.07 109.886 -179.775 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 331' ' ' GLN . . . . . . . . . . . . . 19.4 tp60 -86.87 114.84 23.85 Favored 'General case' 0 N--CA 1.488 1.449 0 O-C-N 121.318 -0.864 . . . . 0.91 109.121 179.688 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 332' ' ' ILE . . . . . 0.405 HG23 ' HA ' ' A' ' 338' ' ' PHE . 52.1 mt -103.26 107.22 21.66 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.572 0 O-C-N 121.215 -0.928 . . . . 1.09 109.659 -179.797 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 333' ' ' ARG . . . . . 0.523 ' HG2' ' CE1' ' C' ' 327' ' ' TYR . 9.9 mtp180 -72.49 140.04 48.0 Favored 'General case' 0 N--CA 1.488 1.447 0 O-C-N 121.252 -0.905 . . . . 3.41 109.45 179.897 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 334' ' ' GLY . . . . . . . . . . . . . . . 88.88 127.53 2.98 Favored Glycine 0 N--CA 1.49 2.297 0 N-CA-C 109.723 -1.351 . . . . 0.4 109.723 -179.991 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 335' ' ' ARG . . . . . 0.467 ' O ' ' HB3' ' A' ' 338' ' ' PHE . 8.0 ttt180 -78.33 -34.62 48.48 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.265 -1.138 . . . . 3.55 109.636 179.956 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 336' ' ' GLU . . . . . . . . . . . . . 9.3 tt0 -57.89 -62.33 1.89 Allowed 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.166 -0.959 . . . . 2.29 109.714 -179.862 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 337' ' ' ARG . . . . . 0.526 ' NH1' ' HG2' ' A' ' 337' ' ' ARG . 0.0 OUTLIER -60.97 -27.39 68.23 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.202 -0.936 . . . . 3.64 109.717 -179.746 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 338' ' ' PHE . . . . . 0.467 ' HB3' ' O ' ' A' ' 335' ' ' ARG . 52.0 t80 -54.08 -64.73 0.73 Allowed 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.239 -0.913 . . . . 0.41 109.651 -179.727 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 339' ' ' GLU . . . . . . . . . . . . . 43.2 mt-10 -50.62 -29.04 9.99 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.245 -0.909 . . . . 1.97 109.681 -179.739 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 340' ' ' MET . . . . . 0.433 ' HB3' ' O ' ' A' ' 337' ' ' ARG . 6.9 ttp -64.43 -52.29 58.81 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.17 -0.956 . . . . 1.14 109.851 -179.853 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 341' ' ' PHE . . . . . . . . . . . . . 40.4 m-85 -62.54 -44.61 95.93 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.313 -0.867 . . . . 0.21 110.068 -179.687 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 342' ' ' ARG . . . . . . . . . . . . . 1.8 ttp180 -49.82 -41.87 45.85 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.102 -0.999 . . . . 3.15 109.867 -179.598 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 343' ' ' GLU . . . . . . . . . . . . . 38.4 tt0 -59.06 -47.19 86.15 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.194 -0.941 . . . . 2.35 109.882 -179.697 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 344' ' ' LEU . . . . . . . . . . . . . 78.6 mt -62.71 -32.56 73.68 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.213 -0.929 . . . . 1.06 109.925 -179.65 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 345' ' ' ASN . . . . . 0.503 ' HA ' ' CZ ' ' C' ' 341' ' ' PHE . 53.8 t-20 -57.03 -56.09 26.26 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.203 -0.936 . . . . 1.36 110.064 -179.641 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 346' ' ' GLU . . . . . . . . . . . . . 3.9 tp10 -61.48 -26.79 68.13 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.145 -0.972 . . . . 1.65 110.089 -179.397 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 347' ' ' ALA . . . . . . . . . . . . . . . -61.41 -58.31 8.72 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.081 -1.012 . . . . 1.03 110.182 -179.618 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 348' ' ' LEU . . . . . 0.465 ' N ' HD23 ' A' ' 348' ' ' LEU . 4.0 mm? -62.1 -50.72 70.8 Favored 'General case' 0 N--CA 1.494 1.773 0 O-C-N 121.183 -0.948 . . . . 1.04 110.323 -179.287 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 349' ' ' GLU . . . . . . . . . . . . . 66.6 mt-10 -57.15 -30.87 64.81 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.184 -0.948 . . . . 1.94 110.055 -179.149 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 350' ' ' LEU . . . . . 0.501 HD23 HD23 ' B' ' 350' ' ' LEU . 8.9 tt -65.06 -45.59 84.68 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.147 -0.971 . . . . 1.17 109.579 -179.876 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 351' ' ' LYS . . . . . . . . . . . . . 41.1 tttm -57.35 -43.19 83.23 Favored 'General case' 0 N--CA 1.488 1.45 0 O-C-N 121.337 -0.852 . . . . 1.97 109.541 -179.441 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 352' ' ' ASP . . . . . . . . . . . . . 14.3 m-20 -55.85 -54.86 39.43 Favored 'General case' 0 N--CA 1.488 1.46 0 O-C-N 121.214 -0.929 . . . . 1.16 109.583 179.976 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 353' ' ' ALA . . . . . . . . . . . . . . . -68.47 -11.48 59.84 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.227 -0.921 . . . . 1.22 109.8 -179.832 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 354' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -84.89 -16.38 41.38 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.167 -0.958 . . . . 1.71 109.723 -179.771 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 355' ' ' ALA . . . . . . . . . . . . . . . -73.84 -18.22 60.97 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.191 -0.943 . . . . 1.3 109.52 179.989 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 356' ' ' GLY . . . . . . . . . . . . . . . -80.59 3.13 75.58 Favored Glycine 0 N--CA 1.491 2.354 0 N-CA-C 109.82 -1.312 . . . . 1.3 109.82 -179.987 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 357' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -91.63 -44.51 8.99 Favored 'General case' 0 N--CA 1.489 1.489 0 O-C-N 121.095 -1.238 . . . . 4.46 109.763 -179.729 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 358' ' ' GLU . . . . . . . . . . . . . 57.2 tt0 -48.62 134.77 13.49 Favored Pre-proline 0 N--CA 1.49 1.528 0 O-C-N 121.142 -0.974 . . . . 5.75 109.258 -179.95 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 359' ' ' PRO . . . . . . . . . . . . . 2.3 Cg_endo -62.44 -175.25 0.19 Allowed 'Trans proline' 0 C--N 1.312 -1.394 0 C-N-CA 122.008 1.806 . . . . 5.63 110.233 -179.956 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 360' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.277 0 CA-C-O 117.992 -1.449 . . . . 6.97 109.536 179.98 . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' B' B ' 319' ' ' LYS . . . . . . . . . . . . . 1.4 mtmt . . . . . 0 N--CA 1.489 1.501 0 N-CA-C 109.479 -0.563 . . . . 7.95 109.479 . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' B' B ' 320' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 63.26 -139.81 0.36 Allowed 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.253 -0.904 . . . . 6.73 109.501 179.821 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 321' ' ' LYS . . . . . . . . . . . . . 2.3 ttmt -155.68 103.64 2.15 Favored Pre-proline 0 N--CA 1.491 1.576 0 O-C-N 121.059 -1.026 . . . . 6.5 109.393 -179.879 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 322' ' ' PRO . . . . . . . . . . . . . 3.1 Cg_endo -69.18 5.96 1.29 Allowed 'Trans proline' 0 C--N 1.314 -1.239 0 C-N-CA 122.392 2.062 . . . . 3.29 111.572 -179.939 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 323' ' ' LEU . . . . . . . . . . . . . 11.3 mt -83.54 58.6 4.65 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 120.929 -1.107 . . . . 3.18 110.08 -179.692 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 324' ' ' ASP . . . . . . . . . . . . . 26.5 m-20 -81.03 164.96 22.11 Favored 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.022 -1.049 . . . . 1.53 109.27 179.743 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 325' ' ' GLY . . . . . . . . . . . . . . . -67.61 -179.7 15.0 Favored Glycine 0 N--CA 1.49 2.262 0 N-CA-C 109.447 -1.461 . . . . 0.65 109.447 179.873 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 326' ' ' GLU . . . . . . . . . . . . . 1.8 mm-40 -57.39 -173.12 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.158 -1.201 . . . . 2.13 109.204 179.83 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 327' ' ' TYR . . . . . 0.572 ' CE1' ' HG2' ' D' ' 333' ' ' ARG . 46.2 m-85 -149.18 105.26 3.49 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.096 -1.003 . . . . 0.99 109.812 -179.79 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 328' ' ' PHE . . . . . . . . . . . . . 97.2 m-85 -112.16 -163.69 0.87 Allowed 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.375 -0.828 . . . . 0.36 109.471 179.783 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 329' ' ' THR . . . . . . . . . . . . . 73.8 p -154.59 166.33 33.7 Favored 'General case' 0 N--CA 1.489 1.488 0 O-C-N 121.283 -0.886 . . . . 1.05 108.986 179.788 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 330' ' ' LEU . . . . . . . . . . . . . 32.5 tp -151.07 131.93 14.15 Favored 'General case' 0 N--CA 1.489 1.481 0 O-C-N 121.102 -0.999 . . . . 1.07 109.857 -179.809 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 331' ' ' GLN . . . . . . . . . . . . . 19.5 tp60 -86.89 114.97 23.97 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.358 -0.839 . . . . 0.91 109.081 179.688 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 332' ' ' ILE . . . . . 0.412 HG23 ' HA ' ' B' ' 338' ' ' PHE . 52.2 mt -103.38 106.9 20.99 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.58 0 O-C-N 121.248 -0.908 . . . . 1.08 109.677 -179.769 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 333' ' ' ARG . . . . . 0.482 ' HG2' ' CE1' ' D' ' 327' ' ' TYR . 9.8 mtp180 -72.22 140.05 48.49 Favored 'General case' 0 N--CA 1.489 1.497 0 O-C-N 121.259 -0.901 . . . . 3.42 109.414 179.756 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 334' ' ' GLY . . . . . . . . . . . . . . . 88.95 127.45 2.98 Favored Glycine 0 N--CA 1.491 2.361 0 N-CA-C 109.72 -1.352 . . . . 0.4 109.72 179.851 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 335' ' ' ARG . . . . . 0.465 ' O ' ' HB3' ' B' ' 338' ' ' PHE . 8.2 ttt180 -78.14 -34.77 49.65 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.303 -1.116 . . . . 3.55 109.576 179.991 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 336' ' ' GLU . . . . . . . . . . . . . 9.2 tt0 -57.79 -62.36 1.86 Allowed 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.265 -0.897 . . . . 2.28 109.771 -179.787 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 337' ' ' ARG . . . . . 0.532 ' HG2' ' NH1' ' B' ' 337' ' ' ARG . 0.0 OUTLIER -60.85 -27.55 68.19 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.258 -0.901 . . . . 3.64 109.827 -179.801 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' B' B ' 338' ' ' PHE . . . . . 0.465 ' HB3' ' O ' ' B' ' 335' ' ' ARG . 52.2 t80 -53.92 -64.87 0.69 Allowed 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.284 -0.885 . . . . 0.39 109.669 -179.772 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 339' ' ' GLU . . . . . . . . . . . . . 42.7 mt-10 -50.5 -28.94 9.36 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.256 -0.902 . . . . 1.98 109.77 -179.775 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 340' ' ' MET . . . . . 0.434 ' HB3' ' O ' ' B' ' 337' ' ' ARG . 6.9 ttp -64.54 -52.2 58.91 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.182 -0.949 . . . . 1.14 109.79 -179.8 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 341' ' ' PHE . . . . . 0.534 ' CZ ' ' HA ' ' D' ' 345' ' ' ASN . 39.9 m-85 -62.66 -44.53 96.03 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.243 -0.911 . . . . 0.22 110.019 -179.624 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 342' ' ' ARG . . . . . . . . . . . . . 1.8 ttp180 -49.93 -41.79 47.04 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.156 -0.965 . . . . 3.15 109.918 -179.618 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 343' ' ' GLU . . . . . . . . . . . . . 37.4 tt0 -59.24 -47.15 86.42 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.181 -0.949 . . . . 2.35 109.793 -179.645 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 344' ' ' LEU . . . . . . . . . . . . . 79.3 mt -62.71 -32.46 73.57 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.129 -0.982 . . . . 1.05 109.825 -179.645 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 345' ' ' ASN . . . . . 0.449 ' HA ' ' CZ ' ' D' ' 341' ' ' PHE . 54.1 t-20 -57.22 -56.04 27.0 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.22 -0.925 . . . . 1.35 110.014 -179.585 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 346' ' ' GLU . . . . . . . . . . . . . 3.9 tp10 -61.49 -26.66 68.06 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.259 -0.9 . . . . 1.66 110.011 -179.443 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 347' ' ' ALA . . . . . . . . . . . . . . . -61.53 -58.34 8.53 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.124 -0.985 . . . . 1.02 110.17 -179.623 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 348' ' ' LEU . . . . . 0.459 ' N ' HD23 ' B' ' 348' ' ' LEU . 4.0 mm? -62.11 -50.75 70.65 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.192 -0.943 . . . . 1.05 110.327 -179.267 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 349' ' ' GLU . . . . . . . . . . . . . 66.7 mt-10 -57.09 -30.93 64.75 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.185 -0.947 . . . . 1.95 110.084 -179.15 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 350' ' ' LEU . . . . . 0.501 HD23 HD23 ' A' ' 350' ' ' LEU . 8.9 tt -65.01 -45.54 85.1 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.151 -0.968 . . . . 1.18 109.601 -179.923 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 351' ' ' LYS . . . . . . . . . . . . . 40.8 tttm -57.33 -43.17 83.13 Favored 'General case' 0 N--CA 1.489 1.497 0 O-C-N 121.268 -0.895 . . . . 1.96 109.618 -179.45 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 352' ' ' ASP . . . . . . . . . . . . . 14.4 m-20 -55.91 -54.88 39.32 Favored 'General case' 0 N--CA 1.489 1.478 0 O-C-N 121.208 -0.932 . . . . 1.16 109.56 179.902 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 353' ' ' ALA . . . . . . . . . . . . . . . -68.44 -11.61 59.98 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.215 -0.928 . . . . 1.21 109.802 -179.78 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 354' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -84.62 -16.55 41.65 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.167 -0.958 . . . . 1.69 109.727 -179.779 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 355' ' ' ALA . . . . . . . . . . . . . . . -73.79 -18.22 60.99 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.231 -0.918 . . . . 1.3 109.571 179.99 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 356' ' ' GLY . . . . . . . . . . . . . . . -80.53 3.17 75.07 Favored Glycine 0 N--CA 1.492 2.379 0 N-CA-C 109.842 -1.303 . . . . 1.29 109.842 179.992 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 357' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -91.72 -44.4 9.02 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.114 -1.227 . . . . 4.45 109.669 -179.667 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 358' ' ' GLU . . . . . . . . . . . . . 56.9 tt0 -48.7 134.83 13.72 Favored Pre-proline 0 N--CA 1.491 1.586 0 O-C-N 121.047 -1.033 . . . . 5.72 109.253 -179.842 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 359' ' ' PRO . . . . . . . . . . . . . 2.2 Cg_endo -62.53 -175.25 0.19 Allowed 'Trans proline' 0 C--N 1.311 -1.437 0 C-N-CA 122.046 1.831 . . . . 5.6 110.183 -179.946 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 360' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.214 0 CA-C-O 117.944 -1.476 . . . . 6.98 109.595 -179.989 . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' C' C ' 319' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.49 1.539 0 N-CA-C 109.43 -0.582 . . . . 7.03 109.43 . . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' C' C ' 320' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 54.93 79.19 0.15 Allowed 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.233 -0.917 . . . . 6.84 109.341 -179.85 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' C' C ' 321' ' ' LYS . . . . . 0.54 ' N ' ' HD3' ' C' ' 322' ' ' PRO . 0.1 OUTLIER -156.47 57.73 1.5 Allowed Pre-proline 0 N--CA 1.49 1.541 0 O-C-N 121.377 -0.827 . . . . 6.78 109.347 179.868 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' C' C ' 322' ' ' PRO . . . . . 0.54 ' HD3' ' N ' ' C' ' 321' ' ' LYS . 1.6 Cg_endo -62.35 153.48 70.19 Favored 'Trans proline' 0 C--N 1.311 -1.435 0 C-N-CA 122.327 2.018 . . . . 3.98 110.264 -179.822 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' C' C ' 323' ' ' LEU . . . . . . . . . . . . . 30.4 mt -80.24 132.13 35.8 Favored 'General case' 0 N--CA 1.488 1.455 0 O-C-N 121.364 -0.835 . . . . 4.31 109.241 179.564 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' C' C ' 324' ' ' ASP . . . . . 0.502 ' CB ' ' OH ' ' C' ' 327' ' ' TYR . 37.0 m-20 -78.64 158.63 28.37 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.214 -0.929 . . . . 1.63 109.376 -179.917 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' C' C ' 325' ' ' GLY . . . . . . . . . . . . . . . -67.86 -172.08 6.24 Favored Glycine 0 N--CA 1.489 2.187 0 N-CA-C 109.354 -1.498 . . . . 0.82 109.354 -179.987 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' C' C ' 326' ' ' GLU . . . . . 0.462 ' OE1' ' HB2' ' A' ' 335' ' ' ARG . 2.3 mt-10 -58.11 -172.78 0.01 OUTLIER 'General case' 0 N--CA 1.488 1.463 0 O-C-N 121.235 -1.156 . . . . 2.17 109.415 -179.933 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' C' C ' 327' ' ' TYR . . . . . 0.523 ' CE1' ' HG2' ' A' ' 333' ' ' ARG . 42.6 m-85 -148.98 103.41 3.35 Favored 'General case' 0 N--CA 1.489 1.493 0 O-C-N 121.269 -0.894 . . . . 1.03 109.175 179.941 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' C' C ' 328' ' ' PHE . . . . . . . . . . . . . 52.9 m-85 -107.13 -167.41 1.27 Allowed 'General case' 0 N--CA 1.488 1.469 0 O-C-N 121.292 -0.88 . . . . 0.37 109.378 -179.944 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' C' C ' 329' ' ' THR . . . . . 0.411 ' HA ' ' O ' ' A' ' 330' ' ' LEU . 4.5 p -152.07 167.85 27.16 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.26 -0.9 . . . . 1.04 109.043 179.907 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' C' C ' 330' ' ' LEU . . . . . 0.44 ' O ' ' HA ' ' A' ' 329' ' ' THR . 27.0 tp -151.15 129.5 12.04 Favored 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.127 -0.983 . . . . 1.09 109.946 -179.525 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' C' C ' 331' ' ' GLN . . . . . 0.498 ' NE2' ' HB3' ' A' ' 327' ' ' TYR . 0.8 OUTLIER -89.41 114.91 26.43 Favored 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.3 -0.875 . . . . 1.48 109.438 179.724 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' C' C ' 332' ' ' ILE . . . . . 0.404 HG23 ' HA ' ' C' ' 338' ' ' PHE . 60.2 mt -103.76 113.29 40.23 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.622 0 O-C-N 121.11 -0.994 . . . . 1.08 109.648 179.964 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' C' C ' 333' ' ' ARG . . . . . 0.588 ' HG2' ' CE1' ' A' ' 327' ' ' TYR . 34.7 mtt180 -73.44 139.91 46.15 Favored 'General case' 0 N--CA 1.489 1.478 0 O-C-N 121.171 -0.956 . . . . 3.36 109.443 179.772 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' C' C ' 334' ' ' GLY . . . . . . . . . . . . . . . 81.43 125.64 0.75 Allowed Glycine 0 N--CA 1.491 2.325 0 N-CA-C 109.597 -1.401 . . . . 0.35 109.597 179.946 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' C' C ' 335' ' ' ARG . . . . . 0.565 ' HD3' ' CZ ' ' A' ' 328' ' ' PHE . 0.0 OUTLIER -76.57 -25.57 54.16 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.194 -1.18 . . . . 3.23 109.696 -179.986 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' C' C ' 336' ' ' GLU . . . . . . . . . . . . . 1.9 tt0 -55.85 -69.49 0.14 Allowed 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.135 -0.978 . . . . 2.62 109.72 -179.716 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' C' C ' 337' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -60.72 -23.83 65.21 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.164 -0.96 . . . . 3.61 109.566 -179.862 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' C' C ' 338' ' ' PHE . . . . . 0.436 ' HB3' ' O ' ' C' ' 335' ' ' ARG . 61.2 t80 -54.67 -59.4 4.76 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.215 -0.928 . . . . 0.43 109.491 -179.971 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' C' C ' 339' ' ' GLU . . . . . . . . . . . . . 2.1 mt-10 -52.1 -33.37 39.22 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.231 -0.918 . . . . 2.05 109.945 -179.794 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' C' C ' 340' ' ' MET . . . . . 0.464 ' HE3' ' HG ' ' A' ' 348' ' ' LEU . 41.5 ttp -63.21 -50.73 69.12 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.067 -1.021 . . . . 1.1 109.896 -179.618 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' C' C ' 341' ' ' PHE . . . . . 0.503 ' CZ ' ' HA ' ' A' ' 345' ' ' ASN . 46.9 m-85 -62.16 -50.34 72.23 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.142 -0.974 . . . . 0.21 109.785 -179.796 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' C' C ' 342' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -48.19 -42.2 29.2 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.224 -0.923 . . . . 3.42 110.068 -179.61 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' C' C ' 343' ' ' GLU . . . . . . . . . . . . . 10.2 tp10 -57.9 -48.1 80.85 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.251 -0.905 . . . . 2.14 109.618 -179.673 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' C' C ' 344' ' ' LEU . . . . . . . . . . . . . 79.6 mt -62.33 -26.51 68.47 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.292 -0.88 . . . . 1.09 109.603 -179.95 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' C' C ' 345' ' ' ASN . . . . . . . . . . . . . 56.9 t-20 -58.5 -57.63 12.11 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.288 -0.883 . . . . 1.38 110.019 -179.786 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' C' C ' 346' ' ' GLU . . . . . 0.462 ' O ' ' HG2' ' C' ' 346' ' ' GLU . 25.4 tt0 -60.96 -27.81 68.53 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.185 -0.947 . . . . 2.21 110.043 -179.415 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' C' C ' 347' ' ' ALA . . . . . . . . . . . . . . . -61.93 -58.4 8.07 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.037 -1.039 . . . . 1.03 110.276 -179.498 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' C' C ' 348' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -62.09 -48.94 77.96 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.206 -0.934 . . . . 1.06 110.538 -179.065 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' C' C ' 349' ' ' GLU . . . . . . . . . . . . . 16.5 mm-40 -57.49 -34.99 69.64 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.091 -1.005 . . . . 2.19 110.267 -179.135 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' C' C ' 350' ' ' LEU . . . . . 0.486 HD21 ' CD2' ' D' ' 350' ' ' LEU . 8.5 tt -64.48 -40.46 95.73 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.056 -1.028 . . . . 1.2 109.563 -179.794 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' C' C ' 351' ' ' LYS . . . . . . . . . . . . . 7.0 ttmt -59.33 -48.97 79.62 Favored 'General case' 0 N--CA 1.489 1.477 0 O-C-N 121.293 -0.879 . . . . 1.92 109.612 -179.837 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' C' C ' 352' ' ' ASP . . . . . . . . . . . . . 62.1 m-20 -56.94 -54.57 45.15 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.338 -0.851 . . . . 1.19 110.232 -179.732 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' C' C ' 353' ' ' ALA . . . . . . . . . . . . . . . -67.33 -10.87 55.18 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.141 -0.975 . . . . 1.15 110.063 -179.327 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' C' C ' 354' ' ' GLN . . . . . 0.416 ' O ' ' HG2' ' C' ' 354' ' ' GLN . 6.6 tt0 -84.13 -12.79 54.4 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.105 -0.997 . . . . 1.7 109.852 -179.845 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' C' C ' 355' ' ' ALA . . . . . . . . . . . . . . . -71.68 -9.39 58.18 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.106 -0.996 . . . . 1.3 109.437 179.907 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' C' C ' 356' ' ' GLY . . . . . . . . . . . . . . . -81.09 11.72 41.24 Favored Glycine 0 N--CA 1.49 2.251 0 N-CA-C 110.31 -1.116 . . . . 1.33 110.31 -179.869 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' C' C ' 357' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -85.07 98.0 10.18 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 120.897 -1.355 . . . . 4.39 109.435 -179.849 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' C' C ' 358' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -51.86 155.69 2.89 Favored Pre-proline 0 N--CA 1.49 1.538 0 O-C-N 121.499 -0.751 . . . . 5.75 110.089 -179.773 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' C' C ' 359' ' ' PRO . . . . . . . . . . . . . 2.8 Cg_endo -69.2 -0.72 6.85 Favored 'Trans proline' 0 C--N 1.312 -1.374 0 C-N-CA 122.549 2.166 . . . . 5.54 110.853 179.724 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' C' C ' 360' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.302 0 CA-C-O 117.945 -1.475 . . . . 6.5 109.622 -179.8 . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' D' D ' 319' ' ' LYS . . . . . . . . . . . . . 1.4 mtmt . . . . . 0 N--CA 1.49 1.557 0 N-CA-C 109.449 -0.574 . . . . 7.93 109.449 . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' D' D ' 320' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 63.21 -139.82 0.37 Allowed 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.222 -0.924 . . . . 6.7 109.562 179.793 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' D' D ' 321' ' ' LYS . . . . . . . . . . . . . 2.2 ttmt -155.68 103.6 2.15 Favored Pre-proline 0 N--CA 1.491 1.589 0 O-C-N 121.022 -1.049 . . . . 6.49 109.416 -179.997 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' D' D ' 322' ' ' PRO . . . . . . . . . . . . . 3.2 Cg_endo -69.27 6.21 1.23 Allowed 'Trans proline' 0 C--N 1.314 -1.277 0 C-N-CA 122.368 2.045 . . . . 3.29 111.575 -179.908 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' D' D ' 323' ' ' LEU . . . . . . . . . . . . . 11.4 mt -83.58 58.46 4.59 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 120.769 -1.207 . . . . 3.16 110.062 -179.796 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' D' D ' 324' ' ' ASP . . . . . . . . . . . . . 26.7 m-20 -80.82 165.22 22.06 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.102 -0.999 . . . . 1.54 109.287 179.716 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' D' D ' 325' ' ' GLY . . . . . . . . . . . . . . . -68.12 -179.68 17.42 Favored Glycine 0 N--CA 1.491 2.361 0 N-CA-C 109.35 -1.5 . . . . 0.65 109.35 179.958 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' D' D ' 326' ' ' GLU . . . . . . . . . . . . . 1.8 mm-40 -57.3 -173.06 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.213 -1.169 . . . . 2.13 109.243 179.892 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' D' D ' 327' ' ' TYR . . . . . 0.482 ' CE1' ' HG2' ' B' ' 333' ' ' ARG . 46.7 m-85 -149.36 105.38 3.47 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.066 -1.021 . . . . 1.0 109.924 -179.834 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' D' D ' 328' ' ' PHE . . . . . . . . . . . . . 97.1 m-85 -112.29 -163.57 0.86 Allowed 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.307 -0.871 . . . . 0.34 109.451 179.838 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' D' D ' 329' ' ' THR . . . . . . . . . . . . . 72.5 p -154.71 166.38 33.62 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.309 -0.869 . . . . 1.05 108.924 179.817 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' D' D ' 330' ' ' LEU . . . . . . . . . . . . . 32.5 tp -151.07 132.09 14.29 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.056 -1.028 . . . . 1.07 109.823 -179.782 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' D' D ' 331' ' ' GLN . . . . . . . . . . . . . 19.4 tp60 -86.96 114.98 24.04 Favored 'General case' 0 N--CA 1.489 1.488 0 O-C-N 121.37 -0.832 . . . . 0.93 109.021 179.672 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' D' D ' 332' ' ' ILE . . . . . 0.41 HG23 ' HA ' ' D' ' 338' ' ' PHE . 52.5 mt -103.43 106.87 20.96 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.542 0 O-C-N 121.209 -0.932 . . . . 1.07 109.662 -179.8 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' D' D ' 333' ' ' ARG . . . . . 0.572 ' HG2' ' CE1' ' B' ' 327' ' ' TYR . 9.9 mtp180 -72.19 140.14 48.58 Favored 'General case' 0 N--CA 1.488 1.441 0 O-C-N 121.273 -0.892 . . . . 3.42 109.393 179.824 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' D' D ' 334' ' ' GLY . . . . . . . . . . . . . . . 88.96 127.23 2.93 Favored Glycine 0 N--CA 1.492 2.414 0 N-CA-C 109.689 -1.365 . . . . 0.41 109.689 179.93 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' D' D ' 335' ' ' ARG . . . . . 0.468 ' O ' ' HB3' ' D' ' 338' ' ' PHE . 7.9 ttt180 -78.2 -34.52 49.39 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.258 -1.142 . . . . 3.58 109.63 179.947 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' D' D ' 336' ' ' GLU . . . . . . . . . . . . . 9.2 tt0 -58.05 -62.19 2.0 Allowed 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.276 -0.89 . . . . 2.26 109.659 -179.819 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' D' D ' 337' ' ' ARG . . . . . 0.528 ' NH1' ' HG2' ' D' ' 337' ' ' ARG . 0.0 OUTLIER -60.99 -27.58 68.4 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.317 -0.864 . . . . 3.64 109.706 -179.774 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' D' D ' 338' ' ' PHE . . . . . 0.468 ' HB3' ' O ' ' D' ' 335' ' ' ARG . 52.9 t80 -53.84 -64.66 0.76 Allowed 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.248 -0.907 . . . . 0.4 109.777 -179.792 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' D' D ' 339' ' ' GLU . . . . . . . . . . . . . 42.8 mt-10 -50.6 -29.17 10.24 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.25 -0.906 . . . . 1.99 109.687 -179.765 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' D' D ' 340' ' ' MET . . . . . 0.425 ' HB3' ' O ' ' D' ' 337' ' ' ARG . 7.0 ttp -64.39 -52.26 59.12 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.236 -0.915 . . . . 1.13 109.793 -179.763 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' D' D ' 341' ' ' PHE . . . . . 0.449 ' CZ ' ' HA ' ' B' ' 345' ' ' ASN . 39.8 m-85 -62.71 -44.53 95.98 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.303 -0.873 . . . . 0.21 109.991 -179.594 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' D' D ' 342' ' ' ARG . . . . . . . . . . . . . 1.9 ttp180 -49.86 -41.93 46.42 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.158 -0.964 . . . . 3.15 109.921 -179.656 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' D' D ' 343' ' ' GLU . . . . . . . . . . . . . 38.1 tt0 -59.08 -47.19 86.16 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.133 -0.98 . . . . 2.35 109.885 -179.701 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' D' D ' 344' ' ' LEU . . . . . . . . . . . . . 79.3 mt -62.66 -32.55 73.63 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.191 -0.943 . . . . 1.06 109.909 -179.717 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' D' D ' 345' ' ' ASN . . . . . 0.534 ' HA ' ' CZ ' ' B' ' 341' ' ' PHE . 53.7 t-20 -57.11 -56.12 25.94 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.283 -0.886 . . . . 1.35 110.04 -179.613 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' D' D ' 346' ' ' GLU . . . . . . . . . . . . . 4.0 tp10 -61.45 -26.51 67.93 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.152 -0.968 . . . . 1.69 110.144 -179.498 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' D' D ' 347' ' ' ALA . . . . . . . . . . . . . . . -61.57 -58.34 8.5 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.169 -0.957 . . . . 1.03 110.172 -179.566 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' D' D ' 348' ' ' LEU . . . . . 0.459 ' N ' HD23 ' D' ' 348' ' ' LEU . 4.0 mm? -62.05 -50.63 71.22 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.212 -0.93 . . . . 1.04 110.294 -179.29 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' D' D ' 349' ' ' GLU . . . . . . . . . . . . . 66.9 mt-10 -57.19 -30.99 64.98 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.135 -0.978 . . . . 1.95 110.134 -179.226 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' D' D ' 350' ' ' LEU . . . . . 0.486 ' CD2' HD21 ' C' ' 350' ' ' LEU . 8.9 tt -65.08 -45.13 86.51 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.09 -1.006 . . . . 1.16 109.675 -179.884 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' D' D ' 351' ' ' LYS . . . . . . . . . . . . . 40.9 tttm -57.74 -43.3 85.29 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.302 -0.874 . . . . 1.97 109.593 -179.643 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' D' D ' 352' ' ' ASP . . . . . . . . . . . . . 14.3 m-20 -55.81 -54.92 38.59 Favored 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.253 -0.905 . . . . 1.17 109.561 179.926 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' D' D ' 353' ' ' ALA . . . . . . . . . . . . . . . -68.45 -11.43 59.73 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.247 -0.908 . . . . 1.21 109.779 -179.872 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' D' D ' 354' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -84.86 -16.28 41.79 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.149 -0.969 . . . . 1.68 109.798 -179.826 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' D' D ' 355' ' ' ALA . . . . . . . . . . . . . . . -73.93 -18.07 60.94 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.129 -0.982 . . . . 1.29 109.542 179.947 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' D' D ' 356' ' ' GLY . . . . . . . . . . . . . . . -80.8 3.19 76.55 Favored Glycine 0 N--CA 1.49 2.278 0 N-CA-C 109.734 -1.346 . . . . 1.28 109.734 -179.863 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' D' D ' 357' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -91.6 -44.4 9.07 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.16 -1.2 . . . . 4.45 109.745 -179.746 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' D' D ' 358' ' ' GLU . . . . . . . . . . . . . 57.0 tt0 -48.6 134.68 13.45 Favored Pre-proline 0 N--CA 1.49 1.539 0 O-C-N 121.149 -0.97 . . . . 5.71 109.308 -179.928 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' D' D ' 359' ' ' PRO . . . . . . . . . . . . . 2.3 Cg_endo -62.56 -174.86 0.18 Allowed 'Trans proline' 0 C--N 1.312 -1.373 0 C-N-CA 121.879 1.72 . . . . 5.6 110.133 -179.932 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' D' D ' 360' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.243 0 N-CA-C 109.512 -1.435 . . . . 6.97 109.512 -179.97 . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 319' ' ' LYS . . . . . . . . . . . . . 1.9 tttp . . . . . 0 N--CA 1.49 1.543 0 N-CA-C 109.303 -0.629 . . . . 7.95 109.303 . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 320' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 67.84 -152.27 0.18 Allowed 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.228 -0.92 . . . . 6.71 109.739 179.577 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 321' ' ' LYS . . . . . . . . . . . . . 1.1 mttt -82.97 144.41 47.64 Favored Pre-proline 0 N--CA 1.49 1.526 0 O-C-N 121.229 -0.92 . . . . 6.5 109.664 -179.814 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 322' ' ' PRO . . . . . . . . . . . . . 1.6 Cg_endo -66.18 -81.3 0.01 OUTLIER 'Trans proline' 0 C--N 1.312 -1.344 0 C-N-CA 122.263 1.975 . . . . 3.3 109.937 179.843 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 323' ' ' LEU . . . . . . . . . . . . . 19.4 mt -81.8 124.13 29.39 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.189 -0.944 . . . . 3.16 109.452 179.766 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 324' ' ' ASP . . . . . . . . . . . . . 7.3 m-20 -81.39 -146.26 0.06 Allowed 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.218 -0.926 . . . . 1.53 109.241 179.765 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 325' ' ' GLY . . . . . . . . . . . . . . . -67.61 -177.8 11.44 Favored Glycine 0 N--CA 1.49 2.257 0 N-CA-C 109.572 -1.411 . . . . 0.67 109.572 -179.944 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 326' ' ' GLU . . . . . . . . . . . . . 3.6 mt-10 -57.62 -172.96 0.01 OUTLIER 'General case' 0 N--CA 1.488 1.47 0 O-C-N 121.294 -1.121 . . . . 2.13 109.545 -179.687 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 327' ' ' TYR . . . . . 0.448 ' CE1' ' HG2' ' C' ' 333' ' ' ARG . 47.2 m-85 -149.85 112.76 4.83 Favored 'General case' 0 N--CA 1.489 1.491 0 O-C-N 121.377 -0.827 . . . . 1.0 109.43 -179.9 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 328' ' ' PHE . . . . . 0.481 ' O ' ' OE1' ' C' ' 331' ' ' GLN . 77.4 m-85 -113.46 -170.18 1.64 Allowed 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.257 -0.902 . . . . 0.34 109.385 -179.934 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 329' ' ' THR . . . . . 0.415 ' HA ' ' O ' ' C' ' 330' ' ' LEU . 52.4 p -154.58 169.26 24.25 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.082 -1.012 . . . . 1.05 109.438 -179.775 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 330' ' ' LEU . . . . . . . . . . . . . 33.6 tp -152.12 129.09 11.01 Favored 'General case' 0 N--CA 1.488 1.474 0 O-C-N 121.081 -1.012 . . . . 1.07 110.144 -179.927 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 331' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -87.83 109.62 19.89 Favored 'General case' 0 N--CA 1.487 1.404 0 O-C-N 121.302 -0.874 . . . . 0.91 108.841 179.271 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 332' ' ' ILE . . . . . . . . . . . . . 18.3 mt -103.03 104.91 17.32 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.523 0 O-C-N 121.14 -0.975 . . . . 1.09 109.682 -179.586 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 333' ' ' ARG . . . . . 0.629 ' CG ' ' CE1' ' C' ' 327' ' ' TYR . 0.0 OUTLIER -72.01 152.92 42.1 Favored 'General case' 0 C--N 1.303 -1.455 0 O-C-N 121.564 -0.71 . . . . 3.41 109.25 179.714 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 334' ' ' GLY . . . . . . . . . . . . . . . 76.45 129.69 0.34 Allowed Glycine 0 N--CA 1.489 2.202 0 N-CA-C 109.545 -1.422 . . . . 0.4 109.545 179.997 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 335' ' ' ARG . . . . . . . . . . . . . 9.2 ttm180 -79.15 -26.0 42.82 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.317 -1.107 . . . . 3.55 109.785 -179.939 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 336' ' ' GLU . . . . . . . . . . . . . 16.3 mt-10 -57.42 -68.89 0.19 Allowed 'General case' 0 N--CA 1.495 1.786 0 O-C-N 121.225 -0.922 . . . . 2.29 109.83 -179.728 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 337' ' ' ARG . . . . . . . . . . . . . 6.1 mpt_? -59.41 -29.39 67.71 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.226 -0.921 . . . . 3.64 109.586 -179.738 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 338' ' ' PHE . . . . . . . . . . . . . 72.4 t80 -53.99 -59.6 4.43 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.431 -0.793 . . . . 0.41 109.645 -179.829 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 339' ' ' GLU . . . . . . . . . . . . . 58.9 mt-10 -50.54 -34.89 27.15 Favored 'General case' 0 N--CA 1.488 1.473 0 O-C-N 121.197 -0.939 . . . . 1.97 110.181 -179.456 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 340' ' ' MET . . . . . . . . . . . . . 52.9 ttp -64.2 -50.08 69.5 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.193 -0.942 . . . . 1.14 110.408 -179.288 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 341' ' ' PHE . . . . . . . . . . . . . 55.6 m-85 -62.08 -39.95 94.17 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.238 -0.914 . . . . 0.21 109.996 -179.344 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 342' ' ' ARG . . . . . . . . . . . . . 31.8 ttt180 -51.41 -47.59 62.91 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.182 -0.949 . . . . 3.15 110.175 -179.5 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 343' ' ' GLU . . . . . . . . . . . . . 9.4 tp10 -60.13 -43.02 96.0 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 120.992 -1.067 . . . . 2.35 110.201 -179.379 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 344' ' ' LEU . . . . . . . . . . . . . 52.7 mt -61.28 -37.04 81.72 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.085 -1.01 . . . . 1.06 110.03 -179.416 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 345' ' ' ASN . . . . . . . . . . . . . 46.4 t-20 -58.24 -53.27 60.16 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.166 -0.959 . . . . 1.36 109.8 -179.786 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 346' ' ' GLU . . . . . . . . . . . . . 1.2 tt0 -61.29 -30.95 70.79 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.208 -0.932 . . . . 1.65 109.768 -179.674 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 347' ' ' ALA . . . . . . . . . . . . . . . -61.59 -57.59 11.47 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.236 -0.915 . . . . 1.03 110.245 -179.501 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 348' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -61.56 -44.78 96.4 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.147 -0.97 . . . . 1.04 110.04 -179.324 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 349' ' ' GLU . . . . . . . . . . . . . 76.0 mt-10 -57.99 -35.21 70.9 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.228 -0.92 . . . . 1.94 109.95 -179.496 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 350' ' ' LEU . . . . . 0.529 HD21 ' CD1' ' B' ' 350' ' ' LEU . 6.8 tt -63.89 -48.39 76.82 Favored 'General case' 0 C--N 1.302 -1.474 0 O-C-N 121.098 -1.001 . . . . 1.17 109.593 -179.623 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 351' ' ' LYS . . . . . . . . . . . . . 43.4 tttm -59.11 -42.03 89.59 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.307 -0.87 . . . . 1.97 109.664 -179.794 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 352' ' ' ASP . . . . . 0.515 ' OD2' ' CZ ' ' C' ' 337' ' ' ARG . 1.0 OUTLIER -58.51 -38.96 78.81 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.084 -1.01 . . . . 1.16 109.742 -179.896 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 353' ' ' ALA . . . . . . . . . . . . . . . -67.19 -21.72 65.76 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.289 -0.882 . . . . 1.22 109.94 -179.483 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 354' ' ' GLN . . . . . . . . . . . . . 9.3 mt-30 -83.06 -15.58 50.38 Favored 'General case' 0 N--CA 1.489 1.489 0 O-C-N 121.174 -0.953 . . . . 1.71 109.361 179.903 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 355' ' ' ALA . . . . . . . . . . . . . . . -74.0 -2.4 24.02 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.185 -0.947 . . . . 1.3 109.571 179.623 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 356' ' ' GLY . . . . . . . . . . . . . . . -79.29 -8.01 88.08 Favored Glycine 0 N--CA 1.49 2.286 0 N-CA-C 109.643 -1.383 . . . . 1.3 109.643 -179.767 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 357' ' ' LYS . . . . . . . . . . . . . 32.5 mttp -87.18 134.7 33.5 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.282 -1.128 . . . . 4.46 108.709 179.487 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 358' ' ' GLU . . . . . 0.417 ' CG ' ' HD2' ' A' ' 359' ' ' PRO . 0.0 OUTLIER -48.47 157.84 0.67 Allowed Pre-proline 0 N--CA 1.49 1.535 0 O-C-N 121.104 -0.997 . . . . 5.75 109.781 -179.54 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 359' ' ' PRO . . . . . 0.417 ' HD2' ' CG ' ' A' ' 358' ' ' GLU . 2.4 Cg_endo -62.17 -177.76 0.29 Allowed 'Trans proline' 0 C--N 1.31 -1.495 0 C-N-CA 122.34 2.027 . . . . 5.63 110.043 179.662 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 360' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.312 0 CA-C-O 118.041 -1.421 . . . . 6.97 109.724 179.958 . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' B' B ' 319' ' ' LYS . . . . . . . . . . . . . 2.6 tttp . . . . . 0 N--CA 1.492 1.673 0 N-CA-C 109.55 -0.537 . . . . 7.95 109.55 . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' B' B ' 320' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 62.85 -152.1 0.34 Allowed 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.313 -0.867 . . . . 6.73 109.914 179.867 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 321' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -82.55 145.42 51.16 Favored Pre-proline 0 N--CA 1.491 1.587 0 O-C-N 121.377 -0.827 . . . . 6.5 109.679 -179.859 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 322' ' ' PRO . . . . . . . . . . . . . 2.6 Cg_endo -66.64 -81.25 0.01 OUTLIER 'Trans proline' 0 C--N 1.309 -1.503 0 C-N-CA 122.312 2.008 . . . . 3.29 109.892 179.836 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 323' ' ' LEU . . . . . . . . . . . . . 20.7 mt -80.98 123.37 28.28 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.291 -0.881 . . . . 3.18 109.685 179.905 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 324' ' ' ASP . . . . . . . . . . . . . 5.0 m-20 -81.62 -149.21 0.07 Allowed 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.282 -0.887 . . . . 1.53 109.195 179.596 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 325' ' ' GLY . . . . . . . . . . . . . . . -65.12 -177.67 6.33 Favored Glycine 0 N--CA 1.489 2.208 0 N-CA-C 109.628 -1.389 . . . . 0.65 109.628 -179.941 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 326' ' ' GLU . . . . . . . . . . . . . 3.8 mt-10 -57.93 -173.34 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.389 -1.065 . . . . 2.13 109.619 -179.78 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 327' ' ' TYR . . . . . 0.583 ' CE1' ' CG ' ' D' ' 333' ' ' ARG . 44.7 m-85 -149.55 112.11 4.75 Favored 'General case' 0 N--CA 1.488 1.443 0 O-C-N 121.105 -0.997 . . . . 0.99 109.651 -179.907 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 328' ' ' PHE . . . . . . . . . . . . . 80.4 m-85 -113.02 -170.88 1.76 Allowed 'General case' 0 C--N 1.303 -1.444 0 O-C-N 121.27 -0.894 . . . . 0.36 109.462 -179.67 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 329' ' ' THR . . . . . 0.406 ' HA ' ' O ' ' D' ' 330' ' ' LEU . 43.6 p -153.61 169.83 22.3 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.25 -0.906 . . . . 1.05 109.381 -179.689 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 330' ' ' LEU . . . . . . . . . . . . . 32.8 tp -152.7 128.83 10.43 Favored 'General case' 0 N--CA 1.489 1.479 0 O-C-N 121.021 -1.049 . . . . 1.07 110.198 -179.991 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 331' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -87.58 109.89 19.97 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.404 -0.81 . . . . 0.91 108.863 179.131 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 332' ' ' ILE . . . . . 0.415 HG23 ' HA ' ' B' ' 338' ' ' PHE . 20.4 mt -103.24 105.23 17.9 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.488 0 O-C-N 121.157 -0.964 . . . . 1.08 109.876 -179.63 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 333' ' ' ARG . . . . . 0.577 ' CG ' ' CE1' ' D' ' 327' ' ' TYR . 0.0 OUTLIER -72.46 151.86 42.29 Favored 'General case' 0 N--CA 1.489 1.486 0 O-C-N 121.324 -0.86 . . . . 3.42 109.241 179.735 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' B' B ' 334' ' ' GLY . . . . . . . . . . . . . . . 77.57 128.86 0.42 Allowed Glycine 0 N--CA 1.489 2.175 0 N-CA-C 109.837 -1.305 . . . . 0.4 109.837 179.935 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 335' ' ' ARG . . . . . . . . . . . . . 9.3 ttm180 -78.89 -27.05 43.91 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.473 -1.016 . . . . 3.55 109.739 -179.917 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 336' ' ' GLU . . . . . . . . . . . . . 18.1 mt-10 -57.48 -68.21 0.26 Allowed 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.205 -0.935 . . . . 2.28 109.805 -179.632 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 337' ' ' ARG . . . . . . . . . . . . . 5.7 mpt_? -60.13 -29.42 68.62 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.251 -0.906 . . . . 3.64 109.584 -179.844 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 338' ' ' PHE . . . . . 0.415 ' HA ' HG23 ' B' ' 332' ' ' ILE . 69.1 t80 -54.03 -58.25 8.02 Favored 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.317 -0.864 . . . . 0.39 109.608 -179.774 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 339' ' ' GLU . . . . . . . . . . . . . 58.0 mt-10 -51.44 -34.43 35.12 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.381 -0.824 . . . . 1.98 110.2 -179.594 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 340' ' ' MET . . . . . . . . . . . . . 52.0 ttp -65.05 -49.74 68.9 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.204 -0.935 . . . . 1.14 110.485 -179.258 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 341' ' ' PHE . . . . . . . . . . . . . 56.4 m-85 -62.1 -40.43 95.85 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.144 -0.972 . . . . 0.22 109.942 -179.343 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 342' ' ' ARG . . . . . . . . . . . . . 23.8 ttt180 -50.66 -47.51 58.62 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.217 -0.927 . . . . 3.15 110.18 -179.596 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 343' ' ' GLU . . . . . . . . . . . . . 11.8 tp10 -59.96 -42.42 94.07 Favored 'General case' 0 N--CA 1.494 1.759 0 O-C-N 121.218 -0.927 . . . . 2.35 110.142 -179.304 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 344' ' ' LEU . . . . . . . . . . . . . 45.2 mt -62.21 -37.1 84.06 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.106 -0.996 . . . . 1.05 110.039 -179.5 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 345' ' ' ASN . . . . . . . . . . . . . 50.8 t-20 -58.17 -53.58 56.61 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.155 -0.965 . . . . 1.35 110.008 -179.618 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 346' ' ' GLU . . . . . . . . . . . . . 1.2 tt0 -61.27 -31.2 71.02 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.249 -0.907 . . . . 1.66 109.789 -179.611 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 347' ' ' ALA . . . . . . . . . . . . . . . -61.14 -57.67 11.54 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.216 -0.928 . . . . 1.02 110.308 -179.525 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 348' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -60.96 -45.16 95.84 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.257 -0.902 . . . . 1.05 110.127 -179.412 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 349' ' ' GLU . . . . . . . . . . . . . 77.9 mt-10 -57.99 -35.36 71.1 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.11 -0.994 . . . . 1.95 110.056 -179.482 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 350' ' ' LEU . . . . . 0.529 ' CD1' HD21 ' A' ' 350' ' ' LEU . 6.9 tt -63.28 -48.29 78.74 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.145 -0.972 . . . . 1.18 109.451 -179.828 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 351' ' ' LYS . . . . . . . . . . . . . 45.9 tttm -59.24 -42.34 90.87 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.275 -0.89 . . . . 1.96 109.835 -179.734 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 352' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -58.63 -37.88 76.87 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.167 -0.958 . . . . 1.16 109.668 -179.982 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 353' ' ' ALA . . . . . . . . . . . . . . . -67.84 -22.17 65.15 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.362 -0.836 . . . . 1.21 109.728 -179.386 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 354' ' ' GLN . . . . . . . . . . . . . 8.5 mt-30 -82.99 -15.69 50.19 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.148 -0.97 . . . . 1.69 109.471 -179.844 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 355' ' ' ALA . . . . . . . . . . . . . . . -73.72 -2.52 23.66 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.213 -0.93 . . . . 1.3 109.737 179.873 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 356' ' ' GLY . . . . . . . . . . . . . . . -79.77 -7.95 88.09 Favored Glycine 0 N--CA 1.491 2.359 0 N-CA-C 109.705 -1.358 . . . . 1.29 109.705 -179.747 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 357' ' ' LYS . . . . . . . . . . . . . 32.1 mttp -86.8 135.82 33.21 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.175 -1.191 . . . . 4.45 109.006 179.459 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 358' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -47.78 157.37 0.61 Allowed Pre-proline 0 N--CA 1.491 1.625 0 O-C-N 121.158 -0.964 . . . . 5.72 109.683 -179.597 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 359' ' ' PRO . . . . . . . . . . . . . 2.4 Cg_endo -62.27 -177.76 0.3 Allowed 'Trans proline' 0 C--N 1.311 -1.41 0 C-N-CA 122.316 2.01 . . . . 5.6 109.842 179.951 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 360' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.172 0 N-CA-C 109.332 -1.507 . . . . 6.98 109.332 179.989 . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' C' C ' 319' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.491 1.583 0 CA-C-O 121.345 0.593 . . . . 7.03 109.661 . . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' C' C ' 320' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -81.45 168.9 17.8 Favored 'General case' 0 N--CA 1.488 1.456 0 O-C-N 121.296 -0.877 . . . . 6.84 109.229 179.816 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' C' C ' 321' ' ' LYS . . . . . 0.405 ' O ' ' O ' ' C' ' 322' ' ' PRO . 0.0 OUTLIER -157.71 87.44 2.54 Favored Pre-proline 0 C--N 1.301 -1.53 0 O-C-N 121.416 -0.802 . . . . 6.78 109.101 179.89 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' C' C ' 322' ' ' PRO . . . . . 0.405 ' O ' ' O ' ' C' ' 321' ' ' LYS . 5.0 Cg_exo -58.1 -151.71 0.01 OUTLIER 'Trans proline' 0 C--N 1.308 -1.553 0 C-N-CA 122.065 1.843 . . . . 3.98 109.953 -179.995 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' C' C ' 323' ' ' LEU . . . . . . . . . . . . . 14.3 mt -78.96 141.37 37.59 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.163 -0.961 . . . . 4.31 109.446 -179.974 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' C' C ' 324' ' ' ASP . . . . . 0.521 ' CB ' ' OH ' ' C' ' 327' ' ' TYR . 4.5 m-20 -78.73 155.49 29.35 Favored 'General case' 0 N--CA 1.489 1.495 0 O-C-N 121.279 -0.888 . . . . 1.63 109.563 -179.662 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' C' C ' 325' ' ' GLY . . . . . 0.438 ' O ' ' O ' ' C' ' 326' ' ' GLU . . . -67.55 -177.18 10.17 Favored Glycine 0 N--CA 1.49 2.29 0 N-CA-C 109.106 -1.598 . . . . 0.82 109.106 179.704 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' C' C ' 326' ' ' GLU . . . . . 0.438 ' O ' ' O ' ' C' ' 325' ' ' GLY . 16.7 mt-10 -55.98 -168.98 0.0 OUTLIER 'General case' 0 N--CA 1.489 1.475 0 O-C-N 121.079 -1.248 . . . . 2.17 108.884 179.862 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' C' C ' 327' ' ' TYR . . . . . 0.629 ' CE1' ' CG ' ' A' ' 333' ' ' ARG . 43.8 m-85 -149.72 113.63 5.1 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.025 -1.047 . . . . 1.03 109.827 -179.824 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' C' C ' 328' ' ' PHE . . . . . . . . . . . . . 97.6 m-85 -113.03 -166.53 1.09 Allowed 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.162 -0.961 . . . . 0.37 109.726 179.718 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' C' C ' 329' ' ' THR . . . . . . . . . . . . . 27.2 p -153.32 167.14 30.37 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.212 -0.93 . . . . 1.04 109.564 -179.721 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' C' C ' 330' ' ' LEU . . . . . 0.415 ' O ' ' HA ' ' A' ' 329' ' ' THR . 18.4 tp -150.26 124.93 9.72 Favored 'General case' 0 N--CA 1.488 1.43 0 O-C-N 121.194 -0.941 . . . . 1.09 109.707 -179.727 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' C' C ' 331' ' ' GLN . . . . . 0.481 ' OE1' ' O ' ' A' ' 328' ' ' PHE . 7.2 tp-100 -89.23 109.01 19.94 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.245 -0.91 . . . . 1.48 109.14 179.794 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' C' C ' 332' ' ' ILE . . . . . . . . . . . . . 93.9 mt -102.78 113.75 40.35 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.647 0 O-C-N 121.081 -1.012 . . . . 1.08 109.737 -179.722 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' C' C ' 333' ' ' ARG . . . . . 0.448 ' HG2' ' CE1' ' A' ' 327' ' ' TYR . 0.6 OUTLIER -73.53 148.75 42.77 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.295 -0.878 . . . . 3.36 109.6 179.81 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' C' C ' 334' ' ' GLY . . . . . . . . . . . . . . . 70.89 134.57 0.11 Allowed Glycine 0 N--CA 1.492 2.385 0 N-CA-C 109.677 -1.369 . . . . 0.35 109.677 179.958 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' C' C ' 335' ' ' ARG . . . . . 0.551 ' HG2' ' NH1' ' C' ' 335' ' ' ARG . 0.0 OUTLIER -75.34 -26.33 58.51 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.329 -1.1 . . . . 3.23 109.622 -179.985 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' C' C ' 336' ' ' GLU . . . . . . . . . . . . . 9.2 tt0 -54.2 -65.06 0.64 Allowed 'General case' 0 C--N 1.301 -1.535 0 O-C-N 121.192 -0.943 . . . . 2.62 109.561 -179.509 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' C' C ' 337' ' ' ARG . . . . . 0.515 ' CZ ' ' OD2' ' A' ' 352' ' ' ASP . 2.0 mpt_? -59.58 -28.45 67.16 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.259 -0.9 . . . . 3.61 109.206 179.874 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' C' C ' 338' ' ' PHE . . . . . 0.468 ' HB3' ' O ' ' C' ' 335' ' ' ARG . 84.5 t80 -56.53 -64.54 0.83 Allowed 'General case' 0 N--CA 1.489 1.5 0 O-C-N 121.451 -0.781 . . . . 0.43 110.026 -179.813 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' C' C ' 339' ' ' GLU . . . . . 0.442 ' OE2' ' HG2' ' C' ' 335' ' ' ARG . 10.6 mt-10 -48.66 -37.0 17.24 Favored 'General case' 0 N--CA 1.495 1.802 0 O-C-N 121.132 -0.98 . . . . 2.05 110.398 -179.45 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' C' C ' 340' ' ' MET . . . . . . . . . . . . . 30.9 ttp -61.46 -49.63 76.04 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.054 -1.029 . . . . 1.1 109.727 -179.542 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' C' C ' 341' ' ' PHE . . . . . . . . . . . . . 44.2 m-85 -64.16 -41.1 97.29 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.207 -0.933 . . . . 0.21 110.161 -179.79 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' C' C ' 342' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -52.47 -48.02 66.15 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.258 -0.901 . . . . 3.42 110.032 -179.63 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' C' C ' 343' ' ' GLU . . . . . . . . . . . . . 14.4 tt0 -57.76 -45.93 85.23 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.345 -0.847 . . . . 2.14 110.063 -179.593 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' C' C ' 344' ' ' LEU . . . . . 0.466 ' O ' HD21 ' C' ' 348' ' ' LEU . 94.6 mt -63.06 -33.69 75.98 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.09 -1.006 . . . . 1.09 109.693 -179.729 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' C' C ' 345' ' ' ASN . . . . . . . . . . . . . 50.5 t-20 -59.48 -56.82 17.11 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.126 -0.984 . . . . 1.38 109.498 -179.995 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' C' C ' 346' ' ' GLU . . . . . . . . . . . . . 5.9 tp10 -61.97 -26.71 68.37 Favored 'General case' 0 C--N 1.302 -1.475 0 O-C-N 121.202 -0.936 . . . . 2.21 109.515 179.942 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' C' C ' 347' ' ' ALA . . . . . 0.434 ' HB3' ' HB2' ' D' ' 347' ' ' ALA . . . -64.07 -61.27 2.37 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.214 -0.929 . . . . 1.03 110.041 -179.799 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' C' C ' 348' ' ' LEU . . . . . 0.527 HD23 ' N ' ' C' ' 348' ' ' LEU . 3.9 mm? -60.5 -50.53 73.18 Favored 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.319 -0.863 . . . . 1.06 110.241 -179.051 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' C' C ' 349' ' ' GLU . . . . . . . . . . . . . 16.0 mm-40 -58.87 -34.52 71.71 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.233 -0.917 . . . . 2.19 109.998 -179.406 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' C' C ' 350' ' ' LEU . . . . . 0.529 ' CD2' HD21 ' D' ' 350' ' ' LEU . 3.5 tt -64.66 -37.97 89.39 Favored 'General case' 0 C--N 1.302 -1.493 0 O-C-N 121.049 -1.032 . . . . 1.2 109.378 -179.942 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' C' C ' 351' ' ' LYS . . . . . 0.435 ' HE2' ' OE2' ' D' ' 343' ' ' GLU . 11.3 tttp -58.55 -40.2 82.37 Favored 'General case' 0 N--CA 1.488 1.455 0 O-C-N 121.254 -0.904 . . . . 1.92 108.884 179.752 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' C' C ' 352' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 -56.63 -43.75 80.57 Favored 'General case' 0 C--N 1.304 -1.403 0 O-C-N 121.432 -0.792 . . . . 1.19 109.423 179.612 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' C' C ' 353' ' ' ALA . . . . . . . . . . . . . . . -69.59 -22.4 63.52 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.379 -0.825 . . . . 1.15 110.047 -179.764 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' C' C ' 354' ' ' GLN . . . . . . . . . . . . . 8.3 tt0 -82.4 -6.5 59.32 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.108 -0.995 . . . . 1.7 109.684 -179.675 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' C' C ' 355' ' ' ALA . . . . . . . . . . . . . . . -70.04 -38.36 75.81 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.223 -0.923 . . . . 1.3 109.398 179.977 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' C' C ' 356' ' ' GLY . . . . . . . . . . . . . . . -80.77 7.27 59.3 Favored Glycine 0 N--CA 1.492 2.39 0 N-CA-C 110.351 -1.1 . . . . 1.33 110.351 -179.675 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' C' C ' 357' ' ' LYS . . . . . 0.454 ' O ' ' HD3' ' C' ' 359' ' ' PRO . 11.4 mmtm -84.28 -172.05 3.95 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 120.917 -1.343 . . . . 4.39 109.571 -179.705 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' C' C ' 358' ' ' GLU . . . . . . . . . . . . . 24.3 mt-10 -47.81 106.77 0.64 Allowed Pre-proline 0 N--CA 1.49 1.53 0 O-C-N 121.296 -0.877 . . . . 5.75 109.537 -179.83 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' C' C ' 359' ' ' PRO . . . . . 0.454 ' HD3' ' O ' ' C' ' 357' ' ' LYS . 4.9 Cg_exo -60.47 -151.9 0.01 OUTLIER 'Trans proline' 0 C--N 1.31 -1.45 0 C-N-CA 122.114 1.876 . . . . 5.54 110.085 179.927 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' C' C ' 360' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.21 0 N-CA-C 109.53 -1.428 . . . . 6.5 109.53 -179.955 . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' D' D ' 319' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 N--CA 1.489 1.508 0 N-CA-C 109.469 -0.567 . . . . 7.93 109.469 . . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' D' D ' 320' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 62.94 -153.92 0.34 Allowed 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.096 -1.002 . . . . 6.7 109.502 -179.999 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' D' D ' 321' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -81.01 146.51 59.24 Favored Pre-proline 0 N--CA 1.491 1.61 0 O-C-N 121.258 -0.901 . . . . 6.49 109.504 -179.937 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' D' D ' 322' ' ' PRO . . . . . . . . . . . . . 1.8 Cg_endo -67.37 -81.04 0.01 OUTLIER 'Trans proline' 0 C--N 1.308 -1.563 0 C-N-CA 122.309 2.006 . . . . 3.29 109.543 179.649 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' D' D ' 323' ' ' LEU . . . . . . . . . . . . . 17.1 mt -80.53 123.62 28.25 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.414 -0.804 . . . . 3.16 109.867 -179.85 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' D' D ' 324' ' ' ASP . . . . . . . . . . . . . 4.1 m-20 -81.55 -147.43 0.07 Allowed 'General case' 0 N--CA 1.488 1.451 0 O-C-N 121.301 -0.874 . . . . 1.54 109.198 179.547 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' D' D ' 325' ' ' GLY . . . . . . . . . . . . . . . -67.67 -175.2 8.26 Favored Glycine 0 N--CA 1.49 2.257 0 N-CA-C 109.737 -1.345 . . . . 0.65 109.737 -179.706 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' D' D ' 326' ' ' GLU . . . . . . . . . . . . . 3.4 mt-10 -58.65 -175.02 0.02 OUTLIER 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.325 -1.103 . . . . 2.13 109.765 -179.866 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' D' D ' 327' ' ' TYR . . . . . 0.577 ' CE1' ' CG ' ' B' ' 333' ' ' ARG . 44.6 m-85 -149.03 112.26 4.94 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.446 -0.784 . . . . 1.0 109.476 -179.937 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' D' D ' 328' ' ' PHE . . . . . . . . . . . . . 83.0 m-85 -113.49 -170.85 1.77 Allowed 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.317 -0.864 . . . . 0.34 109.426 -179.841 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' D' D ' 329' ' ' THR . . . . . . . . . . . . . 38.6 p -153.4 169.37 23.3 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.241 -0.912 . . . . 1.05 109.598 -179.864 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' D' D ' 330' ' ' LEU . . . . . 0.406 ' O ' ' HA ' ' B' ' 329' ' ' THR . 33.5 tp -152.56 128.89 10.56 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.228 -0.92 . . . . 1.07 110.267 179.968 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' D' D ' 331' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -88.27 109.21 19.77 Favored 'General case' 0 N--CA 1.491 1.602 0 N-CA-C 108.806 -0.813 . . . . 0.93 108.806 179.125 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' D' D ' 332' ' ' ILE . . . . . 0.444 HG23 ' HA ' ' D' ' 338' ' ' PHE . 20.2 mt -102.18 104.98 17.24 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.495 0 O-C-N 121.146 -0.971 . . . . 1.07 109.817 -179.646 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' D' D ' 333' ' ' ARG . . . . . 0.583 ' CG ' ' CE1' ' B' ' 327' ' ' TYR . 0.0 OUTLIER -72.23 151.87 42.58 Favored 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.323 -0.861 . . . . 3.42 109.141 179.553 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' D' D ' 334' ' ' GLY . . . . . . . . . . . . . . . 78.23 128.57 0.48 Allowed Glycine 0 N--CA 1.49 2.258 0 N-CA-C 109.689 -1.365 . . . . 0.41 109.689 179.963 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' D' D ' 335' ' ' ARG . . . . . . . . . . . . . 8.8 ttm180 -78.99 -28.25 43.45 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.414 -1.05 . . . . 3.58 109.858 -179.903 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' D' D ' 336' ' ' GLU . . . . . . . . . . . . . 12.8 mt-10 -57.08 -68.05 0.26 Allowed 'General case' 0 N--CA 1.495 1.786 0 O-C-N 121.301 -0.874 . . . . 2.26 109.772 -179.551 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' D' D ' 337' ' ' ARG . . . . . . . . . . . . . 5.8 mpt_? -59.87 -29.98 68.69 Favored 'General case' 0 N--CA 1.488 1.446 0 O-C-N 121.271 -0.893 . . . . 3.64 109.665 -179.81 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' D' D ' 338' ' ' PHE . . . . . 0.444 ' HA ' HG23 ' D' ' 332' ' ' ILE . 70.5 t80 -54.09 -58.59 6.76 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.256 -0.902 . . . . 0.4 109.566 -179.88 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' D' D ' 339' ' ' GLU . . . . . . . . . . . . . 55.3 mt-10 -51.05 -34.81 31.39 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.333 -0.854 . . . . 1.99 110.059 -179.721 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' D' D ' 340' ' ' MET . . . . . . . . . . . . . 51.9 ttp -64.64 -49.42 71.11 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.156 -0.965 . . . . 1.13 110.26 -179.116 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' D' D ' 341' ' ' PHE . . . . . . . . . . . . . 55.8 m-85 -62.25 -42.82 99.66 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.073 -1.017 . . . . 0.21 110.125 -179.403 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' D' D ' 342' ' ' ARG . . . . . . . . . . . . . 23.2 ttt180 -48.8 -47.03 42.43 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.183 -0.948 . . . . 3.15 110.166 -179.705 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' D' D ' 343' ' ' GLU . . . . . 0.435 ' OE2' ' HE2' ' C' ' 351' ' ' LYS . 13.9 tp10 -60.05 -42.8 95.26 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.04 -1.038 . . . . 2.35 110.012 -179.447 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' D' D ' 344' ' ' LEU . . . . . . . . . . . . . 38.0 mt -61.68 -37.38 83.9 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.128 -0.982 . . . . 1.06 109.956 -179.476 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' D' D ' 345' ' ' ASN . . . . . . . . . . . . . 51.5 t-20 -58.17 -52.6 64.89 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.071 -1.018 . . . . 1.35 109.935 -179.539 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' D' D ' 346' ' ' GLU . . . . . . . . . . . . . 1.3 tt0 -61.44 -32.11 72.07 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.21 -0.931 . . . . 1.69 109.862 -179.65 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' D' D ' 347' ' ' ALA . . . . . 0.434 ' HB2' ' HB3' ' C' ' 347' ' ' ALA . . . -60.87 -57.73 11.43 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.219 -0.926 . . . . 1.03 110.249 -179.7 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' D' D ' 348' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -60.99 -44.24 97.69 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.077 -1.014 . . . . 1.04 110.038 -179.301 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' D' D ' 349' ' ' GLU . . . . . . . . . . . . . 71.8 mt-10 -58.51 -35.01 71.59 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.043 -1.036 . . . . 1.95 110.075 -179.32 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' D' D ' 350' ' ' LEU . . . . . 0.529 HD21 ' CD2' ' C' ' 350' ' ' LEU . 6.6 tt -63.75 -48.01 78.71 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.011 -1.056 . . . . 1.16 109.594 -179.796 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' D' D ' 351' ' ' LYS . . . . . . . . . . . . . 48.4 tttm -58.55 -42.91 88.94 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.32 -0.862 . . . . 1.97 109.715 -179.835 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' D' D ' 352' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -58.58 -37.03 74.91 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.093 -1.004 . . . . 1.17 109.698 -179.977 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' D' D ' 353' ' ' ALA . . . . . . . . . . . . . . . -68.1 -22.65 64.89 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.204 -0.935 . . . . 1.21 110.003 -179.5 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' D' D ' 354' ' ' GLN . . . . . . . . . . . . . 9.5 mt-30 -83.85 -15.34 48.56 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.107 -0.996 . . . . 1.68 109.677 -179.707 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' D' D ' 355' ' ' ALA . . . . . . . . . . . . . . . -73.49 -3.0 24.9 Favored 'General case' 0 N--CA 1.489 1.525 0 O-C-N 121.127 -0.983 . . . . 1.29 109.494 179.707 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' D' D ' 356' ' ' GLY . . . . . . . . . . . . . . . -79.99 -7.13 88.78 Favored Glycine 0 N--CA 1.49 2.269 0 N-CA-C 109.891 -1.284 . . . . 1.28 109.891 -179.656 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' D' D ' 357' ' ' LYS . . . . . . . . . . . . . 32.2 mttp -87.65 135.72 33.25 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.005 -1.291 . . . . 4.45 109.059 179.693 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' D' D ' 358' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -47.62 154.95 0.82 Allowed Pre-proline 0 N--CA 1.492 1.632 0 O-C-N 121.089 -1.007 . . . . 5.71 109.755 -179.492 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' D' D ' 359' ' ' PRO . . . . . . . . . . . . . 1.9 Cg_endo -62.57 178.09 1.05 Allowed 'Trans proline' 0 C--N 1.31 -1.461 0 C-N-CA 122.235 1.957 . . . . 5.6 110.321 179.955 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' D' D ' 360' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.243 0 CA-C-O 118.058 -1.412 . . . . 6.97 109.735 179.981 . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 319' ' ' LYS . . . . . . . . . . . . . 21.1 mttt . . . . . 0 N--CA 1.49 1.551 0 N-CA-C 109.495 -0.557 . . . . 7.95 109.495 . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 320' ' ' LYS . . . . . . . . . . . . . 1.2 mttt 59.85 163.81 0.05 Allowed 'General case' 0 C--N 1.301 -1.524 0 O-C-N 121.416 -0.803 . . . . 6.71 109.597 179.779 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 321' ' ' LYS . . . . . . . . . . . . . 3.1 mttt -156.87 99.22 2.02 Favored Pre-proline 0 N--CA 1.488 1.471 0 O-C-N 121.277 -0.889 . . . . 6.5 108.932 -179.858 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 322' ' ' PRO . . . . . . . . . . . . . 1.8 Cg_endo -68.78 5.28 1.39 Allowed 'Trans proline' 0 C--N 1.311 -1.422 0 C-N-CA 122.27 1.98 . . . . 3.3 111.44 -179.778 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 323' ' ' LEU . . . . . . . . . . . . . 19.7 mt -82.42 36.32 0.47 Allowed 'General case' 0 N--CA 1.491 1.595 0 O-C-N 120.668 -1.27 . . . . 3.16 110.014 -179.856 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 324' ' ' ASP . . . . . . . . . . . . . 7.0 m-20 -84.91 -153.27 0.16 Allowed 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.103 -0.998 . . . . 1.53 109.588 -179.965 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 325' ' ' GLY . . . . . 0.447 ' O ' ' CE2' ' A' ' 327' ' ' TYR . . . -68.57 176.64 27.8 Favored Glycine 0 N--CA 1.486 1.968 0 N-CA-C 109.572 -1.411 . . . . 0.67 109.572 179.611 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 326' ' ' GLU . . . . . . . . . . . . . 2.1 mm-40 -58.27 175.89 0.2 Allowed 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.341 -1.093 . . . . 2.13 109.14 179.632 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 327' ' ' TYR . . . . . 0.576 ' CE1' ' HG3' ' C' ' 333' ' ' ARG . 51.0 m-85 -148.5 108.9 4.14 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.408 -0.808 . . . . 1.0 109.411 -179.829 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 328' ' ' PHE . . . . . . . . . . . . . 83.4 m-85 -113.42 -165.97 1.05 Allowed 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.414 -0.804 . . . . 0.34 109.592 179.98 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 329' ' ' THR . . . . . . . . . . . . . 22.2 p -154.75 167.68 29.38 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.295 -0.878 . . . . 1.05 109.432 -179.839 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 330' ' ' LEU . . . . . 0.418 HD22 HG12 ' A' ' 332' ' ' ILE . 25.0 tp -150.49 127.05 10.83 Favored 'General case' 0 C--N 1.302 -1.5 0 O-C-N 121.248 -0.907 . . . . 1.07 109.917 -179.787 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 331' ' ' GLN . . . . . . . . . . . . . 1.2 tp60 -86.32 108.4 18.41 Favored 'General case' 0 C--N 1.303 -1.451 0 O-C-N 121.257 -0.902 . . . . 0.91 108.854 179.144 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 332' ' ' ILE . . . . . 0.44 HG22 ' CD2' ' A' ' 341' ' ' PHE . 21.1 mt -102.83 112.94 38.04 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.516 0 O-C-N 121.311 -0.868 . . . . 1.09 109.509 -179.802 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 333' ' ' ARG . . . . . 0.409 ' HG2' ' CE2' ' C' ' 327' ' ' TYR . 54.9 mtm180 -72.84 154.91 40.41 Favored 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.491 -0.756 . . . . 3.41 109.535 179.845 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 334' ' ' GLY . . . . . . . . . . . . . . . 75.98 129.28 0.29 Allowed Glycine 0 N--CA 1.49 2.254 0 N-CA-C 109.728 -1.349 . . . . 0.4 109.728 179.868 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 335' ' ' ARG . . . . . 0.576 ' HB2' ' CZ ' ' C' ' 328' ' ' PHE . 31.3 ttp180 -78.91 -32.45 45.69 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.107 -1.231 . . . . 3.55 109.305 179.705 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 336' ' ' GLU . . . . . . . . . . . . . 1.9 tt0 -57.48 -62.99 1.39 Allowed 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.34 -0.85 . . . . 2.29 109.634 -179.799 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 337' ' ' ARG . . . . . 0.461 ' NH1' ' CG ' ' A' ' 337' ' ' ARG . 0.0 OUTLIER -59.2 -29.05 67.2 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.257 -0.902 . . . . 3.64 109.446 -179.651 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 338' ' ' PHE . . . . . 0.43 ' HB3' ' O ' ' A' ' 335' ' ' ARG . 75.5 t80 -54.76 -57.19 12.51 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.37 -0.831 . . . . 0.41 109.833 -179.872 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 339' ' ' GLU . . . . . . . . . . . . . 3.2 mt-10 -52.27 -33.47 42.08 Favored 'General case' 0 N--CA 1.493 1.692 0 O-C-N 121.205 -0.934 . . . . 1.97 109.678 -179.757 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 340' ' ' MET . . . . . . . . . . . . . 31.0 ttp -63.27 -50.2 71.08 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.482 -0.761 . . . . 1.14 109.947 -179.753 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 341' ' ' PHE . . . . . 0.44 ' CD2' HG22 ' A' ' 332' ' ' ILE . 52.4 m-85 -62.46 -44.24 96.88 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.147 -0.97 . . . . 0.21 109.792 -179.733 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 342' ' ' ARG . . . . . 0.429 ' CG ' HH11 ' A' ' 342' ' ' ARG . 0.1 OUTLIER -51.82 -43.16 63.01 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.319 -0.863 . . . . 3.15 109.866 -179.885 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 343' ' ' GLU . . . . . . . . . . . . . 1.8 tt0 -59.14 -48.37 81.86 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.254 -0.904 . . . . 2.35 110.281 -179.597 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 344' ' ' LEU . . . . . . . . . . . . . 74.4 mt -62.07 -32.85 73.43 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.121 -0.987 . . . . 1.06 109.244 -179.75 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 345' ' ' ASN . . . . . . . . . . . . . 46.4 t-20 -59.68 -52.35 65.87 Favored 'General case' 0 C--N 1.301 -1.523 0 O-C-N 121.364 -0.835 . . . . 1.36 109.823 -179.908 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 346' ' ' GLU . . . . . . . . . . . . . 41.9 tt0 -62.44 -27.04 68.83 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.138 -0.976 . . . . 1.65 109.568 -179.736 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 347' ' ' ALA . . . . . . . . . . . . . . . -62.44 -59.7 4.6 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.441 -0.787 . . . . 1.03 109.941 -179.808 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 348' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -61.13 -44.03 97.96 Favored 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.144 -0.973 . . . . 1.04 109.849 -179.753 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 349' ' ' GLU . . . . . . . . . . . . . 3.5 mm-40 -56.75 -36.32 69.64 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.056 -1.028 . . . . 1.94 109.683 -179.753 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 350' ' ' LEU . . . . . 0.47 HD21 HD11 ' B' ' 350' ' ' LEU . 5.9 tt -62.9 -45.05 94.33 Favored 'General case' 0 N--CA 1.489 1.488 0 O-C-N 120.942 -1.099 . . . . 1.17 109.354 -179.904 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 351' ' ' LYS . . . . . . . . . . . . . 30.0 tttt -57.88 -48.22 80.48 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.223 -0.923 . . . . 1.97 109.584 -179.843 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 352' ' ' ASP . . . . . . . . . . . . . 62.4 m-20 -59.88 -39.03 83.91 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.254 -0.904 . . . . 1.16 109.818 -179.809 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 353' ' ' ALA . . . . . . . . . . . . . . . -67.48 -18.16 64.96 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.296 -0.878 . . . . 1.22 110.038 -179.372 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 354' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -85.33 -20.35 30.1 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.268 -0.895 . . . . 1.71 109.531 -179.985 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 355' ' ' ALA . . . . . . . . . . . . . . . -73.31 -8.31 55.29 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.215 -0.928 . . . . 1.3 109.425 179.804 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 356' ' ' GLY . . . . . . . . . . . . . . . -79.21 -4.23 88.82 Favored Glycine 0 N--CA 1.493 2.439 0 N-CA-C 109.606 -1.397 . . . . 1.3 109.606 -179.776 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 357' ' ' LYS . . . . . . . . . . . . . 7.2 tttt -83.88 163.12 20.26 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.247 -1.149 . . . . 4.46 109.344 -179.946 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 358' ' ' GLU . . . . . . . . . . . . . 8.2 pt-20 -53.29 147.61 18.36 Favored Pre-proline 0 N--CA 1.493 1.676 0 O-C-N 121.239 -0.913 . . . . 5.75 109.805 -179.988 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 359' ' ' PRO . . . . . . . . . . . . . 1.6 Cg_endo -62.9 -159.21 0.03 OUTLIER 'Trans proline' 0 C--N 1.31 -1.466 0 C-N-CA 122.328 2.019 . . . . 5.63 109.511 179.58 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 360' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.486 1.983 0 CA-C-O 117.928 -1.484 . . . . 6.97 109.624 179.8 . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' B' B ' 319' ' ' LYS . . . . . . . . . . . . . 22.3 mttt . . . . . 0 N--CA 1.49 1.562 0 CA-C-O 121.344 0.592 . . . . 7.95 109.478 . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' B' B ' 320' ' ' LYS . . . . . . . . . . . . . 1.2 mttt 59.85 165.22 0.06 Allowed 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.429 -0.794 . . . . 6.73 109.565 179.955 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 321' ' ' LYS . . . . . . . . . . . . . 2.9 mttt -155.57 100.47 2.22 Favored Pre-proline 0 N--CA 1.489 1.484 0 O-C-N 121.271 -0.893 . . . . 6.5 109.233 179.799 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 322' ' ' PRO . . . . . . . . . . . . . 1.8 Cg_endo -68.43 4.34 1.71 Allowed 'Trans proline' 0 C--N 1.312 -1.358 0 C-N-CA 122.419 2.079 . . . . 3.29 111.119 -179.867 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 323' ' ' LEU . . . . . . . . . . . . . 17.2 mt -81.85 35.23 0.41 Allowed 'General case' 0 N--CA 1.49 1.552 0 O-C-N 120.772 -1.205 . . . . 3.18 110.116 179.936 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 324' ' ' ASP . . . . . . . . . . . . . 9.0 m-20 -83.29 -154.62 0.15 Allowed 'General case' 0 C--N 1.305 -1.345 0 O-C-N 120.849 -1.157 . . . . 1.53 109.12 179.757 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 325' ' ' GLY . . . . . 0.441 ' O ' ' CE2' ' B' ' 327' ' ' TYR . . . -68.59 179.21 22.18 Favored Glycine 0 N--CA 1.491 2.327 0 N-CA-C 109.633 -1.387 . . . . 0.65 109.633 179.711 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 326' ' ' GLU . . . . . . . . . . . . . 2.2 mm-40 -59.93 176.35 0.31 Allowed 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.318 -1.107 . . . . 2.13 109.659 -179.888 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 327' ' ' TYR . . . . . 0.441 ' CE2' ' O ' ' B' ' 325' ' ' GLY . 51.3 m-85 -148.84 109.27 4.17 Favored 'General case' 0 C--N 1.301 -1.531 0 O-C-N 120.998 -1.064 . . . . 0.99 109.388 -179.997 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 328' ' ' PHE . . . . . 0.445 ' CE2' ' HB2' ' D' ' 335' ' ' ARG . 79.3 m-85 -113.62 -167.89 1.27 Allowed 'General case' 0 N--CA 1.488 1.443 0 O-C-N 121.217 -0.927 . . . . 0.36 109.451 179.898 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 329' ' ' THR . . . . . . . . . . . . . 27.4 p -152.57 167.25 29.48 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.505 -0.747 . . . . 1.05 109.41 179.808 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 330' ' ' LEU . . . . . 0.406 ' O ' ' HA ' ' D' ' 329' ' ' THR . 30.7 tp -149.26 126.22 11.25 Favored 'General case' 0 N--CA 1.488 1.434 0 O-C-N 121.202 -0.936 . . . . 1.07 109.817 -179.785 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 331' ' ' GLN . . . . . . . . . . . . . 1.4 tp60 -85.75 107.93 17.83 Favored 'General case' 0 C--N 1.304 -1.41 0 O-C-N 121.211 -0.931 . . . . 0.91 108.773 179.325 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 332' ' ' ILE . . . . . 0.416 HG22 ' CD2' ' B' ' 341' ' ' PHE . 24.7 mt -103.17 113.96 41.43 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.493 0 O-C-N 121.094 -1.004 . . . . 1.08 109.585 -179.417 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 333' ' ' ARG . . . . . . . . . . . . . 54.7 mtm180 -73.62 153.99 39.94 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.388 -0.82 . . . . 3.42 109.648 179.85 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 334' ' ' GLY . . . . . . . . . . . . . . . 77.5 129.47 0.44 Allowed Glycine 0 N--CA 1.488 2.109 0 N-CA-C 109.834 -1.306 . . . . 0.4 109.834 179.577 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 335' ' ' ARG . . . . . 0.401 ' O ' ' HB3' ' B' ' 338' ' ' PHE . 32.3 ttp180 -79.82 -32.78 40.67 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.431 -1.04 . . . . 3.55 109.303 -179.977 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 336' ' ' GLU . . . . . . . . . . . . . 2.4 tt0 -57.92 -62.2 1.98 Allowed 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.518 -0.739 . . . . 2.28 109.795 179.884 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 337' ' ' ARG . . . . . 0.468 ' NH1' ' CG ' ' B' ' 337' ' ' ARG . 0.0 OUTLIER -59.25 -29.0 67.23 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.372 -0.83 . . . . 3.64 109.588 179.953 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' B' B ' 338' ' ' PHE . . . . . 0.401 ' HB3' ' O ' ' B' ' 335' ' ' ARG . 73.5 t80 -55.36 -57.21 12.76 Favored 'General case' 0 N--CA 1.487 1.405 0 O-C-N 121.289 -0.882 . . . . 0.39 109.502 -179.941 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 339' ' ' GLU . . . . . . . . . . . . . 3.1 mt-10 -51.95 -33.7 38.8 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.259 -0.901 . . . . 1.98 109.777 -179.719 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 340' ' ' MET . . . . . . . . . . . . . 31.3 ttp -63.18 -50.79 68.95 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.298 -0.876 . . . . 1.14 110.23 -179.458 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 341' ' ' PHE . . . . . 0.416 ' CD2' HG22 ' B' ' 332' ' ' ILE . 51.8 m-85 -62.49 -43.35 99.02 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.02 -1.05 . . . . 0.22 109.551 -179.484 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 342' ' ' ARG . . . . . 0.437 ' CG ' HH11 ' B' ' 342' ' ' ARG . 0.0 OUTLIER -51.63 -43.82 62.72 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.452 -0.78 . . . . 3.15 109.813 -179.887 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' B' B ' 343' ' ' GLU . . . . . . . . . . . . . 2.1 tt0 -59.05 -47.39 85.39 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.43 -0.794 . . . . 2.35 110.154 -179.426 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 344' ' ' LEU . . . . . . . . . . . . . 76.3 mt -62.37 -33.38 74.63 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.094 -1.004 . . . . 1.05 109.51 -179.913 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 345' ' ' ASN . . . . . . . . . . . . . 45.2 t-20 -59.32 -52.89 63.68 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.253 -0.905 . . . . 1.35 109.87 -179.98 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 346' ' ' GLU . . . . . . . . . . . . . 45.3 tt0 -61.53 -28.3 69.22 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.101 -1.0 . . . . 1.66 109.642 -179.769 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 347' ' ' ALA . . . . . . . . . . . . . . . -61.89 -58.59 7.34 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.354 -0.841 . . . . 1.02 109.973 -179.829 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 348' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -62.38 -43.41 98.89 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.092 -1.005 . . . . 1.05 109.715 -179.65 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 349' ' ' GLU . . . . . . . . . . . . . 3.7 mm-40 -56.78 -35.4 68.63 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.182 -0.949 . . . . 1.95 110.125 -179.424 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 350' ' ' LEU . . . . . 0.47 HD11 HD21 ' A' ' 350' ' ' LEU . 6.2 tt -64.04 -46.15 85.68 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.056 -1.028 . . . . 1.18 109.704 -179.769 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 351' ' ' LYS . . . . . . . . . . . . . 33.6 tttt -56.77 -49.7 74.52 Favored 'General case' 0 N--CA 1.488 1.45 0 O-C-N 121.429 -0.794 . . . . 1.96 109.388 -179.894 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 352' ' ' ASP . . . . . . . . . . . . . 60.6 m-20 -58.45 -39.67 80.52 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.278 -0.889 . . . . 1.16 109.888 -179.895 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 353' ' ' ALA . . . . . . . . . . . . . . . -66.48 -20.48 66.05 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.341 -0.849 . . . . 1.21 109.814 -179.545 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 354' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -83.19 -18.96 37.48 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 120.893 -1.129 . . . . 1.69 109.424 -179.925 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 355' ' ' ALA . . . . . . . . . . . . . . . -73.45 -9.82 59.09 Favored 'General case' 0 N--CA 1.489 1.479 0 O-C-N 121.244 -0.91 . . . . 1.3 109.482 179.731 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 356' ' ' GLY . . . . . . . . . . . . . . . -79.57 -3.25 88.82 Favored Glycine 0 N--CA 1.489 2.227 0 N-CA-C 109.536 -1.426 . . . . 1.29 109.536 179.871 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 357' ' ' LYS . . . . . . . . . . . . . 7.7 mttt -84.37 161.79 20.25 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.075 -1.25 . . . . 4.45 109.213 -179.979 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 358' ' ' GLU . . . . . . . . . . . . . 8.8 pt-20 -52.04 148.15 11.51 Favored Pre-proline 0 N--CA 1.49 1.57 0 O-C-N 121.104 -0.997 . . . . 5.72 109.59 179.991 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 359' ' ' PRO . . . . . . . . . . . . . 2.2 Cg_endo -62.46 -158.73 0.03 OUTLIER 'Trans proline' 0 C--N 1.313 -1.329 0 C-N-CA 122.262 1.974 . . . . 5.6 109.529 179.456 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 360' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.192 0 CA-C-O 117.926 -1.485 . . . . 6.98 109.537 179.796 . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' C' C ' 319' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.493 1.718 0 N-CA-C 109.384 -0.598 . . . . 7.03 109.384 . . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' C' C ' 320' ' ' LYS . . . . . . . . . . . . . 13.1 mtpt 54.31 99.65 0.01 OUTLIER 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.349 -0.844 . . . . 6.84 109.898 179.871 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' C' C ' 321' ' ' LYS . . . . . . . . . . . . . 19.5 mtpt -83.0 137.81 43.14 Favored Pre-proline 0 N--CA 1.496 1.837 0 O-C-N 121.147 -0.971 . . . . 6.78 109.95 179.886 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' C' C ' 322' ' ' PRO . . . . . . . . . . . . . 1.8 Cg_endo -67.43 -2.07 7.62 Favored 'Trans proline' 0 C--N 1.316 -1.164 0 C-N-CA 122.362 2.041 . . . . 3.98 110.957 179.662 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' C' C ' 323' ' ' LEU . . . . . . . . . . . . . 87.8 mt -83.59 32.36 0.46 Allowed 'General case' 0 N--CA 1.495 1.822 0 O-C-N 121.107 -0.996 . . . . 4.31 110.144 -179.837 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' C' C ' 324' ' ' ASP . . . . . . . . . . . . . 54.1 m-20 -77.58 -172.26 2.49 Favored 'General case' 0 N--CA 1.488 1.461 0 O-C-N 120.98 -1.075 . . . . 1.63 108.997 179.682 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' C' C ' 325' ' ' GLY . . . . . 0.509 ' O ' ' CE1' ' C' ' 327' ' ' TYR . . . -67.76 174.68 28.24 Favored Glycine 0 N--CA 1.488 2.151 0 N-CA-C 109.02 -1.632 . . . . 0.82 109.02 179.689 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' C' C ' 326' ' ' GLU . . . . . . . . . . . . . 3.0 mm-40 -55.99 -178.88 0.02 OUTLIER 'General case' 0 N--CA 1.488 1.467 0 O-C-N 121.207 -1.172 . . . . 2.17 109.099 179.943 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' C' C ' 327' ' ' TYR . . . . . 0.509 ' CE1' ' O ' ' C' ' 325' ' ' GLY . 47.4 m-85 -147.27 113.43 5.86 Favored 'General case' 0 C--N 1.3 -1.556 0 O-C-N 121.465 -0.772 . . . . 1.03 109.003 179.822 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' C' C ' 328' ' ' PHE . . . . . 0.576 ' CZ ' ' HB2' ' A' ' 335' ' ' ARG . 86.3 m-85 -111.61 -167.95 1.25 Allowed 'General case' 0 C--N 1.303 -1.435 0 O-C-N 121.068 -1.02 . . . . 0.37 109.578 -179.618 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' C' C ' 329' ' ' THR . . . . . . . . . . . . . 76.4 p -150.37 163.79 37.47 Favored 'General case' 0 N--CA 1.487 1.407 0 O-C-N 121.248 -0.908 . . . . 1.04 109.387 -179.831 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' C' C ' 330' ' ' LEU . . . . . . . . . . . . . 29.6 tp -150.07 130.04 13.44 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.434 -0.791 . . . . 1.09 109.609 -179.623 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' C' C ' 331' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -85.37 115.14 22.94 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.258 -0.901 . . . . 1.48 109.234 179.847 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' C' C ' 332' ' ' ILE . . . . . 0.474 ' CG2' ' HA ' ' C' ' 338' ' ' PHE . 50.8 mt -103.88 99.88 9.31 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.482 0 O-C-N 121.165 -0.959 . . . . 1.08 109.916 -179.768 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' C' C ' 333' ' ' ARG . . . . . 0.576 ' HG3' ' CE1' ' A' ' 327' ' ' TYR . 0.0 OUTLIER -71.48 144.69 49.59 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.132 -0.98 . . . . 3.36 109.527 179.892 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' C' C ' 334' ' ' GLY . . . . . . . . . . . . . . . 86.99 126.75 2.18 Favored Glycine 0 N--CA 1.492 2.394 0 N-CA-C 109.379 -1.488 . . . . 0.35 109.379 -179.991 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' C' C ' 335' ' ' ARG . . . . . 0.404 ' NH1' ' CG ' ' C' ' 335' ' ' ARG . 0.0 OUTLIER -77.86 -32.34 51.98 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.332 -1.099 . . . . 3.23 109.848 -179.865 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' C' C ' 336' ' ' GLU . . . . . . . . . . . . . 1.6 mt-10 -59.84 -62.58 1.77 Allowed 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.02 -1.05 . . . . 2.62 110.062 -179.672 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' C' C ' 337' ' ' ARG . . . . . . . . . . . . . 10.5 mpt_? -62.08 -29.35 70.25 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.269 -0.895 . . . . 3.61 110.263 -179.621 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' C' C ' 338' ' ' PHE . . . . . 0.474 ' HA ' ' CG2' ' C' ' 332' ' ' ILE . 68.1 t80 -52.4 -60.21 3.49 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.137 -0.977 . . . . 0.43 109.621 -179.752 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' C' C ' 339' ' ' GLU . . . . . . . . . . . . . 3.6 mt-10 -51.89 -31.11 26.86 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.382 -0.824 . . . . 2.05 109.882 -179.836 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' C' C ' 340' ' ' MET . . . . . . . . . . . . . 38.5 ttp -63.28 -52.72 60.83 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.232 -0.917 . . . . 1.1 109.471 -179.847 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' C' C ' 341' ' ' PHE . . . . . 0.441 ' CB ' HD12 ' C' ' 332' ' ' ILE . 40.2 m-85 -60.69 -42.21 96.7 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.148 -0.97 . . . . 0.21 109.735 -179.745 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' C' C ' 342' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -52.29 -43.08 64.27 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.215 -0.928 . . . . 3.42 109.683 179.928 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' C' C ' 343' ' ' GLU . . . . . . . . . . . . . 7.5 tp10 -59.77 -45.51 92.03 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 120.912 -1.118 . . . . 2.14 110.32 -179.49 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' C' C ' 344' ' ' LEU . . . . . 0.478 ' O ' HD21 ' C' ' 348' ' ' LEU . 48.9 mt -62.5 -42.81 99.75 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.324 -0.86 . . . . 1.09 110.081 -179.387 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' C' C ' 345' ' ' ASN . . . . . . . . . . . . . 22.5 t-20 -54.12 -50.93 65.76 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.211 -0.931 . . . . 1.38 109.627 -179.379 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' C' C ' 346' ' ' GLU . . . . . . . . . . . . . 1.2 tt0 -61.03 -36.36 79.35 Favored 'General case' 0 C--N 1.301 -1.514 0 O-C-N 121.521 -0.737 . . . . 2.21 109.919 -179.773 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' C' C ' 347' ' ' ALA . . . . . . . . . . . . . . . -58.88 -52.76 64.35 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.075 -1.016 . . . . 1.03 110.1 -179.529 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' C' C ' 348' ' ' LEU . . . . . 0.478 HD21 ' O ' ' C' ' 344' ' ' LEU . 2.7 mm? -62.22 -40.6 96.65 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.327 -0.858 . . . . 1.06 109.721 -179.768 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' C' C ' 349' ' ' GLU . . . . . . . . . . . . . 4.1 mt-10 -59.73 -36.77 77.26 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.138 -0.976 . . . . 2.19 110.653 -179.247 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' C' C ' 350' ' ' LEU . . . . . 0.486 HD21 ' CD2' ' D' ' 350' ' ' LEU . 5.3 tt -62.61 -45.96 90.49 Favored 'General case' 0 N--CA 1.494 1.74 0 O-C-N 121.126 -0.984 . . . . 1.2 109.726 -178.953 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' C' C ' 351' ' ' LYS . . . . . . . . . . . . . 24.2 tttm -59.65 -43.73 93.81 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.111 -0.993 . . . . 1.92 109.903 -179.497 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' C' C ' 352' ' ' ASP . . . . . . . . . . . . . 13.2 m-20 -58.58 -32.16 68.69 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.06 -1.025 . . . . 1.19 109.417 -179.616 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' C' C ' 353' ' ' ALA . . . . . . . . . . . . . . . -68.29 -24.58 64.88 Favored 'General case' 0 C--N 1.301 -1.504 0 O-C-N 121.234 -0.916 . . . . 1.15 110.378 -179.37 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' C' C ' 354' ' ' GLN . . . . . . . . . . . . . 15.2 mt-30 -84.31 -19.15 34.22 Favored 'General case' 0 N--CA 1.494 1.763 0 O-C-N 121.049 -1.032 . . . . 1.7 110.122 -179.42 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' C' C ' 355' ' ' ALA . . . . . . . . . . . . . . . -73.29 -0.8 15.59 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.273 -0.892 . . . . 1.3 109.699 179.429 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' C' C ' 356' ' ' GLY . . . . . . . . . . . . . . . -79.72 -72.94 1.17 Allowed Glycine 0 N--CA 1.492 2.386 0 N-CA-C 110.244 -1.142 . . . . 1.33 110.244 -179.694 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' C' C ' 357' ' ' LYS . . . . . . . . . . . . . 3.4 ptmt -81.37 127.41 32.73 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 120.993 -1.298 . . . . 4.39 109.758 -179.241 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' C' C ' 358' ' ' GLU . . . . . . . . . . . . . 1.6 mt-10 -50.55 110.22 1.62 Allowed Pre-proline 0 C--N 1.304 -1.381 0 O-C-N 121.073 -1.017 . . . . 5.75 109.07 179.794 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' C' C ' 359' ' ' PRO . . . . . . . . . . . . . 3.3 Cg_exo -60.18 -80.97 0.01 OUTLIER 'Trans proline' 0 C--N 1.312 -1.386 0 C-N-CA 122.055 1.836 . . . . 5.54 110.488 -179.923 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' C' C ' 360' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 2.403 0 CA-C-O 118.079 -1.4 . . . . 6.5 109.661 -179.861 . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' D' D ' 319' ' ' LYS . . . . . . . . . . . . . 20.0 mttt . . . . . 0 N--CA 1.492 1.63 0 CA-C-O 121.492 0.663 . . . . 7.93 109.538 . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' D' D ' 320' ' ' LYS . . . . . . . . . . . . . 1.3 mttt 60.74 165.36 0.08 Allowed 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.451 -0.78 . . . . 6.7 109.553 179.856 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' D' D ' 321' ' ' LYS . . . . . . . . . . . . . 2.2 mttt -154.92 101.29 2.32 Favored Pre-proline 0 N--CA 1.494 1.771 0 O-C-N 121.367 -0.833 . . . . 6.49 109.53 179.917 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' D' D ' 322' ' ' PRO . . . . . . . . . . . . . 1.5 Cg_endo -66.91 2.46 2.09 Favored 'Trans proline' 0 C--N 1.313 -1.316 0 C-N-CA 122.48 2.12 . . . . 3.29 110.972 179.954 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' D' D ' 323' ' ' LEU . . . . . . . . . . . . . 20.2 mt -81.19 34.97 0.37 Allowed 'General case' 0 N--CA 1.494 1.728 0 O-C-N 120.76 -1.213 . . . . 3.16 110.519 179.983 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' D' D ' 324' ' ' ASP . . . . . 0.431 ' HB2' ' OH ' ' D' ' 327' ' ' TYR . 10.8 m-20 -82.95 -154.19 0.14 Allowed 'General case' 0 C--N 1.304 -1.386 0 O-C-N 121.026 -1.046 . . . . 1.54 109.234 179.394 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' D' D ' 325' ' ' GLY . . . . . 0.486 ' O ' ' CE2' ' D' ' 327' ' ' TYR . . . -69.42 177.33 29.71 Favored Glycine 0 N--CA 1.494 2.503 0 N-CA-C 109.54 -1.424 . . . . 0.65 109.54 -179.966 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' D' D ' 326' ' ' GLU . . . . . . . . . . . . . 1.6 mm-40 -58.65 175.57 0.25 Allowed 'General case' 0 C--N 1.302 -1.493 0 O-C-N 121.33 -1.1 . . . . 2.13 109.162 179.921 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' D' D ' 327' ' ' TYR . . . . . 0.486 ' CE2' ' O ' ' D' ' 325' ' ' GLY . 54.7 m-85 -148.26 109.42 4.32 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.183 -0.948 . . . . 1.0 109.659 -179.854 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' D' D ' 328' ' ' PHE . . . . . . . . . . . . . 68.8 m-85 -114.37 -168.18 1.33 Allowed 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.504 -0.747 . . . . 0.34 109.732 -179.878 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' D' D ' 329' ' ' THR . . . . . 0.406 ' HA ' ' O ' ' B' ' 330' ' ' LEU . 32.9 p -152.87 166.25 32.9 Favored 'General case' 0 N--CA 1.489 1.49 0 O-C-N 121.179 -0.95 . . . . 1.05 109.298 -179.829 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' D' D ' 330' ' ' LEU . . . . . 0.45 HD22 HG12 ' D' ' 332' ' ' ILE . 24.1 tp -148.32 125.99 11.8 Favored 'General case' 0 N--CA 1.488 1.461 0 O-C-N 121.297 -0.877 . . . . 1.07 109.723 -179.734 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' D' D ' 331' ' ' GLN . . . . . . . . . . . . . 1.4 tp60 -85.36 108.69 17.95 Favored 'General case' 0 C--N 1.302 -1.473 0 O-C-N 121.314 -0.866 . . . . 0.93 108.75 179.591 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' D' D ' 332' ' ' ILE . . . . . 0.45 HG12 HD22 ' D' ' 330' ' ' LEU . 31.9 mt -103.33 114.52 43.16 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.641 0 O-C-N 121.146 -0.971 . . . . 1.07 110.003 -179.498 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' D' D ' 333' ' ' ARG . . . . . 0.401 ' HG2' ' CE1' ' B' ' 327' ' ' TYR . 53.4 mtm180 -73.83 151.78 40.43 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.2 -0.938 . . . . 3.42 109.839 179.932 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' D' D ' 334' ' ' GLY . . . . . . . . . . . . . . . 79.3 128.32 0.6 Allowed Glycine 0 N--CA 1.49 2.273 0 N-CA-C 109.894 -1.282 . . . . 0.41 109.894 179.237 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' D' D ' 335' ' ' ARG . . . . . 0.445 ' HB2' ' CE2' ' B' ' 328' ' ' PHE . 33.2 ttp180 -78.75 -32.09 46.51 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.224 -1.162 . . . . 3.58 109.356 179.904 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' D' D ' 336' ' ' GLU . . . . . . . . . . . . . 2.1 tt0 -58.02 -62.26 1.95 Allowed 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.344 -0.847 . . . . 2.26 109.515 -179.993 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' D' D ' 337' ' ' ARG . . . . . 0.452 ' NH1' ' CG ' ' D' ' 337' ' ' ARG . 0.0 OUTLIER -59.38 -29.62 67.83 Favored 'General case' 0 C--N 1.301 -1.502 0 O-C-N 121.229 -0.919 . . . . 3.64 109.719 -179.608 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' D' D ' 338' ' ' PHE . . . . . 0.405 ' HB3' ' O ' ' D' ' 335' ' ' ARG . 68.0 t80 -54.22 -56.44 18.24 Favored 'General case' 0 C--N 1.3 -1.574 0 O-C-N 121.491 -0.756 . . . . 0.4 109.429 179.953 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' D' D ' 339' ' ' GLU . . . . . . . . . . . . . 3.3 mt-10 -52.49 -34.65 50.36 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.022 -1.049 . . . . 1.99 109.924 -179.893 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' D' D ' 340' ' ' MET . . . . . . . . . . . . . 32.4 ttp -62.83 -50.24 71.75 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.137 -0.977 . . . . 1.13 110.143 -179.308 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' D' D ' 341' ' ' PHE . . . . . 0.421 ' CD2' HG22 ' D' ' 332' ' ' ILE . 46.8 m-85 -62.77 -44.24 96.7 Favored 'General case' 0 C--N 1.301 -1.511 0 O-C-N 120.944 -1.097 . . . . 0.21 109.669 -179.484 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' D' D ' 342' ' ' ARG . . . . . 0.453 ' NH1' ' CG ' ' D' ' 342' ' ' ARG . 0.0 OUTLIER -51.9 -41.65 62.11 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.236 -0.915 . . . . 3.15 109.821 -179.478 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' D' D ' 343' ' ' GLU . . . . . . . . . . . . . 3.6 tt0 -60.4 -46.62 89.32 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.183 -0.948 . . . . 2.35 109.84 -179.346 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' D' D ' 344' ' ' LEU . . . . . . . . . . . . . 71.6 mt -62.44 -34.68 77.28 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.283 -0.886 . . . . 1.06 109.469 -179.844 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' D' D ' 345' ' ' ASN . . . . . . . . . . . . . 43.2 t-20 -58.49 -52.19 66.68 Favored 'General case' 0 C--N 1.302 -1.492 0 O-C-N 121.319 -0.863 . . . . 1.35 109.723 -179.741 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' D' D ' 346' ' ' GLU . . . . . . . . . . . . . 42.7 tt0 -62.27 -29.25 70.29 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.39 -0.819 . . . . 1.69 109.678 -179.68 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' D' D ' 347' ' ' ALA . . . . . . . . . . . . . . . -61.88 -57.23 12.6 Favored 'General case' 0 N--CA 1.493 1.713 0 O-C-N 121.421 -0.799 . . . . 1.03 109.966 -179.614 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' D' D ' 348' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -63.16 -44.06 96.55 Favored 'General case' 0 N--CA 1.488 1.472 0 O-C-N 121.186 -0.946 . . . . 1.04 109.762 -179.804 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' D' D ' 349' ' ' GLU . . . . . . . . . . . . . 3.5 mm-40 -57.22 -34.13 68.24 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.109 -0.995 . . . . 1.95 110.066 -179.232 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' D' D ' 350' ' ' LEU . . . . . 0.486 ' CD2' HD21 ' C' ' 350' ' ' LEU . 6.2 tt -64.08 -46.13 85.64 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.181 -0.95 . . . . 1.16 109.413 179.885 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' D' D ' 351' ' ' LYS . . . . . . . . . . . . . 42.0 tttt -57.6 -48.43 79.42 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.252 -0.905 . . . . 1.97 109.59 -179.939 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' D' D ' 352' ' ' ASP . . . . . . . . . . . . . 72.4 m-20 -58.66 -38.89 79.13 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.401 -0.812 . . . . 1.17 109.462 179.458 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' D' D ' 353' ' ' ALA . . . . . . . . . . . . . . . -67.65 -20.71 65.35 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.485 -0.759 . . . . 1.21 109.958 -179.514 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' D' D ' 354' ' ' GLN . . . . . . . . . . . . . 1.1 mt-30 -84.11 -19.2 34.64 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.365 -0.834 . . . . 1.68 109.675 -179.887 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' D' D ' 355' ' ' ALA . . . . . . . . . . . . . . . -73.52 -10.61 59.89 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.36 -0.837 . . . . 1.29 109.681 -179.93 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' D' D ' 356' ' ' GLY . . . . . . . . . . . . . . . -79.4 -2.71 88.06 Favored Glycine 0 N--CA 1.492 2.378 0 N-CA-C 109.282 -1.527 . . . . 1.28 109.282 179.958 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' D' D ' 357' ' ' LYS . . . . . . . . . . . . . 8.0 mttt -84.17 162.0 20.38 Favored 'General case' 0 N--CA 1.487 1.422 0 O-C-N 121.199 -1.177 . . . . 4.45 109.213 -179.81 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' D' D ' 358' ' ' GLU . . . . . . . . . . . . . 4.4 pt-20 -52.4 147.39 14.21 Favored Pre-proline 0 N--CA 1.495 1.795 0 O-C-N 121.115 -0.991 . . . . 5.71 109.605 -179.773 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' D' D ' 359' ' ' PRO . . . . . . . . . . . . . 2.7 Cg_endo -61.74 -158.68 0.02 OUTLIER 'Trans proline' 0 C--N 1.311 -1.429 0 C-N-CA 122.212 1.941 . . . . 5.6 110.57 -179.954 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' D' D ' 360' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.486 2.025 0 N-CA-C 109.13 -1.588 . . . . 6.97 109.13 179.777 . . . . . . . . 0 0 . 1 . 021 nuclear orig full ' A' A ' 319' ' ' LYS . . . . . . . . . . . . . 3.6 mmtm . . . . . 0 N--CA 1.491 1.588 0 N-CA-C 109.477 -0.564 . . . . 7.95 109.477 . . . . . . . . . 0 0 . 1 . 021 nuclear orig full ' A' A ' 320' ' ' LYS . . . . . . . . . . . . . 5.8 tttm 60.07 96.71 0.03 OUTLIER 'General case' 0 N--CA 1.489 1.476 0 O-C-N 121.254 -0.903 . . . . 6.71 109.347 179.953 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 321' ' ' LYS . . . . . 0.419 ' HB2' ' HD2' ' A' ' 322' ' ' PRO . 15.7 pttt -80.86 155.78 72.84 Favored Pre-proline 0 N--CA 1.491 1.607 0 O-C-N 121.251 -0.905 . . . . 6.5 109.232 -179.978 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 322' ' ' PRO . . . . . 0.419 ' HD2' ' HB2' ' A' ' 321' ' ' LYS . 5.4 Cg_exo -58.27 -157.04 0.01 OUTLIER 'Trans proline' 0 C--N 1.308 -1.564 0 C-N-CA 121.991 1.794 . . . . 3.3 110.081 179.996 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 323' ' ' LEU . . . . . . . . . . . . . 34.8 mt -79.6 150.52 31.01 Favored 'General case' 0 N--CA 1.489 1.484 0 O-C-N 121.137 -0.977 . . . . 3.16 109.39 -179.972 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 324' ' ' ASP . . . . . 0.415 ' HB2' ' OH ' ' A' ' 327' ' ' TYR . 42.5 m-20 -78.45 -165.49 0.7 Allowed 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.208 -0.932 . . . . 1.53 109.668 -179.713 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 325' ' ' GLY . . . . . . . . . . . . . . . -69.8 -160.98 2.92 Favored Glycine 0 N--CA 1.489 2.221 0 N-CA-C 109.686 -1.366 . . . . 0.67 109.686 -179.884 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 326' ' ' GLU . . . . . . . . . . . . . 7.1 mt-10 -59.07 -169.55 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.313 -1.11 . . . . 2.13 109.634 179.982 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 327' ' ' TYR . . . . . 0.579 ' CE1' ' HG2' ' C' ' 333' ' ' ARG . 41.4 m-85 -149.79 115.52 5.59 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.394 -0.816 . . . . 1.0 109.628 179.975 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 328' ' ' PHE . . . . . 0.485 ' CE1' ' HA ' ' C' ' 335' ' ' ARG . 76.6 m-85 -113.51 -170.52 1.71 Allowed 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.36 -0.837 . . . . 0.34 109.385 179.928 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 329' ' ' THR . . . . . . . . . . . . . 27.3 p -154.08 167.47 29.69 Favored 'General case' 0 N--CA 1.489 1.483 0 O-C-N 121.302 -0.874 . . . . 1.05 109.39 -179.849 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 330' ' ' LEU . . . . . . . . . . . . . 14.7 tp -148.51 126.9 12.27 Favored 'General case' 0 N--CA 1.489 1.487 0 O-C-N 121.251 -0.906 . . . . 1.07 109.359 -179.944 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 331' ' ' GLN . . . . . . . . . . . . . 1.1 tp60 -86.95 111.38 20.78 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.236 -0.915 . . . . 0.91 109.473 -179.996 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 332' ' ' ILE . . . . . . . . . . . . . 32.2 mt -103.61 110.26 29.47 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.501 0 O-C-N 121.245 -0.909 . . . . 1.09 109.486 -179.946 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 333' ' ' ARG . . . . . 0.406 ' CG ' ' CE2' ' C' ' 327' ' ' TYR . 2.4 mpt_? -72.36 143.44 48.61 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.287 -0.883 . . . . 3.41 109.241 179.793 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 334' ' ' GLY . . . . . . . . . . . . . . . 83.74 130.24 1.76 Allowed Glycine 0 N--CA 1.491 2.327 0 N-CA-C 109.525 -1.43 . . . . 0.4 109.525 -179.869 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 335' ' ' ARG . . . . . 0.505 ' HB2' ' CZ ' ' C' ' 328' ' ' PHE . 6.1 ttm180 -79.07 -28.48 43.11 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.344 -1.092 . . . . 3.55 109.622 -179.834 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 336' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -56.79 -67.16 0.34 Allowed 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.208 -0.933 . . . . 2.29 109.799 -179.701 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 337' ' ' ARG . . . . . 0.421 HH11 ' HG2' ' A' ' 337' ' ' ARG . 0.8 OUTLIER -60.38 -25.79 66.16 Favored 'General case' 0 N--CA 1.488 1.47 0 O-C-N 121.251 -0.905 . . . . 3.64 109.68 -179.766 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' A' A ' 338' ' ' PHE . . . . . 0.429 ' HB3' ' O ' ' A' ' 335' ' ' ARG . 67.6 t80 -55.39 -60.59 3.2 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.3 -0.875 . . . . 0.41 109.677 179.982 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 339' ' ' GLU . . . . . . . . . . . . . 79.0 mt-10 -51.36 -31.71 23.16 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.281 -0.887 . . . . 1.97 109.998 -179.738 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 340' ' ' MET . . . . . . . . . . . . . 9.5 ttp -63.27 -52.58 61.49 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.159 -0.963 . . . . 1.14 109.954 -179.575 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 341' ' ' PHE . . . . . . . . . . . . . 48.3 m-85 -61.85 -41.68 98.12 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.226 -0.921 . . . . 0.21 109.74 -179.587 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 342' ' ' ARG . . . . . 0.502 ' HG2' ' NH1' ' A' ' 342' ' ' ARG . 0.0 OUTLIER -50.9 -41.73 58.74 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.17 -0.956 . . . . 3.15 109.888 -179.867 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' A' A ' 343' ' ' GLU . . . . . . . . . . . . . 28.3 tt0 -59.67 -50.71 72.78 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.235 -0.916 . . . . 2.35 110.195 -179.544 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 344' ' ' LEU . . . . . 0.403 ' CD2' ' CD2' ' B' ' 344' ' ' LEU . 41.0 mt -61.29 -30.04 70.23 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.121 -0.987 . . . . 1.06 109.92 -179.477 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 345' ' ' ASN . . . . . 0.41 ' O ' ' HG3' ' A' ' 349' ' ' GLU . 29.3 t-20 -57.52 -56.96 15.18 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.235 -0.916 . . . . 1.36 109.993 -179.659 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 346' ' ' GLU . . . . . . . . . . . . . 70.9 tt0 -61.47 -29.47 69.99 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.219 -0.926 . . . . 1.65 110.183 -179.452 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 347' ' ' ALA . . . . . . . . . . . . . . . -60.07 -55.89 28.37 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.115 -0.991 . . . . 1.03 110.066 -179.522 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 348' ' ' LEU . . . . . 0.513 ' N ' HD23 ' A' ' 348' ' ' LEU . 4.2 mm? -61.84 -44.62 96.47 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.257 -0.902 . . . . 1.04 110.07 -179.434 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 349' ' ' GLU . . . . . 0.41 ' HG3' ' O ' ' A' ' 345' ' ' ASN . 55.8 mt-10 -57.4 -35.7 70.36 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.077 -1.015 . . . . 1.94 109.945 -179.438 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 350' ' ' LEU . . . . . 0.478 HD21 HD21 ' B' ' 350' ' ' LEU . 6.1 tt -64.45 -40.41 95.68 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.208 -0.933 . . . . 1.17 109.63 -179.765 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 351' ' ' LYS . . . . . . . . . . . . . 2.3 ttmt -57.67 -56.63 19.43 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.285 -0.884 . . . . 1.97 109.895 -179.577 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 352' ' ' ASP . . . . . . . . . . . . . 11.8 m-20 -56.55 -37.54 70.66 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.155 -0.966 . . . . 1.16 109.815 -179.842 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 353' ' ' ALA . . . . . . . . . . . . . . . -67.34 -26.35 66.45 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.228 -0.92 . . . . 1.22 110.183 -179.439 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 354' ' ' GLN . . . . . 0.435 ' NE2' HD12 ' B' ' 350' ' ' LEU . 0.1 OUTLIER -83.61 -12.96 55.37 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.023 -1.048 . . . . 1.71 109.797 -179.751 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' A' A ' 355' ' ' ALA . . . . . . . . . . . . . . . -72.78 -21.86 60.93 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.066 -1.021 . . . . 1.3 109.269 179.836 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 356' ' ' GLY . . . . . . . . . . . . . . . -81.68 16.84 17.64 Favored Glycine 0 N--CA 1.492 2.375 0 N-CA-C 110.316 -1.114 . . . . 1.3 110.316 179.947 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 357' ' ' LYS . . . . . . . . . . . . . 41.8 tttt -85.43 111.5 20.01 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 120.989 -1.301 . . . . 4.46 109.722 -179.619 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 358' ' ' GLU . . . . . . . . . . . . . 5.5 mt-10 -48.43 112.98 2.57 Favored Pre-proline 0 N--CA 1.489 1.495 0 O-C-N 121.256 -0.902 . . . . 5.75 109.252 179.818 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 359' ' ' PRO . . . . . . . . . . . . . 2.4 Cg_endo -61.72 137.77 70.56 Favored 'Trans proline' 0 C--N 1.312 -1.347 0 C-N-CA 121.953 1.769 . . . . 5.63 110.214 -179.82 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 360' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.245 0 CA-C-O 118.024 -1.431 . . . . 6.97 109.538 179.972 . . . . . . . . 0 0 . 1 . 021 nuclear orig full ' B' B ' 319' ' ' LYS . . . . . . . . . . . . . 3.5 mmtm . . . . . 0 N--CA 1.489 1.511 0 N-CA-C 109.41 -0.589 . . . . 7.95 109.41 . . . . . . . . . 0 0 . 1 . 021 nuclear orig full ' B' B ' 320' ' ' LYS . . . . . . . . . . . . . 5.1 tttm 59.37 97.01 0.03 OUTLIER 'General case' 0 N--CA 1.489 1.492 0 O-C-N 121.237 -0.914 . . . . 6.73 109.423 179.99 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 321' ' ' LYS . . . . . 0.404 ' HB2' ' HD2' ' B' ' 322' ' ' PRO . 15.2 pttt -81.11 155.78 72.21 Favored Pre-proline 0 N--CA 1.489 1.499 0 O-C-N 121.201 -0.937 . . . . 6.5 109.215 179.971 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' B' B ' 322' ' ' PRO . . . . . 0.404 ' HD2' ' HB2' ' B' ' 321' ' ' LYS . 5.5 Cg_exo -58.36 -156.9 0.01 OUTLIER 'Trans proline' 0 C--N 1.308 -1.6 0 C-N-CA 122.006 1.804 . . . . 3.29 110.105 179.987 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' B' B ' 323' ' ' LEU . . . . . . . . . . . . . 36.6 mt -79.55 150.54 31.08 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.12 -0.987 . . . . 3.18 109.393 -179.983 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 324' ' ' ASP . . . . . 0.411 ' HB2' ' OH ' ' B' ' 327' ' ' TYR . 43.7 m-20 -78.43 -165.18 0.65 Allowed 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.26 -0.9 . . . . 1.53 109.583 -179.802 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' B' B ' 325' ' ' GLY . . . . . . . . . . . . . . . -70.25 -160.94 3.27 Favored Glycine 0 N--CA 1.49 2.248 0 N-CA-C 109.731 -1.348 . . . . 0.65 109.731 -179.819 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 326' ' ' GLU . . . . . . . . . . . . . 7.1 mt-10 -58.86 -169.41 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.341 -1.093 . . . . 2.13 109.625 179.989 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 327' ' ' TYR . . . . . 0.534 ' CE1' ' CG ' ' D' ' 333' ' ' ARG . 41.7 m-85 -149.84 115.42 5.55 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.339 -0.851 . . . . 0.99 109.607 179.96 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' B' B ' 328' ' ' PHE . . . . . 0.495 ' CZ ' ' HB2' ' D' ' 335' ' ' ARG . 75.9 m-85 -113.54 -170.72 1.75 Allowed 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.352 -0.843 . . . . 0.36 109.321 179.885 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' B' B ' 329' ' ' THR . . . . . 0.473 ' HA ' ' O ' ' D' ' 330' ' ' LEU . 27.7 p -153.89 167.64 29.02 Favored 'General case' 0 N--CA 1.488 1.471 0 O-C-N 121.311 -0.868 . . . . 1.05 109.383 -179.978 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' B' B ' 330' ' ' LEU . . . . . 0.481 ' O ' ' HA ' ' D' ' 329' ' ' THR . 14.5 tp -148.74 126.06 11.54 Favored 'General case' 0 N--CA 1.488 1.45 0 O-C-N 121.207 -0.933 . . . . 1.07 109.491 -179.859 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' B' B ' 331' ' ' GLN . . . . . . . . . . . . . 1.1 tt0 -86.24 111.32 20.31 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.243 -0.911 . . . . 0.91 109.624 -179.905 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 332' ' ' ILE . . . . . . . . . . . . . 31.9 mt -103.36 110.63 30.39 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.538 0 O-C-N 121.23 -0.919 . . . . 1.08 109.564 179.922 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 333' ' ' ARG . . . . . 0.595 ' CG ' ' CE1' ' D' ' 327' ' ' TYR . 2.4 mpt_? -72.57 143.53 48.23 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.19 -0.944 . . . . 3.42 109.261 179.822 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' B' B ' 334' ' ' GLY . . . . . . . . . . . . . . . 83.55 130.04 1.67 Allowed Glycine 0 N--CA 1.49 2.254 0 N-CA-C 109.521 -1.431 . . . . 0.4 109.521 -179.981 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 335' ' ' ARG . . . . . 0.515 ' HB2' ' CZ ' ' D' ' 328' ' ' PHE . 6.2 ttm180 -78.68 -28.41 45.29 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.289 -1.124 . . . . 3.55 109.737 -179.947 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' B' B ' 336' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -56.7 -67.42 0.31 Allowed 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.236 -0.915 . . . . 2.28 109.796 -179.714 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' B' B ' 337' ' ' ARG . . . . . 0.415 HH11 ' HG2' ' B' ' 337' ' ' ARG . 0.8 OUTLIER -60.3 -25.52 65.81 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.271 -0.893 . . . . 3.64 109.676 -179.798 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' B' B ' 338' ' ' PHE . . . . . 0.427 ' HB3' ' O ' ' B' ' 335' ' ' ARG . 66.8 t80 -55.67 -60.7 3.07 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.221 -0.924 . . . . 0.39 109.517 -179.96 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' B' B ' 339' ' ' GLU . . . . . . . . . . . . . 79.1 mt-10 -51.32 -31.77 22.89 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.365 -0.834 . . . . 1.98 109.965 -179.673 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 340' ' ' MET . . . . . . . . . . . . . 9.4 ttp -63.32 -52.52 61.54 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.149 -0.969 . . . . 1.14 110.041 -179.597 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 341' ' ' PHE . . . . . . . . . . . . . 48.3 m-85 -61.64 -42.14 98.48 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.167 -0.958 . . . . 0.22 109.761 -179.695 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 342' ' ' ARG . . . . . 0.512 ' NH1' ' HG2' ' B' ' 342' ' ' ARG . 0.0 OUTLIER -50.32 -42.03 52.13 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.334 -0.854 . . . . 3.15 109.857 -179.894 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' B' B ' 343' ' ' GLU . . . . . . . . . . . . . 27.3 tt0 -59.55 -50.7 72.88 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.255 -0.903 . . . . 2.35 110.258 -179.411 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 344' ' ' LEU . . . . . 0.403 ' CD2' ' CD2' ' A' ' 344' ' ' LEU . 40.0 mt -61.38 -29.82 70.15 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.127 -0.983 . . . . 1.05 109.929 -179.537 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' B' B ' 345' ' ' ASN . . . . . 0.402 ' O ' ' HG3' ' B' ' 349' ' ' GLU . 29.2 t-20 -57.58 -57.0 14.67 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.245 -0.909 . . . . 1.35 110.017 -179.688 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' B' B ' 346' ' ' GLU . . . . . . . . . . . . . 71.0 tt0 -61.5 -29.4 69.96 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.214 -0.928 . . . . 1.66 110.246 -179.395 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 347' ' ' ALA . . . . . . . . . . . . . . . -60.28 -55.78 29.56 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.136 -0.978 . . . . 1.02 110.061 -179.516 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 348' ' ' LEU . . . . . 0.506 ' N ' HD23 ' B' ' 348' ' ' LEU . 4.2 mm? -61.82 -44.59 96.56 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.203 -0.936 . . . . 1.05 110.005 -179.468 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' B' B ' 349' ' ' GLU . . . . . 0.402 ' HG3' ' O ' ' B' ' 345' ' ' ASN . 56.4 mt-10 -57.38 -35.78 70.42 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.172 -0.955 . . . . 1.95 109.946 -179.471 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' B' B ' 350' ' ' LEU . . . . . 0.478 HD21 HD21 ' A' ' 350' ' ' LEU . 6.1 tt -64.4 -40.28 95.48 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.269 -0.894 . . . . 1.18 109.791 -179.826 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' B' B ' 351' ' ' LYS . . . . . . . . . . . . . 2.3 ttmt -57.87 -56.55 20.48 Favored 'General case' 0 N--CA 1.489 1.525 0 O-C-N 121.192 -0.943 . . . . 1.96 109.915 -179.595 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 352' ' ' ASP . . . . . . . . . . . . . 11.5 m-20 -56.69 -37.35 70.75 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.178 -0.951 . . . . 1.16 109.791 -179.882 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 353' ' ' ALA . . . . . . . . . . . . . . . -67.33 -26.28 66.42 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.208 -0.933 . . . . 1.21 110.049 -179.513 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 354' ' ' GLN . . . . . 0.456 ' NE2' HD12 ' A' ' 350' ' ' LEU . 0.1 OUTLIER -83.84 -12.87 54.95 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.05 -1.031 . . . . 1.69 109.936 -179.59 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' B' B ' 355' ' ' ALA . . . . . . . . . . . . . . . -72.94 -21.99 60.79 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.139 -0.975 . . . . 1.3 109.329 179.826 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 356' ' ' GLY . . . . . . . . . . . . . . . -81.38 17.03 14.85 Favored Glycine 0 N--CA 1.491 2.307 0 N-CA-C 110.342 -1.103 . . . . 1.29 110.342 179.868 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 357' ' ' LYS . . . . . . . . . . . . . 42.1 tttt -85.64 111.46 20.1 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 120.831 -1.394 . . . . 4.45 109.747 -179.645 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 358' ' ' GLU . . . . . . . . . . . . . 5.5 mt-10 -48.36 112.61 2.38 Favored Pre-proline 0 N--CA 1.49 1.566 0 O-C-N 121.272 -0.893 . . . . 5.72 109.323 179.805 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 359' ' ' PRO . . . . . . . . . . . . . 2.4 Cg_endo -61.53 138.44 75.79 Favored 'Trans proline' 0 C--N 1.313 -1.329 0 C-N-CA 121.996 1.797 . . . . 5.6 110.306 -179.84 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 360' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.18 0 CA-C-O 117.925 -1.486 . . . . 6.98 109.55 -179.956 . . . . . . . . 0 0 . 1 . 021 nuclear orig full ' C' C ' 319' ' ' LYS . . . . . 0.447 ' O ' ' HB2' ' C' ' 320' ' ' LYS . 10.2 mttp . . . . . 0 N--CA 1.49 1.56 0 N-CA-C 109.43 -0.581 . . . . 7.03 109.43 . . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' C' C ' 320' ' ' LYS . . . . . 0.447 ' HB2' ' O ' ' C' ' 319' ' ' LYS . 9.8 mtmt 61.14 166.27 0.09 Allowed 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.279 -0.888 . . . . 6.84 109.678 179.899 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' C' C ' 321' ' ' LYS . . . . . . . . . . . . . 1.7 mttp -157.73 145.11 13.57 Favored Pre-proline 0 N--CA 1.49 1.542 0 O-C-N 121.23 -0.919 . . . . 6.78 109.318 179.875 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' C' C ' 322' ' ' PRO . . . . . . . . . . . . . 3.4 Cg_exo -60.78 178.03 0.56 Allowed 'Trans proline' 0 C--N 1.31 -1.449 0 C-N-CA 122.168 1.912 . . . . 3.98 110.317 -179.865 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' C' C ' 323' ' ' LEU . . . . . . . . . . . . . 44.8 mt -79.38 120.49 23.88 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.343 -0.848 . . . . 4.31 109.208 179.855 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' C' C ' 324' ' ' ASP . . . . . 0.472 ' HB3' ' OH ' ' C' ' 327' ' ' TYR . 90.0 m-20 -79.61 146.08 32.73 Favored 'General case' 0 N--CA 1.489 1.495 0 O-C-N 121.304 -0.872 . . . . 1.63 109.482 -179.779 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' C' C ' 325' ' ' GLY . . . . . . . . . . . . . . . -68.21 -168.14 4.51 Favored Glycine 0 N--CA 1.489 2.199 0 N-CA-C 109.386 -1.486 . . . . 0.82 109.386 179.773 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' C' C ' 326' ' ' GLU . . . . . . . . . . . . . 2.3 mt-10 -58.7 -172.22 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.256 -1.144 . . . . 2.17 109.555 -179.991 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' C' C ' 327' ' ' TYR . . . . . 0.472 ' OH ' ' HB3' ' C' ' 324' ' ' ASP . 37.2 m-85 -149.11 114.21 5.47 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.446 -0.784 . . . . 1.03 109.463 179.809 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' C' C ' 328' ' ' PHE . . . . . 0.505 ' CZ ' ' HB2' ' A' ' 335' ' ' ARG . 77.0 m-85 -112.56 -170.54 1.68 Allowed 'General case' 0 N--CA 1.487 1.42 0 O-C-N 121.269 -0.895 . . . . 0.37 108.951 179.677 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' C' C ' 329' ' ' THR . . . . . . . . . . . . . 5.0 p -153.42 170.25 21.17 Favored 'General case' 0 C--N 1.301 -1.512 0 O-C-N 121.27 -0.894 . . . . 1.04 109.226 179.957 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' C' C ' 330' ' ' LEU . . . . . . . . . . . . . 49.5 tp -149.12 134.49 18.44 Favored 'General case' 0 C--N 1.303 -1.454 0 O-C-N 121.213 -0.929 . . . . 1.09 109.325 -179.77 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' C' C ' 331' ' ' GLN . . . . . 0.472 ' NE2' ' O ' ' A' ' 328' ' ' PHE . 57.8 tp60 -84.95 107.17 16.96 Favored 'General case' 0 N--CA 1.489 1.475 0 O-C-N 121.337 -0.852 . . . . 1.48 109.187 -179.994 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' C' C ' 332' ' ' ILE . . . . . . . . . . . . . 64.2 mt -103.05 100.39 10.31 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.505 0 O-C-N 121.162 -0.961 . . . . 1.08 109.424 -179.897 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' C' C ' 333' ' ' ARG . . . . . 0.579 ' HG2' ' CE1' ' A' ' 327' ' ' TYR . 89.2 mtt180 -72.57 159.09 34.46 Favored 'General case' 0 N--CA 1.488 1.456 0 O-C-N 121.311 -0.868 . . . . 3.36 109.289 179.725 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' C' C ' 334' ' ' GLY . . . . . . . . . . . . . . . 72.58 129.13 0.11 Allowed Glycine 0 N--CA 1.491 2.36 0 N-CA-C 109.39 -1.484 . . . . 0.35 109.39 -179.788 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' C' C ' 335' ' ' ARG . . . . . 0.485 ' HA ' ' CE1' ' A' ' 328' ' ' PHE . 10.1 ttm180 -78.08 -30.89 49.86 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.245 -1.15 . . . . 3.23 109.889 -179.769 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' C' C ' 336' ' ' GLU . . . . . . . . . . . . . 1.5 tt0 -58.95 -63.82 1.16 Allowed 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.227 -0.921 . . . . 2.62 110.087 -179.591 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' C' C ' 337' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -59.09 -26.11 64.37 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.155 -0.965 . . . . 3.61 109.802 -179.43 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' C' C ' 338' ' ' PHE . . . . . 0.431 ' HB3' ' O ' ' C' ' 335' ' ' ARG . 81.3 t80 -54.78 -61.12 2.52 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.152 -0.968 . . . . 0.43 109.662 -179.944 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' C' C ' 339' ' ' GLU . . . . . . . . . . . . . 22.9 mt-10 -50.97 -31.59 18.38 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.301 -0.874 . . . . 2.05 109.995 -179.669 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' C' C ' 340' ' ' MET . . . . . . . . . . . . . 34.6 ttp -63.47 -52.85 59.6 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.173 -0.954 . . . . 1.1 109.916 -179.564 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' C' C ' 341' ' ' PHE . . . . . . . . . . . . . 48.9 m-85 -62.08 -42.26 99.02 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.153 -0.967 . . . . 0.21 109.848 -179.58 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' C' C ' 342' ' ' ARG . . . . . 0.441 ' NH1' ' CG ' ' C' ' 342' ' ' ARG . 0.2 OUTLIER -49.94 -45.39 51.19 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.358 -0.839 . . . . 3.42 110.177 -179.574 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' C' C ' 343' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -57.82 -48.71 78.97 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.137 -0.977 . . . . 2.14 110.025 -179.332 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' C' C ' 344' ' ' LEU . . . . . . . . . . . . . 32.3 mt -62.69 -31.94 72.93 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.2 -0.938 . . . . 1.09 110.132 -179.549 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' C' C ' 345' ' ' ASN . . . . . . . . . . . . . 20.4 t-20 -57.63 -58.62 7.5 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.213 -0.929 . . . . 1.38 109.57 -179.665 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' C' C ' 346' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -61.36 -26.08 67.59 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.317 -0.865 . . . . 2.21 109.669 -179.875 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' C' C ' 347' ' ' ALA . . . . . . . . . . . . . . . -60.42 -58.63 7.7 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.173 -0.954 . . . . 1.03 109.772 -179.984 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' C' C ' 348' ' ' LEU . . . . . 0.46 ' N ' ' CD2' ' C' ' 348' ' ' LEU . 4.3 mm? -62.23 -40.54 96.47 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.237 -0.915 . . . . 1.06 109.86 -179.658 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' C' C ' 349' ' ' GLU . . . . . . . . . . . . . 68.0 mm-40 -57.46 -37.09 72.31 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.186 -0.946 . . . . 2.19 109.726 -179.63 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' C' C ' 350' ' ' LEU . . . . . 0.523 ' CD1' HD21 ' D' ' 350' ' ' LEU . 5.3 tt -63.02 -38.79 92.62 Favored 'General case' 0 N--CA 1.489 1.481 0 O-C-N 121.109 -0.994 . . . . 1.2 109.065 179.929 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' C' C ' 351' ' ' LYS . . . . . 0.464 ' HA ' ' OE1' ' C' ' 354' ' ' GLN . 20.3 tttt -60.15 -37.12 79.15 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.351 -0.843 . . . . 1.92 109.164 179.765 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' C' C ' 352' ' ' ASP . . . . . . . . . . . . . 8.5 m-20 -56.93 -41.91 79.07 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.31 -0.869 . . . . 1.19 109.539 179.926 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' C' C ' 353' ' ' ALA . . . . . . . . . . . . . . . -67.57 -23.15 65.38 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.272 -0.892 . . . . 1.15 109.575 -179.897 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' C' C ' 354' ' ' GLN . . . . . 0.481 ' OE1' ' CD2' ' C' ' 350' ' ' LEU . 26.4 mt-30 -82.47 -6.78 59.51 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.193 -0.942 . . . . 1.7 109.621 -179.987 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' C' C ' 355' ' ' ALA . . . . . . . . . . . . . . . -70.66 -86.04 0.03 OUTLIER 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.225 -0.922 . . . . 1.3 109.6 179.971 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' C' C ' 356' ' ' GLY . . . . . . . . . . . . . . . -81.41 66.06 3.89 Favored Glycine 0 N--CA 1.494 2.503 0 N-CA-C 109.907 -1.277 . . . . 1.33 109.907 179.999 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' C' C ' 357' ' ' LYS . . . . . . . . . . . . . 24.0 tttt -86.23 156.26 20.36 Favored 'General case' 0 N--CA 1.488 1.431 0 O-C-N 121.145 -1.209 . . . . 4.39 109.24 179.919 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' C' C ' 358' ' ' GLU . . . . . 0.406 ' HB3' ' HD2' ' C' ' 359' ' ' PRO . 11.9 mm-40 -48.03 156.09 0.79 Allowed Pre-proline 0 N--CA 1.49 1.555 0 O-C-N 121.168 -0.957 . . . . 5.75 109.297 -179.995 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' C' C ' 359' ' ' PRO . . . . . 0.406 ' HD2' ' HB3' ' C' ' 358' ' ' GLU . 5.0 Cg_exo -59.85 174.34 1.32 Allowed 'Trans proline' 0 C--N 1.309 -1.538 0 C-N-CA 122.177 1.918 . . . . 5.54 110.316 -179.766 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' C' C ' 360' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.244 0 N-CA-C 109.556 -1.418 . . . . 6.5 109.556 -179.961 . . . . . . . . 0 0 . 1 . 021 nuclear orig full ' D' D ' 319' ' ' LYS . . . . . . . . . . . . . 3.9 mmtm . . . . . 0 N--CA 1.49 1.537 0 N-CA-C 109.421 -0.585 . . . . 7.93 109.421 . . . . . . . . . 0 0 . 1 . 021 nuclear orig full ' D' D ' 320' ' ' LYS . . . . . . . . . . . . . 5.1 tttm 60.09 96.7 0.03 OUTLIER 'General case' 0 N--CA 1.488 1.457 0 O-C-N 121.335 -0.853 . . . . 6.7 109.34 -179.936 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' D' D ' 321' ' ' LYS . . . . . 0.411 ' HB2' ' HD2' ' D' ' 322' ' ' PRO . 14.7 pttt -80.73 156.09 72.99 Favored Pre-proline 0 N--CA 1.488 1.447 0 O-C-N 121.202 -0.937 . . . . 6.49 109.303 -179.972 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' D' D ' 322' ' ' PRO . . . . . 0.411 ' HD2' ' HB2' ' D' ' 321' ' ' LYS . 5.5 Cg_exo -58.52 -157.11 0.01 OUTLIER 'Trans proline' 0 C--N 1.308 -1.571 0 C-N-CA 122.053 1.835 . . . . 3.29 110.134 179.929 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' D' D ' 323' ' ' LEU . . . . . . . . . . . . . 35.3 mt -79.37 150.62 31.34 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.181 -0.949 . . . . 3.16 109.353 179.9 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' D' D ' 324' ' ' ASP . . . . . 0.422 ' HB2' ' OH ' ' D' ' 327' ' ' TYR . 44.2 m-20 -78.5 -165.48 0.71 Allowed 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.245 -0.91 . . . . 1.54 109.475 -179.756 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' D' D ' 325' ' ' GLY . . . . . . . . . . . . . . . -69.92 -160.81 2.96 Favored Glycine 0 N--CA 1.491 2.306 0 N-CA-C 109.744 -1.342 . . . . 0.65 109.744 -179.919 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' D' D ' 326' ' ' GLU . . . . . . . . . . . . . 7.3 mt-10 -59.02 -169.29 0.01 OUTLIER 'General case' 0 N--CA 1.488 1.47 0 O-C-N 121.466 -1.02 . . . . 2.13 109.655 -179.92 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' D' D ' 327' ' ' TYR . . . . . 0.595 ' CE1' ' CG ' ' B' ' 333' ' ' ARG . 41.2 m-85 -149.96 115.52 5.53 Favored 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.354 -0.841 . . . . 1.0 109.422 -179.973 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' D' D ' 328' ' ' PHE . . . . . 0.515 ' CZ ' ' HB2' ' B' ' 335' ' ' ARG . 76.4 m-85 -113.49 -170.71 1.74 Allowed 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.317 -0.864 . . . . 0.34 109.313 179.934 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' D' D ' 329' ' ' THR . . . . . 0.481 ' HA ' ' O ' ' B' ' 330' ' ' LEU . 26.9 p -153.74 167.79 28.44 Favored 'General case' 0 N--CA 1.489 1.499 0 O-C-N 121.221 -0.924 . . . . 1.05 109.428 179.986 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' D' D ' 330' ' ' LEU . . . . . 0.473 ' O ' ' HA ' ' B' ' 329' ' ' THR . 14.7 tp -148.95 126.12 11.41 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.193 -0.942 . . . . 1.07 109.478 -179.946 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' D' D ' 331' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -86.28 111.52 20.52 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.218 -0.926 . . . . 0.93 109.55 -179.976 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' D' D ' 332' ' ' ILE . . . . . . . . . . . . . 31.8 mt -103.6 110.54 30.29 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.532 0 O-C-N 121.176 -0.953 . . . . 1.07 109.573 179.827 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' D' D ' 333' ' ' ARG . . . . . 0.534 ' CG ' ' CE1' ' B' ' 327' ' ' TYR . 2.4 mpt_? -72.69 143.22 48.16 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.313 -0.867 . . . . 3.42 109.239 179.847 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' D' D ' 334' ' ' GLY . . . . . . . . . . . . . . . 84.21 129.91 1.86 Allowed Glycine 0 N--CA 1.49 2.274 0 N-CA-C 109.539 -1.425 . . . . 0.41 109.539 -179.856 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' D' D ' 335' ' ' ARG . . . . . 0.495 ' HB2' ' CZ ' ' B' ' 328' ' ' PHE . 6.1 ttm180 -78.79 -28.65 44.63 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.193 -1.18 . . . . 3.58 109.6 -179.949 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' D' D ' 336' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -56.53 -67.17 0.33 Allowed 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.201 -0.937 . . . . 2.26 109.881 -179.779 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' D' D ' 337' ' ' ARG . . . . . 0.421 HH11 ' HG2' ' D' ' 337' ' ' ARG . 0.8 OUTLIER -60.53 -25.79 66.39 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.216 -0.927 . . . . 3.64 109.651 -179.669 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' D' D ' 338' ' ' PHE . . . . . 0.423 ' HB3' ' O ' ' D' ' 335' ' ' ARG . 67.8 t80 -55.47 -60.53 3.29 Favored 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.124 -0.985 . . . . 0.4 109.628 -179.968 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' D' D ' 339' ' ' GLU . . . . . . . . . . . . . 77.2 mt-10 -51.35 -31.84 23.51 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.305 -0.872 . . . . 1.99 109.998 -179.725 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' D' D ' 340' ' ' MET . . . . . . . . . . . . . 9.4 ttp -63.25 -52.65 61.24 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.132 -0.98 . . . . 1.13 109.959 -179.604 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' D' D ' 341' ' ' PHE . . . . . . . . . . . . . 48.6 m-85 -61.57 -41.86 98.01 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.183 -0.948 . . . . 0.21 109.786 -179.633 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' D' D ' 342' ' ' ARG . . . . . 0.498 ' NH1' ' HG2' ' D' ' 342' ' ' ARG . 0.0 OUTLIER -50.72 -41.96 56.76 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.241 -0.912 . . . . 3.15 109.845 -179.809 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' D' D ' 343' ' ' GLU . . . . . . . . . . . . . 28.3 tt0 -59.54 -50.56 73.44 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.258 -0.901 . . . . 2.35 110.251 -179.478 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' D' D ' 344' ' ' LEU . . . . . . . . . . . . . 40.3 mt -61.47 -29.85 70.22 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.143 -0.973 . . . . 1.06 109.834 -179.463 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' D' D ' 345' ' ' ASN . . . . . 0.41 ' O ' ' HG3' ' D' ' 349' ' ' GLU . 29.3 t-20 -57.59 -57.02 14.53 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.173 -0.954 . . . . 1.35 110.002 -179.659 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' D' D ' 346' ' ' GLU . . . . . . . . . . . . . 70.6 tt0 -61.47 -29.56 70.04 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.182 -0.949 . . . . 1.69 110.203 -179.427 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' D' D ' 347' ' ' ALA . . . . . . . . . . . . . . . -60.07 -55.69 30.89 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.059 -1.026 . . . . 1.03 110.096 -179.562 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' D' D ' 348' ' ' LEU . . . . . 0.509 ' N ' HD23 ' D' ' 348' ' ' LEU . 4.2 mm? -62.07 -44.43 96.69 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.234 -0.916 . . . . 1.04 110.074 -179.409 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' D' D ' 349' ' ' GLU . . . . . 0.41 ' HG3' ' O ' ' D' ' 345' ' ' ASN . 56.9 mt-10 -57.64 -35.65 70.79 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.209 -0.932 . . . . 1.95 109.953 -179.479 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' D' D ' 350' ' ' LEU . . . . . 0.523 HD21 ' CD1' ' C' ' 350' ' ' LEU . 6.1 tt -64.49 -40.07 94.98 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.211 -0.93 . . . . 1.16 109.736 -179.847 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' D' D ' 351' ' ' LYS . . . . . . . . . . . . . 2.3 ttmt -58.02 -56.35 23.2 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.282 -0.886 . . . . 1.97 109.829 -179.633 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' D' D ' 352' ' ' ASP . . . . . . . . . . . . . 11.9 m-20 -56.97 -37.33 71.42 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.145 -0.972 . . . . 1.17 109.773 -179.769 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' D' D ' 353' ' ' ALA . . . . . . . . . . . . . . . -67.4 -26.26 66.35 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.226 -0.921 . . . . 1.21 110.065 -179.493 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' D' D ' 354' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -83.73 -12.54 55.67 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.042 -1.036 . . . . 1.68 109.915 -179.723 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' D' D ' 355' ' ' ALA . . . . . . . . . . . . . . . -73.1 -22.08 60.64 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.035 -1.04 . . . . 1.29 109.363 179.751 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' D' D ' 356' ' ' GLY . . . . . . . . . . . . . . . -81.6 17.0 16.33 Favored Glycine 0 N--CA 1.491 2.341 0 N-CA-C 110.275 -1.13 . . . . 1.28 110.275 -179.959 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' D' D ' 357' ' ' LYS . . . . . . . . . . . . . 41.0 tttt -85.52 111.7 20.25 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 120.941 -1.329 . . . . 4.45 109.653 -179.675 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' D' D ' 358' ' ' GLU . . . . . . . . . . . . . 5.2 mt-10 -48.66 112.93 2.62 Favored Pre-proline 0 N--CA 1.49 1.528 0 O-C-N 121.249 -0.907 . . . . 5.71 109.347 179.826 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' D' D ' 359' ' ' PRO . . . . . . . . . . . . . 2.3 Cg_endo -61.56 137.66 70.64 Favored 'Trans proline' 0 C--N 1.312 -1.378 0 C-N-CA 121.996 1.797 . . . . 5.6 110.25 -179.88 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' D' D ' 360' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.334 0 CA-C-O 117.963 -1.465 . . . . 6.97 109.562 -179.972 . . . . . . . . 0 0 . 1 . 022 nuclear orig full ' A' A ' 319' ' ' LYS . . . . . . . . . . . . . 1.2 mtpt . . . . . 0 N--CA 1.49 1.541 0 CA-C-O 121.234 0.54 . . . . 7.95 109.572 . . . . . . . . . 0 0 . 1 . 022 nuclear orig full ' A' A ' 320' ' ' LYS . . . . . 0.428 ' C ' ' CG ' ' A' ' 321' ' ' LYS . 4.6 mttm 62.96 168.15 0.13 Allowed 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.357 -0.839 . . . . 6.71 109.811 179.838 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 321' ' ' LYS . . . . . 0.428 ' CG ' ' C ' ' A' ' 320' ' ' LYS . 26.2 mtmt -156.78 91.52 2.49 Favored Pre-proline 0 N--CA 1.491 1.584 0 O-C-N 121.407 -0.808 . . . . 6.5 109.125 179.779 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 322' ' ' PRO . . . . . . . . . . . . . 2.1 Cg_endo -68.13 -1.05 6.41 Favored 'Trans proline' 0 C--N 1.31 -1.487 0 C-N-CA 122.243 1.962 . . . . 3.3 110.954 -179.628 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 323' ' ' LEU . . . . . . . . . . . . . 25.7 mt -80.79 90.69 5.86 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 120.787 -1.195 . . . . 3.16 109.424 179.997 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 324' ' ' ASP . . . . . . . . . . . . . 14.3 m-20 -84.29 -154.8 0.17 Allowed 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.244 -0.91 . . . . 1.53 109.485 179.922 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 325' ' ' GLY . . . . . . . . . . . . . . . -69.85 -161.46 3.17 Favored Glycine 0 N--CA 1.491 2.354 0 N-CA-C 109.709 -1.356 . . . . 0.67 109.709 179.887 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 326' ' ' GLU . . . . . . . . . . . . . 7.1 mt-10 -59.18 -170.32 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.246 -1.149 . . . . 2.13 109.404 179.963 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 327' ' ' TYR . . . . . 0.592 ' CE1' ' HG2' ' C' ' 333' ' ' ARG . 45.4 m-85 -149.85 112.28 4.71 Favored 'General case' 0 N--CA 1.489 1.491 0 O-C-N 121.249 -0.907 . . . . 1.0 109.838 -179.997 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 328' ' ' PHE . . . . . . . . . . . . . 75.5 m-85 -113.71 -173.85 2.35 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.341 -0.85 . . . . 0.34 109.171 179.709 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 329' ' ' THR . . . . . . . . . . . . . 73.2 p -153.38 164.21 38.56 Favored 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.184 -0.948 . . . . 1.05 109.268 -179.891 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 330' ' ' LEU . . . . . . . . . . . . . 15.4 tp -149.74 125.93 10.7 Favored 'General case' 0 N--CA 1.488 1.46 0 O-C-N 121.207 -0.933 . . . . 1.07 109.666 -179.853 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 331' ' ' GLN . . . . . . . . . . . . . 1.6 tt0 -87.4 114.44 24.01 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.302 -0.874 . . . . 0.91 109.321 179.817 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 332' ' ' ILE . . . . . . . . . . . . . 57.9 mt -103.37 104.42 16.62 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.592 0 O-C-N 121.261 -0.9 . . . . 1.09 109.739 -179.867 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 333' ' ' ARG . . . . . . . . . . . . . 9.9 mtm180 -72.05 139.17 48.36 Favored 'General case' 0 N--CA 1.488 1.456 0 O-C-N 121.322 -0.861 . . . . 3.41 109.246 179.64 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 334' ' ' GLY . . . . . . . . . . . . . . . 92.89 131.53 5.77 Favored Glycine 0 N--CA 1.49 2.298 0 N-CA-C 109.407 -1.477 . . . . 0.4 109.407 -179.789 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 335' ' ' ARG . . . . . . . . . . . . . 2.0 ttt180 -78.21 -32.92 50.19 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.303 -1.116 . . . . 3.55 109.488 -179.855 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 336' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -58.17 -61.5 2.52 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.133 -0.979 . . . . 2.29 109.696 -179.895 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 337' ' ' ARG . . . . . . . . . . . . . 5.3 mtt180 -60.45 -34.56 74.18 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.173 -0.955 . . . . 3.64 109.705 -179.889 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 338' ' ' PHE . . . . . . . . . . . . . 78.8 t80 -54.05 -60.45 3.32 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.222 -0.924 . . . . 0.41 109.631 -179.704 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 339' ' ' GLU . . . . . . . . . . . . . 95.7 mt-10 -50.89 -33.88 25.94 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.216 -0.928 . . . . 1.97 109.999 -179.615 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 340' ' ' MET . . . . . . . . . . . . . 32.2 ttp -64.01 -50.98 66.36 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.068 -1.02 . . . . 1.14 110.063 -179.635 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 341' ' ' PHE . . . . . . . . . . . . . 37.1 m-85 -61.57 -47.56 84.94 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.128 -0.983 . . . . 0.21 109.78 -179.497 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 342' ' ' ARG . . . . . . . . . . . . . 1.4 ttt180 -49.46 -39.4 33.3 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.173 -0.954 . . . . 3.15 109.598 -179.913 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 343' ' ' GLU . . . . . . . . . . . . . 2.7 tt0 -58.51 -49.47 77.28 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.14 -0.975 . . . . 2.35 109.437 -179.95 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 344' ' ' LEU . . . . . 0.444 ' CD2' HD21 ' B' ' 344' ' ' LEU . 73.9 mt -62.3 -29.7 70.62 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.278 -0.889 . . . . 1.06 109.334 179.824 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 345' ' ' ASN . . . . . . . . . . . . . 11.2 t-20 -57.77 -54.17 49.92 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.323 -0.861 . . . . 1.36 109.581 179.907 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 346' ' ' GLU . . . . . . . . . . . . . 1.2 tp10 -62.13 -28.68 69.81 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.279 -0.888 . . . . 1.65 109.785 -179.768 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 347' ' ' ALA . . . . . . . . . . . . . . . -61.76 -62.2 1.97 Allowed 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.116 -0.99 . . . . 1.03 110.032 -179.632 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 348' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -61.36 -44.61 96.87 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.259 -0.901 . . . . 1.04 110.112 -179.369 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 349' ' ' GLU . . . . . . . . . . . . . 3.1 mt-10 -56.9 -35.77 69.36 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.188 -0.945 . . . . 1.94 109.83 -179.388 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 350' ' ' LEU . . . . . 0.551 HD21 ' CD1' ' B' ' 350' ' ' LEU . 5.9 tt -64.93 -45.67 84.84 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.243 -0.91 . . . . 1.17 109.669 -179.962 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 351' ' ' LYS . . . . . . . . . . . . . 22.0 tttt -59.06 -41.21 87.39 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.246 -0.909 . . . . 1.97 109.303 -179.983 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 352' ' ' ASP . . . . . . . . . . . . . 11.9 m-20 -56.39 -50.22 72.22 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.33 -0.856 . . . . 1.16 109.494 179.855 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 353' ' ' ALA . . . . . . . . . . . . . . . -68.63 -15.8 63.64 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.375 -0.828 . . . . 1.22 109.566 179.987 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 354' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -82.75 -7.02 59.68 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.21 -0.931 . . . . 1.71 109.58 -179.968 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 355' ' ' ALA . . . . . . . . . . . . . . . -70.53 -5.0 25.79 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.215 -0.928 . . . . 1.3 109.623 179.957 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 356' ' ' GLY . . . . . . . . . . . . . . . -75.25 -83.07 0.42 Allowed Glycine 0 N--CA 1.49 2.262 0 N-CA-C 109.379 -1.488 . . . . 1.3 109.379 179.793 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 357' ' ' LYS . . . . . . . . . . . . . 2.4 tttt -86.54 136.47 33.06 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.254 -1.145 . . . . 4.46 109.182 179.832 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 358' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -49.06 159.87 0.55 Allowed Pre-proline 0 N--CA 1.489 1.497 0 O-C-N 121.177 -0.952 . . . . 5.75 109.429 -179.859 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 359' ' ' PRO . . . . . . . . . . . . . 2.5 Cg_endo -61.56 150.33 85.86 Favored 'Trans proline' 0 C--N 1.309 -1.519 0 C-N-CA 122.301 2.001 . . . . 5.63 110.149 179.941 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 360' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.298 0 CA-C-O 117.945 -1.475 . . . . 6.97 109.572 -179.926 . . . . . . . . 0 0 . 1 . 022 nuclear orig full ' B' B ' 319' ' ' LYS . . . . . . . . . . . . . 1.3 mtpt . . . . . 0 N--CA 1.49 1.532 0 CA-C-O 121.279 0.562 . . . . 7.95 109.509 . . . . . . . . . 0 0 . 1 . 022 nuclear orig full ' B' B ' 320' ' ' LYS . . . . . 0.445 ' O ' ' CG ' ' B' ' 321' ' ' LYS . 4.7 mttm 63.22 168.52 0.14 Allowed 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.392 -0.818 . . . . 6.73 109.831 179.854 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' B' B ' 321' ' ' LYS . . . . . 0.445 ' CG ' ' O ' ' B' ' 320' ' ' LYS . 27.1 mtmt -157.05 91.1 2.45 Favored Pre-proline 0 N--CA 1.491 1.582 0 O-C-N 121.38 -0.825 . . . . 6.5 109.209 179.91 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' B' B ' 322' ' ' PRO . . . . . . . . . . . . . 2.3 Cg_endo -68.03 -0.93 6.16 Favored 'Trans proline' 0 C--N 1.309 -1.544 0 C-N-CA 122.267 1.978 . . . . 3.29 111.018 -179.609 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 323' ' ' LEU . . . . . . . . . . . . . 25.8 mt -80.93 90.41 5.93 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 120.817 -1.177 . . . . 3.18 109.535 179.9 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 324' ' ' ASP . . . . . . . . . . . . . 13.0 m-20 -84.11 -154.14 0.16 Allowed 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.235 -0.916 . . . . 1.53 109.68 179.849 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 325' ' ' GLY . . . . . . . . . . . . . . . -70.59 -161.44 3.79 Favored Glycine 0 N--CA 1.49 2.272 0 N-CA-C 109.596 -1.402 . . . . 0.65 109.596 -179.92 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 326' ' ' GLU . . . . . . . . . . . . . 7.2 mt-10 -58.92 -170.44 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.287 -1.125 . . . . 2.13 109.536 179.983 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 327' ' ' TYR . . . . . . . . . . . . . 44.2 m-85 -149.76 112.26 4.73 Favored 'General case' 0 N--CA 1.489 1.493 0 O-C-N 121.272 -0.893 . . . . 0.99 109.732 -179.97 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 328' ' ' PHE . . . . . 0.475 ' CB ' ' CD1' ' D' ' 338' ' ' PHE . 75.8 m-85 -113.74 -173.72 2.33 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.323 -0.861 . . . . 0.36 109.146 179.676 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' B' B ' 329' ' ' THR . . . . . . . . . . . . . 71.6 p -153.47 164.51 38.07 Favored 'General case' 0 N--CA 1.488 1.429 0 O-C-N 121.272 -0.892 . . . . 1.05 109.363 179.921 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 330' ' ' LEU . . . . . . . . . . . . . 15.8 tp -149.89 126.47 10.93 Favored 'General case' 0 C--N 1.302 -1.457 0 O-C-N 121.215 -0.928 . . . . 1.07 109.556 -179.842 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 331' ' ' GLN . . . . . . . . . . . . . 1.6 tt0 -87.85 114.6 24.62 Favored 'General case' 0 N--CA 1.489 1.493 0 O-C-N 121.258 -0.901 . . . . 0.91 109.276 179.829 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 332' ' ' ILE . . . . . . . . . . . . . 57.8 mt -103.41 104.59 16.9 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.493 0 O-C-N 121.217 -0.927 . . . . 1.08 109.709 -179.878 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 333' ' ' ARG . . . . . . . . . . . . . 10.3 mtm180 -72.25 139.06 47.9 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.237 -0.914 . . . . 3.42 109.12 179.717 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 334' ' ' GLY . . . . . . . . . . . . . . . 92.94 131.94 5.93 Favored Glycine 0 N--CA 1.491 2.326 0 N-CA-C 109.392 -1.483 . . . . 0.4 109.392 -179.776 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 335' ' ' ARG . . . . . 0.45 ' HA ' ' CE1' ' D' ' 328' ' ' PHE . 2.0 ttt180 -78.53 -32.93 48.21 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.209 -1.171 . . . . 3.55 109.587 -179.855 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' B' B ' 336' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -58.08 -61.75 2.32 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.235 -0.916 . . . . 2.28 109.633 -179.983 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' B' B ' 337' ' ' ARG . . . . . . . . . . . . . 5.0 mtt180 -60.2 -34.79 74.11 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.242 -0.911 . . . . 3.64 109.695 -179.756 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 338' ' ' PHE . . . . . 0.502 ' CD1' ' HB2' ' D' ' 328' ' ' PHE . 79.9 t80 -53.87 -60.55 3.18 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.319 -0.863 . . . . 0.39 109.763 -179.833 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' B' B ' 339' ' ' GLU . . . . . . . . . . . . . 95.0 mt-10 -50.94 -33.76 25.8 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.233 -0.917 . . . . 1.98 110.114 -179.632 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 340' ' ' MET . . . . . . . . . . . . . 32.7 ttp -64.34 -50.44 67.77 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.101 -0.999 . . . . 1.14 109.975 -179.607 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 341' ' ' PHE . . . . . . . . . . . . . 37.4 m-85 -61.87 -47.2 86.06 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.174 -0.954 . . . . 0.22 110.0 -179.69 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 342' ' ' ARG . . . . . . . . . . . . . 1.5 ttt180 -49.84 -39.3 38.53 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.155 -0.966 . . . . 3.15 109.605 179.947 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 343' ' ' GLU . . . . . . . . . . . . . 2.7 tt0 -58.52 -49.68 76.49 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.292 -0.88 . . . . 2.35 109.352 -179.991 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 344' ' ' LEU . . . . . 0.444 HD21 ' CD2' ' A' ' 344' ' ' LEU . 74.6 mt -62.25 -29.59 70.51 Favored 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.298 -0.876 . . . . 1.05 109.295 179.884 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' B' B ' 345' ' ' ASN . . . . . . . . . . . . . 11.4 t-20 -57.96 -54.07 51.04 Favored 'General case' 0 N--CA 1.488 1.472 0 O-C-N 121.283 -0.886 . . . . 1.35 109.462 -179.946 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 346' ' ' GLU . . . . . . . . . . . . . 1.2 tp10 -62.15 -28.93 69.99 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.287 -0.883 . . . . 1.66 109.765 -179.75 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 347' ' ' ALA . . . . . . . . . . . . . . . -61.76 -61.85 2.21 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.191 -0.943 . . . . 1.02 110.209 -179.625 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 348' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -61.66 -44.56 96.73 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.151 -0.968 . . . . 1.05 110.074 -179.445 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 349' ' ' GLU . . . . . . . . . . . . . 3.1 mt-10 -56.7 -35.98 69.13 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.167 -0.958 . . . . 1.95 109.848 -179.444 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 350' ' ' LEU . . . . . 0.551 ' CD1' HD21 ' A' ' 350' ' ' LEU . 6.0 tt -64.72 -45.78 85.08 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.177 -0.952 . . . . 1.18 109.596 -179.946 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' B' B ' 351' ' ' LYS . . . . . . . . . . . . . 22.1 tttt -58.93 -41.21 86.81 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.365 -0.834 . . . . 1.96 109.283 -179.922 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 352' ' ' ASP . . . . . . . . . . . . . 12.1 m-20 -56.28 -50.45 71.34 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.31 -0.869 . . . . 1.16 109.422 179.862 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 353' ' ' ALA . . . . . . . . . . . . . . . -68.68 -15.63 63.58 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.287 -0.883 . . . . 1.21 109.501 -179.909 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 354' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -82.91 -6.95 59.68 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.193 -0.942 . . . . 1.69 109.561 -179.957 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' B' B ' 355' ' ' ALA . . . . . . . . . . . . . . . -70.68 -4.88 25.8 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.223 -0.923 . . . . 1.3 109.629 -179.923 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 356' ' ' GLY . . . . . . . . . . . . . . . -75.41 -82.98 0.44 Allowed Glycine 0 N--CA 1.49 2.291 0 N-CA-C 109.386 -1.486 . . . . 1.29 109.386 179.86 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 357' ' ' LYS . . . . . . . . . . . . . 2.3 tttt -86.66 135.96 33.21 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.275 -1.133 . . . . 4.45 109.209 179.751 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 358' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -48.8 159.72 0.53 Allowed Pre-proline 0 N--CA 1.489 1.514 0 O-C-N 121.211 -0.931 . . . . 5.72 109.555 -179.829 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' B' B ' 359' ' ' PRO . . . . . . . . . . . . . 2.5 Cg_endo -61.5 150.41 85.36 Favored 'Trans proline' 0 C--N 1.31 -1.495 0 C-N-CA 122.192 1.928 . . . . 5.6 110.219 179.851 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 360' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.276 0 CA-C-O 118.015 -1.436 . . . . 6.98 109.563 -179.992 . . . . . . . . 0 0 . 1 . 022 nuclear orig full ' C' C ' 319' ' ' LYS . . . . . . . . . . . . . 2.5 ttmt . . . . . 0 N--CA 1.491 1.616 0 N-CA-C 109.407 -0.59 . . . . 7.03 109.407 . . . . . . . . . 0 0 . 1 . 022 nuclear orig full ' C' C ' 320' ' ' LYS . . . . . 0.461 ' O ' ' HG3' ' C' ' 321' ' ' LYS . 0.0 OUTLIER 68.75 -162.85 0.19 Allowed 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.254 -0.904 . . . . 6.84 109.596 -179.939 . . . . . . . . 3 3 . 1 . 022 nuclear orig full ' C' C ' 321' ' ' LYS . . . . . 0.461 ' HG3' ' O ' ' C' ' 320' ' ' LYS . 4.5 mttt -157.11 158.78 31.27 Favored Pre-proline 0 N--CA 1.491 1.581 0 O-C-N 121.287 -0.883 . . . . 6.78 109.49 -179.809 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' C' C ' 322' ' ' PRO . . . . . . . . . . . . . 2.7 Cg_endo -60.86 171.05 3.98 Favored 'Trans proline' 0 C--N 1.309 -1.501 0 C-N-CA 122.273 1.982 . . . . 3.98 110.306 179.812 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' C' C ' 323' ' ' LEU . . . . . . . . . . . . . 56.2 mt -80.61 149.51 29.84 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.248 -0.908 . . . . 4.31 109.605 179.909 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' C' C ' 324' ' ' ASP . . . . . . . . . . . . . 8.7 m-20 -78.67 165.9 23.12 Favored 'General case' 0 N--CA 1.489 1.494 0 O-C-N 121.243 -0.911 . . . . 1.63 108.897 179.607 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' C' C ' 325' ' ' GLY . . . . . . . . . . . . . . . -66.86 167.7 37.88 Favored Glycine 0 N--CA 1.49 2.245 0 N-CA-C 109.53 -1.428 . . . . 0.82 109.53 -179.808 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' C' C ' 326' ' ' GLU . . . . . . . . . . . . . 3.6 mp0 -58.11 -169.39 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.297 -1.12 . . . . 2.17 109.355 -179.899 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' C' C ' 327' ' ' TYR . . . . . . . . . . . . . 38.4 m-85 -150.18 105.56 3.38 Favored 'General case' 0 N--CA 1.488 1.451 0 O-C-N 121.234 -0.916 . . . . 1.03 110.085 179.922 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' C' C ' 328' ' ' PHE . . . . . . . . . . . . . 87.8 m-85 -113.97 -174.42 2.47 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.455 -0.778 . . . . 0.37 108.94 179.531 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' C' C ' 329' ' ' THR . . . . . . . . . . . . . 19.8 p -151.55 164.41 36.89 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.108 -0.995 . . . . 1.04 109.466 -179.942 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' C' C ' 330' ' ' LEU . . . . . . . . . . . . . 15.1 tp -150.86 130.52 13.12 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.151 -0.968 . . . . 1.09 109.824 -179.742 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' C' C ' 331' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -88.51 112.48 23.05 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.342 -0.849 . . . . 1.48 109.394 179.691 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' C' C ' 332' ' ' ILE . . . . . 0.47 HD12 ' CD2' ' C' ' 341' ' ' PHE . 64.5 mt -103.68 102.81 14.22 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.653 0 O-C-N 121.138 -0.976 . . . . 1.08 109.994 -179.83 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' C' C ' 333' ' ' ARG . . . . . 0.592 ' HG2' ' CE1' ' A' ' 327' ' ' TYR . 2.4 mtp180 -72.69 156.32 39.07 Favored 'General case' 0 N--CA 1.488 1.47 0 O-C-N 121.262 -0.899 . . . . 3.36 109.201 179.518 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' C' C ' 334' ' ' GLY . . . . . . . . . . . . . . . 80.06 128.92 0.75 Allowed Glycine 0 N--CA 1.491 2.329 0 N-CA-C 109.66 -1.376 . . . . 0.35 109.66 179.856 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' C' C ' 335' ' ' ARG . . . . . . . . . . . . . 20.8 ttt180 -79.28 -33.03 43.76 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.401 -1.058 . . . . 3.23 109.508 -179.999 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' C' C ' 336' ' ' GLU . . . . . 0.457 ' HA ' ' OE1' ' C' ' 339' ' ' GLU . 0.0 OUTLIER -58.08 -62.05 2.1 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.189 -0.944 . . . . 2.62 109.773 -179.781 . . . . . . . . 3 3 . 1 . 022 nuclear orig full ' C' C ' 337' ' ' ARG . . . . . 0.553 ' HG2' ' NH1' ' C' ' 337' ' ' ARG . 0.1 OUTLIER -59.85 -30.88 69.26 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.235 -0.916 . . . . 3.61 109.843 -179.672 . . . . . . . . 3 3 . 1 . 022 nuclear orig full ' C' C ' 338' ' ' PHE . . . . . . . . . . . . . 72.4 t80 -55.53 -54.87 38.59 Favored 'General case' 0 N--CA 1.488 1.457 0 O-C-N 121.158 -0.963 . . . . 0.43 109.681 -179.911 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' C' C ' 339' ' ' GLU . . . . . 0.457 ' OE1' ' HA ' ' C' ' 336' ' ' GLU . 3.0 mt-10 -52.58 -39.24 61.37 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.204 -0.935 . . . . 2.05 110.325 -179.582 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' C' C ' 340' ' ' MET . . . . . . . . . . . . . 36.3 ttp -62.35 -46.25 89.53 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.157 -0.965 . . . . 1.1 110.0 -179.334 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' C' C ' 341' ' ' PHE . . . . . 0.47 ' CD2' HD12 ' C' ' 332' ' ' ILE . 32.7 m-85 -63.14 -43.22 98.95 Favored 'General case' 0 N--CA 1.489 1.5 0 O-C-N 121.174 -0.954 . . . . 0.21 110.021 -179.609 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' C' C ' 342' ' ' ARG . . . . . . . . . . . . . 39.7 ttt180 -51.96 -42.92 63.26 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.216 -0.927 . . . . 3.42 110.028 -179.773 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' C' C ' 343' ' ' GLU . . . . . . . . . . . . . 2.5 tt0 -57.32 -48.27 79.4 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.145 -0.972 . . . . 2.14 109.461 -179.649 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' C' C ' 344' ' ' LEU . . . . . 0.457 HD23 HD23 ' D' ' 344' ' ' LEU . 37.0 mt -62.96 -30.55 71.66 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.205 -0.935 . . . . 1.09 109.357 179.866 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' C' C ' 345' ' ' ASN . . . . . 0.439 ' O ' ' HG3' ' C' ' 349' ' ' GLU . 18.1 t-20 -59.07 -61.35 2.7 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.311 -0.868 . . . . 1.38 109.687 -179.829 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' C' C ' 346' ' ' GLU . . . . . . . . . . . . . 17.0 tp10 -61.22 -25.69 67.23 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.317 -0.864 . . . . 2.21 109.866 -179.608 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' C' C ' 347' ' ' ALA . . . . . . . . . . . . . . . -61.39 -58.34 8.6 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.215 -0.928 . . . . 1.03 109.987 -179.697 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' C' C ' 348' ' ' LEU . . . . . 0.512 HD23 ' N ' ' C' ' 348' ' ' LEU . 3.8 mm? -62.4 -44.39 96.56 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.208 -0.932 . . . . 1.06 110.147 -179.288 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' C' C ' 349' ' ' GLU . . . . . 0.439 ' HG3' ' O ' ' C' ' 345' ' ' ASN . 22.0 mt-10 -56.08 -38.6 70.91 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.141 -0.974 . . . . 2.19 109.887 -179.32 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' C' C ' 350' ' ' LEU . . . . . 0.527 ' CD1' HD21 ' D' ' 350' ' ' LEU . 6.1 tt -62.78 -40.37 97.11 Favored 'General case' 0 N--CA 1.489 1.493 0 O-C-N 121.156 -0.965 . . . . 1.2 109.537 -179.739 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' C' C ' 351' ' ' LYS . . . . . 0.5 ' HA ' ' OE1' ' C' ' 354' ' ' GLN . 11.3 tttt -60.19 -39.98 88.4 Favored 'General case' 0 N--CA 1.489 1.482 0 O-C-N 121.235 -0.915 . . . . 1.92 109.585 179.999 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' C' C ' 352' ' ' ASP . . . . . 0.456 ' OD1' ' N ' ' C' ' 352' ' ' ASP . 4.6 m-20 -59.25 -42.36 90.95 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.249 -0.907 . . . . 1.19 109.763 -179.99 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' C' C ' 353' ' ' ALA . . . . . . . . . . . . . . . -67.82 -14.78 63.23 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.251 -0.906 . . . . 1.15 110.081 -179.358 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' C' C ' 354' ' ' GLN . . . . . 0.541 ' OE1' ' CD1' ' D' ' 350' ' ' LEU . 36.6 mt-30 -82.37 -16.32 49.58 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.004 -1.06 . . . . 1.7 109.436 -179.943 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' C' C ' 355' ' ' ALA . . . . . . . . . . . . . . . -74.1 -3.04 27.12 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.232 -0.917 . . . . 1.3 109.803 179.628 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' C' C ' 356' ' ' GLY . . . . . . . . . . . . . . . -78.16 -43.46 13.41 Favored Glycine 0 N--CA 1.491 2.361 0 N-CA-C 109.901 -1.28 . . . . 1.33 109.901 -179.639 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' C' C ' 357' ' ' LYS . . . . . . . . . . . . . 23.0 pttt -85.45 128.07 34.61 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.12 -1.224 . . . . 4.39 109.273 -179.963 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' C' C ' 358' ' ' GLU . . . . . 0.44 ' OE2' ' HA3' ' C' ' 360' ' ' GLY . 0.2 OUTLIER -47.04 155.79 0.61 Allowed Pre-proline 0 N--CA 1.489 1.509 0 O-C-N 121.214 -0.928 . . . . 5.75 109.464 -179.775 . . . . . . . . 3 3 . 1 . 022 nuclear orig full ' C' C ' 359' ' ' PRO . . . . . . . . . . . . . 6.0 Cg_exo -58.01 86.33 0.05 OUTLIER 'Trans proline' 0 C--N 1.31 -1.488 0 C-N-CA 122.169 1.913 . . . . 5.54 110.336 -179.927 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' C' C ' 360' ' ' GLY . . . . . 0.44 ' HA3' ' OE2' ' C' ' 358' ' ' GLU . . . . . . . . 0 N--CA 1.49 2.287 0 N-CA-C 109.433 -1.467 . . . . 6.5 109.433 -179.964 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' D' D ' 319' ' ' LYS . . . . . . . . . . . . . 1.4 mtpt . . . . . 0 N--CA 1.491 1.576 0 CA-C-O 121.298 0.57 . . . . 7.93 109.517 . . . . . . . . . 0 0 . 1 . 022 nuclear orig full ' D' D ' 320' ' ' LYS . . . . . 0.441 ' O ' ' CG ' ' D' ' 321' ' ' LYS . 4.6 mttm 63.39 168.15 0.14 Allowed 'General case' 0 N--CA 1.489 1.492 0 O-C-N 121.333 -0.855 . . . . 6.7 109.878 179.894 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' D' D ' 321' ' ' LYS . . . . . 0.441 ' CG ' ' O ' ' D' ' 320' ' ' LYS . 27.3 mtmt -156.79 91.37 2.5 Favored Pre-proline 0 N--CA 1.491 1.593 0 O-C-N 121.486 -0.759 . . . . 6.49 109.212 179.897 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' D' D ' 322' ' ' PRO . . . . . . . . . . . . . 2.2 Cg_endo -68.14 -1.25 6.78 Favored 'Trans proline' 0 C--N 1.31 -1.478 0 C-N-CA 122.227 1.951 . . . . 3.29 111.037 -179.73 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' D' D ' 323' ' ' LEU . . . . . . . . . . . . . 27.3 mt -80.67 90.4 5.77 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 120.928 -1.107 . . . . 3.16 109.503 179.945 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' D' D ' 324' ' ' ASP . . . . . . . . . . . . . 13.8 m-20 -84.09 -154.23 0.16 Allowed 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.274 -0.891 . . . . 1.54 109.601 179.891 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' D' D ' 325' ' ' GLY . . . . . . . . . . . . . . . -70.24 -161.33 3.44 Favored Glycine 0 N--CA 1.49 2.281 0 N-CA-C 109.693 -1.363 . . . . 0.65 109.693 179.942 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' D' D ' 326' ' ' GLU . . . . . . . . . . . . . 6.9 mt-10 -59.38 -170.3 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.339 -1.094 . . . . 2.13 109.485 179.919 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' D' D ' 327' ' ' TYR . . . . . . . . . . . . . 44.5 m-85 -150.0 112.45 4.71 Favored 'General case' 0 N--CA 1.489 1.485 0 O-C-N 121.23 -0.919 . . . . 1.0 109.737 -179.935 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' D' D ' 328' ' ' PHE . . . . . 0.502 ' HB2' ' CD1' ' B' ' 338' ' ' PHE . 75.3 m-85 -113.78 -173.55 2.3 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.377 -0.827 . . . . 0.34 109.173 179.673 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' D' D ' 329' ' ' THR . . . . . . . . . . . . . 67.3 p -153.41 164.4 38.23 Favored 'General case' 0 N--CA 1.488 1.445 0 O-C-N 121.249 -0.907 . . . . 1.05 109.28 179.987 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' D' D ' 330' ' ' LEU . . . . . . . . . . . . . 15.4 tp -150.04 125.96 10.5 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.218 -0.926 . . . . 1.07 109.551 -179.837 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' D' D ' 331' ' ' GLN . . . . . . . . . . . . . 1.5 tt0 -87.24 114.7 24.08 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.367 -0.833 . . . . 0.93 109.327 179.799 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' D' D ' 332' ' ' ILE . . . . . . . . . . . . . 58.2 mt -103.3 104.55 16.82 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.514 0 O-C-N 121.089 -1.007 . . . . 1.07 109.741 -179.912 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' D' D ' 333' ' ' ARG . . . . . . . . . . . . . 10.4 mtm180 -72.34 138.67 47.46 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.176 -0.953 . . . . 3.42 109.243 179.728 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' D' D ' 334' ' ' GLY . . . . . . . . . . . . . . . 92.93 131.1 5.63 Favored Glycine 0 N--CA 1.49 2.3 0 N-CA-C 109.482 -1.447 . . . . 0.41 109.482 -179.78 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' D' D ' 335' ' ' ARG . . . . . 0.436 ' HA ' ' CE1' ' B' ' 328' ' ' PHE . 2.0 ttt180 -77.33 -33.15 55.55 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.225 -1.162 . . . . 3.58 109.675 -179.858 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' D' D ' 336' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -58.13 -61.13 2.78 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.129 -0.982 . . . . 2.26 109.722 -179.79 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' D' D ' 337' ' ' ARG . . . . . . . . . . . . . 5.4 mtt180 -60.97 -34.11 74.25 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.296 -0.878 . . . . 3.64 109.61 -179.812 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' D' D ' 338' ' ' PHE . . . . . 0.475 ' CD1' ' CB ' ' B' ' 328' ' ' PHE . 80.3 t80 -54.3 -60.41 3.37 Favored 'General case' 0 N--CA 1.488 1.453 0 O-C-N 121.221 -0.925 . . . . 0.4 109.725 -179.777 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' D' D ' 339' ' ' GLU . . . . . . . . . . . . . 94.2 mt-10 -51.15 -33.47 27.06 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.3 -0.875 . . . . 1.99 110.039 -179.673 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' D' D ' 340' ' ' MET . . . . . . . . . . . . . 33.1 ttp -64.45 -50.76 66.26 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.082 -1.011 . . . . 1.13 109.931 -179.587 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' D' D ' 341' ' ' PHE . . . . . . . . . . . . . 36.9 m-85 -61.56 -47.23 86.47 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.168 -0.957 . . . . 0.21 109.868 -179.525 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' D' D ' 342' ' ' ARG . . . . . . . . . . . . . 1.5 ttt180 -49.92 -39.49 40.33 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.157 -0.964 . . . . 3.15 109.558 -179.902 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' D' D ' 343' ' ' GLU . . . . . . . . . . . . . 2.8 tt0 -58.28 -49.8 75.87 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.294 -0.879 . . . . 2.35 109.398 -179.998 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' D' D ' 344' ' ' LEU . . . . . 0.457 HD23 HD23 ' C' ' 344' ' ' LEU . 75.9 mt -62.25 -29.5 70.44 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.184 -0.948 . . . . 1.06 109.293 179.761 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' D' D ' 345' ' ' ASN . . . . . . . . . . . . . 11.3 t-20 -58.0 -54.37 47.72 Favored 'General case' 0 C--N 1.303 -1.414 0 O-C-N 121.398 -0.813 . . . . 1.35 109.45 179.968 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' D' D ' 346' ' ' GLU . . . . . . . . . . . . . 1.2 tt0 -61.81 -29.06 69.9 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.308 -0.87 . . . . 1.69 109.827 -179.857 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' D' D ' 347' ' ' ALA . . . . . . . . . . . . . . . -61.73 -62.01 2.11 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.201 -0.937 . . . . 1.03 110.122 -179.66 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' D' D ' 348' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -61.52 -44.71 96.57 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.159 -0.963 . . . . 1.04 110.119 -179.394 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' D' D ' 349' ' ' GLU . . . . . . . . . . . . . 3.1 mt-10 -56.64 -35.54 68.46 Favored 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.13 -0.982 . . . . 1.95 109.859 -179.507 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' D' D ' 350' ' ' LEU . . . . . 0.541 ' CD1' ' OE1' ' C' ' 354' ' ' GLN . 6.0 tt -65.02 -45.75 84.17 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.154 -0.966 . . . . 1.16 109.576 -179.865 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' D' D ' 351' ' ' LYS . . . . . . . . . . . . . 21.8 tttt -59.03 -41.09 86.96 Favored 'General case' 0 C--N 1.304 -1.404 0 O-C-N 121.258 -0.901 . . . . 1.97 109.381 -179.877 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' D' D ' 352' ' ' ASP . . . . . . . . . . . . . 11.7 m-20 -56.38 -50.47 71.46 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.328 -0.858 . . . . 1.17 109.484 179.886 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' D' D ' 353' ' ' ALA . . . . . . . . . . . . . . . -68.68 -15.4 63.51 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.232 -0.918 . . . . 1.21 109.543 -179.953 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' D' D ' 354' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -83.09 -7.01 59.7 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.154 -0.966 . . . . 1.68 109.52 -179.991 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' D' D ' 355' ' ' ALA . . . . . . . . . . . . . . . -70.54 -4.93 25.41 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.174 -0.953 . . . . 1.29 109.557 179.986 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' D' D ' 356' ' ' GLY . . . . . . . . . . . . . . . -75.22 -83.46 0.4 Allowed Glycine 0 N--CA 1.491 2.344 0 N-CA-C 109.37 -1.492 . . . . 1.28 109.37 179.801 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' D' D ' 357' ' ' LYS . . . . . . . . . . . . . 2.3 tttt -86.32 136.03 33.3 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.313 -1.11 . . . . 4.45 109.206 179.813 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' D' D ' 358' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -49.02 159.47 0.57 Allowed Pre-proline 0 N--CA 1.489 1.524 0 O-C-N 121.153 -0.967 . . . . 5.71 109.446 -179.835 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' D' D ' 359' ' ' PRO . . . . . . . . . . . . . 2.6 Cg_endo -61.48 150.25 86.03 Favored 'Trans proline' 0 C--N 1.31 -1.499 0 C-N-CA 122.208 1.939 . . . . 5.6 110.213 -179.994 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' D' D ' 360' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.327 0 CA-C-O 117.958 -1.468 . . . . 6.97 109.59 179.961 . . . . . . . . 0 0 . 1 . 023 nuclear orig full ' A' A ' 319' ' ' LYS . . . . . . . . . . . . . 7.0 pttt . . . . . 0 N--CA 1.491 1.59 0 N-CA-C 109.41 -0.589 . . . . 7.95 109.41 . . . . . . . . . 0 0 . 1 . 023 nuclear orig full ' A' A ' 320' ' ' LYS . . . . . . . . . . . . . 38.5 mtmt 54.68 72.85 0.44 Allowed 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.318 -0.864 . . . . 6.71 109.294 -179.97 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 321' ' ' LYS . . . . . . . . . . . . . 7.8 mtpt -82.31 120.13 76.34 Favored Pre-proline 0 N--CA 1.49 1.536 0 O-C-N 121.237 -0.915 . . . . 6.5 109.208 -179.89 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 322' ' ' PRO . . . . . . . . . . . . . 5.0 Cg_exo -60.0 94.99 0.1 OUTLIER 'Trans proline' 0 C--N 1.313 -1.338 0 C-N-CA 121.85 1.7 . . . . 3.3 109.985 179.947 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 323' ' ' LEU . . . . . . . . . . . . . 75.9 mt -80.3 94.18 6.06 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.293 -0.879 . . . . 3.16 109.532 -179.884 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 324' ' ' ASP . . . . . . . . . . . . . 62.9 m-20 -84.09 88.73 7.19 Favored 'General case' 0 N--CA 1.489 1.477 0 O-C-N 121.134 -0.979 . . . . 1.53 109.072 179.536 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 325' ' ' GLY . . . . . 0.537 ' O ' ' CD1' ' A' ' 327' ' ' TYR . . . -71.34 -156.78 2.43 Favored Glycine 0 N--CA 1.49 2.276 0 N-CA-C 109.282 -1.527 . . . . 0.67 109.282 179.721 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 326' ' ' GLU . . . . . . . . . . . . . 59.2 mm-40 -58.6 168.92 1.03 Allowed 'General case' 0 N--CA 1.488 1.475 0 O-C-N 121.218 -1.166 . . . . 2.13 108.945 179.525 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 327' ' ' TYR . . . . . 0.537 ' CD1' ' O ' ' A' ' 325' ' ' GLY . 38.4 m-85 -148.64 105.36 3.57 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.169 -0.957 . . . . 1.0 109.634 179.697 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 328' ' ' PHE . . . . . . . . . . . . . 98.2 m-85 -107.33 -166.92 1.2 Allowed 'General case' 0 C--N 1.303 -1.445 0 N-CA-C 108.851 -0.796 . . . . 0.34 108.851 179.68 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 329' ' ' THR . . . . . . . . . . . . . 68.1 p -151.07 164.71 35.82 Favored 'General case' 0 C--N 1.301 -1.517 0 O-C-N 121.139 -0.976 . . . . 1.05 109.27 -179.984 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 330' ' ' LEU . . . . . . . . . . . . . 16.1 tp -148.76 131.77 16.25 Favored 'General case' 0 C--N 1.302 -1.474 0 O-C-N 121.236 -0.915 . . . . 1.07 109.377 -179.635 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 331' ' ' GLN . . . . . . . . . . . . . 1.6 tp60 -85.87 113.97 22.43 Favored 'General case' 0 N--CA 1.488 1.464 0 O-C-N 121.388 -0.82 . . . . 0.91 109.151 179.955 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 332' ' ' ILE . . . . . . . . . . . . . 53.9 mt -102.83 102.23 13.31 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.497 0 O-C-N 121.295 -0.878 . . . . 1.09 109.38 -179.827 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 333' ' ' ARG . . . . . . . . . . . . . 79.9 mtt180 -72.18 154.64 40.93 Favored 'General case' 0 N--CA 1.489 1.479 0 O-C-N 121.343 -0.848 . . . . 3.41 109.37 179.992 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 334' ' ' GLY . . . . . . . . . . . . . . . 80.07 134.24 1.23 Allowed Glycine 0 N--CA 1.491 2.339 0 N-CA-C 109.598 -1.401 . . . . 0.4 109.598 -179.86 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 335' ' ' ARG . . . . . 0.52 ' NH1' ' HG2' ' A' ' 335' ' ' ARG . 1.3 ttt-85 -79.93 -50.58 10.24 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.271 -1.135 . . . . 3.55 109.83 -179.782 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 336' ' ' GLU . . . . . . . . . . . . . 1.4 pt-20 -55.61 -48.29 75.13 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.179 -0.95 . . . . 2.29 109.611 -179.689 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 337' ' ' ARG . . . . . 0.442 ' NH1' ' CG ' ' A' ' 337' ' ' ARG . 0.0 OUTLIER -60.1 -35.08 74.44 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.209 -0.932 . . . . 3.64 109.474 179.97 . . . . . . . . 3 3 . 1 . 023 nuclear orig full ' A' A ' 338' ' ' PHE . . . . . . . . . . . . . 61.9 t80 -55.64 -55.69 29.19 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.321 -0.862 . . . . 0.41 109.531 179.998 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 339' ' ' GLU . . . . . . . . . . . . . 3.6 mm-40 -51.03 -32.68 22.34 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.339 -0.851 . . . . 1.97 110.118 -179.547 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 340' ' ' MET . . . . . . . . . . . . . 19.5 ttp -64.36 -52.92 55.95 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.151 -0.968 . . . . 1.14 110.198 -179.425 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 341' ' ' PHE . . . . . . . . . . . . . 39.8 m-85 -62.46 -46.08 90.14 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.195 -0.941 . . . . 0.21 110.208 -179.274 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 342' ' ' ARG . . . . . . . . . . . . . 10.0 ttp180 -48.51 -41.19 29.24 Favored 'General case' 0 N--CA 1.491 1.625 0 O-C-N 121.061 -1.025 . . . . 3.15 109.813 -179.827 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 343' ' ' GLU . . . . . . . . . . . . . 9.1 tp10 -59.31 -45.46 91.23 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.259 -0.901 . . . . 2.35 109.967 -179.709 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 344' ' ' LEU . . . . . 0.467 ' O ' HD21 ' A' ' 348' ' ' LEU . 53.1 mt -62.77 -44.64 95.66 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.256 -0.903 . . . . 1.06 110.024 -179.704 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 345' ' ' ASN . . . . . . . . . . . . . 54.7 t-20 -55.38 -49.52 72.12 Favored 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.172 -0.955 . . . . 1.36 109.872 -179.823 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 346' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -61.06 -36.16 78.86 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.243 -0.91 . . . . 1.65 109.585 -179.812 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 347' ' ' ALA . . . . . . . . . . . . . . . -60.14 -50.06 75.19 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.235 -0.915 . . . . 1.03 109.962 -179.806 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 348' ' ' LEU . . . . . 0.467 HD21 ' O ' ' A' ' 344' ' ' LEU . 3.6 mm? -62.24 -48.95 77.67 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.124 -0.985 . . . . 1.04 109.87 -179.63 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 349' ' ' GLU . . . . . . . . . . . . . 76.3 mt-10 -55.53 -35.41 65.63 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.162 -0.961 . . . . 1.94 109.7 -179.479 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 350' ' ' LEU . . . . . 0.519 HD21 ' CD1' ' B' ' 350' ' ' LEU . 5.6 tt -62.91 -45.3 93.17 Favored 'General case' 0 N--CA 1.488 1.472 0 O-C-N 121.266 -0.896 . . . . 1.17 109.216 179.843 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 351' ' ' LYS . . . . . . . . . . . . . 19.1 tttm -56.37 -38.66 71.74 Favored 'General case' 0 N--CA 1.488 1.469 0 O-C-N 121.365 -0.834 . . . . 1.97 109.481 179.982 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 352' ' ' ASP . . . . . 0.456 ' O ' ' HB1' ' A' ' 355' ' ' ALA . 4.7 m-20 -55.61 -45.97 77.39 Favored 'General case' 0 N--CA 1.489 1.495 0 O-C-N 121.223 -0.923 . . . . 1.16 109.429 179.784 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 353' ' ' ALA . . . . . . . . . . . . . . . -67.98 -28.26 67.28 Favored 'General case' 0 N--CA 1.489 1.494 0 O-C-N 121.309 -0.869 . . . . 1.22 109.172 179.734 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 354' ' ' GLN . . . . . . . . . . . . . 3.2 tt0 -81.3 0.92 34.84 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.321 -0.862 . . . . 1.71 109.471 179.756 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 355' ' ' ALA . . . . . 0.456 ' HB1' ' O ' ' A' ' 352' ' ' ASP . . . -69.25 -77.96 0.07 Allowed 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.264 -0.898 . . . . 1.3 109.512 -179.807 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 356' ' ' GLY . . . . . . . . . . . . . . . -81.62 58.48 4.88 Favored Glycine 0 N--CA 1.492 2.368 0 N-CA-C 110.432 -1.067 . . . . 1.3 110.432 -179.578 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 357' ' ' LYS . . . . . . . . . . . . . 13.6 ttmt -90.16 92.33 8.91 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 120.821 -1.399 . . . . 4.46 109.148 179.471 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 358' ' ' GLU . . . . . . . . . . . . . 34.9 tp10 -49.49 117.45 6.99 Favored Pre-proline 0 N--CA 1.49 1.561 0 O-C-N 121.14 -0.975 . . . . 5.75 109.484 -179.85 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 359' ' ' PRO . . . . . . . . . . . . . 2.8 Cg_endo -61.66 156.54 47.13 Favored 'Trans proline' 0 C--N 1.313 -1.322 0 C-N-CA 121.92 1.747 . . . . 5.63 109.939 179.81 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 360' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.216 0 N-CA-C 109.473 -1.451 . . . . 6.97 109.473 179.916 . . . . . . . . 0 0 . 1 . 023 nuclear orig full ' B' B ' 319' ' ' LYS . . . . . . . . . . . . . 7.3 pttt . . . . . 0 N--CA 1.492 1.628 0 N-CA-C 109.448 -0.575 . . . . 7.95 109.448 . . . . . . . . . 0 0 . 1 . 023 nuclear orig full ' B' B ' 320' ' ' LYS . . . . . . . . . . . . . 40.3 mtmt 54.81 72.53 0.46 Allowed 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.255 -0.903 . . . . 6.73 109.479 -179.892 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 321' ' ' LYS . . . . . . . . . . . . . 8.1 mtpt -81.74 120.6 78.17 Favored Pre-proline 0 N--CA 1.488 1.472 0 O-C-N 121.137 -0.977 . . . . 6.5 109.363 -179.999 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 322' ' ' PRO . . . . . . . . . . . . . 5.2 Cg_exo -59.88 95.48 0.1 OUTLIER 'Trans proline' 0 C--N 1.311 -1.401 0 C-N-CA 121.871 1.714 . . . . 3.29 109.954 179.844 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 323' ' ' LEU . . . . . . . . . . . . . 74.4 mt -80.6 93.82 6.18 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.298 -0.877 . . . . 3.18 109.593 -179.804 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 324' ' ' ASP . . . . . . . . . . . . . 62.8 m-20 -83.83 89.61 7.22 Favored 'General case' 0 C--N 1.305 -1.362 0 O-C-N 121.234 -0.916 . . . . 1.53 109.052 179.563 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 325' ' ' GLY . . . . . 0.548 ' O ' ' CD1' ' B' ' 327' ' ' TYR . . . -73.1 -157.1 3.91 Favored Glycine 0 N--CA 1.488 2.152 0 N-CA-C 109.111 -1.596 . . . . 0.65 109.111 179.913 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' B' B ' 326' ' ' GLU . . . . . . . . . . . . . 60.4 mm-40 -58.28 168.5 1.06 Allowed 'General case' 0 C--N 1.304 -1.395 0 O-C-N 121.093 -1.239 . . . . 2.13 108.96 179.746 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 327' ' ' TYR . . . . . 0.548 ' CD1' ' O ' ' B' ' 325' ' ' GLY . 39.2 m-85 -148.35 105.4 3.61 Favored 'General case' 0 C--N 1.301 -1.517 0 O-C-N 121.156 -0.965 . . . . 0.99 109.614 179.846 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' B' B ' 328' ' ' PHE . . . . . . . . . . . . . 98.2 m-85 -107.54 -166.91 1.19 Allowed 'General case' 0 N--CA 1.488 1.455 0 N-CA-C 108.772 -0.825 . . . . 0.36 108.772 179.752 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 329' ' ' THR . . . . . . . . . . . . . 69.7 p -151.04 164.89 35.39 Favored 'General case' 0 C--N 1.301 -1.52 0 O-C-N 121.151 -0.968 . . . . 1.05 109.235 -179.988 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 330' ' ' LEU . . . . . . . . . . . . . 15.7 tp -148.95 131.6 15.9 Favored 'General case' 0 C--N 1.303 -1.445 0 O-C-N 121.189 -0.945 . . . . 1.07 109.386 -179.689 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 331' ' ' GLN . . . . . . . . . . . . . 1.6 tp60 -85.62 113.87 22.17 Favored 'General case' 0 C--N 1.303 -1.432 0 O-C-N 121.347 -0.845 . . . . 0.91 109.203 179.943 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 332' ' ' ILE . . . . . . . . . . . . . 52.4 mt -102.68 102.57 13.78 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.484 0 O-C-N 121.172 -0.955 . . . . 1.08 109.44 -179.967 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 333' ' ' ARG . . . . . 0.404 ' HG2' ' CE2' ' D' ' 327' ' ' TYR . 80.2 mtt180 -72.39 154.71 40.76 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.458 -0.776 . . . . 3.42 109.434 -179.911 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' B' B ' 334' ' ' GLY . . . . . . . . . . . . . . . 79.85 134.54 1.21 Allowed Glycine 0 N--CA 1.491 2.316 0 N-CA-C 109.437 -1.465 . . . . 0.4 109.437 -179.899 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 335' ' ' ARG . . . . . 0.525 ' HG2' ' NH1' ' B' ' 335' ' ' ARG . 1.4 ttt-85 -80.15 -50.37 10.38 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.287 -1.125 . . . . 3.55 109.868 -179.866 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' B' B ' 336' ' ' GLU . . . . . . . . . . . . . 1.3 pt-20 -55.54 -48.12 75.23 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.218 -0.926 . . . . 2.28 109.644 -179.715 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 337' ' ' ARG . . . . . 0.441 ' CG ' ' NH1' ' B' ' 337' ' ' ARG . 0.0 OUTLIER -60.27 -35.22 75.03 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.199 -0.938 . . . . 3.64 109.453 179.966 . . . . . . . . 3 3 . 1 . 023 nuclear orig full ' B' B ' 338' ' ' PHE . . . . . . . . . . . . . 62.3 t80 -55.55 -55.95 25.96 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.246 -0.909 . . . . 0.39 109.563 -179.998 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 339' ' ' GLU . . . . . . . . . . . . . 3.5 mm-40 -50.92 -32.37 20.49 Favored 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.233 -0.917 . . . . 1.98 110.113 -179.6 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 340' ' ' MET . . . . . . . . . . . . . 19.4 ttp -64.56 -52.97 54.88 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.146 -0.972 . . . . 1.14 110.155 -179.457 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 341' ' ' PHE . . . . . . . . . . . . . 40.1 m-85 -62.56 -46.07 90.01 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.166 -0.959 . . . . 0.22 110.254 -179.246 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 342' ' ' ARG . . . . . . . . . . . . . 10.1 ttp180 -48.46 -41.13 28.64 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.046 -1.034 . . . . 3.15 109.771 -179.752 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 343' ' ' GLU . . . . . . . . . . . . . 9.2 tp10 -59.35 -45.55 91.09 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.238 -0.914 . . . . 2.35 109.908 -179.668 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 344' ' ' LEU . . . . . 0.461 ' O ' HD21 ' B' ' 348' ' ' LEU . 49.2 mt -62.91 -44.57 95.72 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.288 -0.883 . . . . 1.05 109.968 -179.607 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' B' B ' 345' ' ' ASN . . . . . . . . . . . . . 55.7 t-20 -55.4 -49.68 71.75 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.22 -0.925 . . . . 1.35 109.685 -179.704 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 346' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -60.81 -36.16 78.34 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.215 -0.928 . . . . 1.66 109.599 -179.773 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' B' B ' 347' ' ' ALA . . . . . . . . . . . . . . . -60.34 -49.92 75.68 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.153 -0.967 . . . . 1.02 109.926 -179.816 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 348' ' ' LEU . . . . . 0.461 HD21 ' O ' ' B' ' 344' ' ' LEU . 3.7 mm? -62.25 -49.04 77.28 Favored 'General case' 0 N--CA 1.493 1.692 0 O-C-N 121.182 -0.949 . . . . 1.05 109.834 -179.67 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' B' B ' 349' ' ' GLU . . . . . . . . . . . . . 77.5 mt-10 -55.43 -35.58 65.57 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.251 -0.906 . . . . 1.95 109.642 -179.479 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 350' ' ' LEU . . . . . 0.519 ' CD1' HD21 ' A' ' 350' ' ' LEU . 5.7 tt -62.88 -45.18 93.76 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.255 -0.903 . . . . 1.18 109.247 179.905 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' B' B ' 351' ' ' LYS . . . . . . . . . . . . . 19.2 tttm -56.38 -38.64 71.73 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.309 -0.869 . . . . 1.96 109.412 179.922 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 352' ' ' ASP . . . . . 0.445 ' O ' ' HB1' ' B' ' 355' ' ' ALA . 4.9 m-20 -55.6 -46.03 77.36 Favored 'General case' 0 N--CA 1.489 1.482 0 O-C-N 121.211 -0.931 . . . . 1.16 109.38 179.866 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' B' B ' 353' ' ' ALA . . . . . . . . . . . . . . . -67.96 -27.88 66.97 Favored 'General case' 0 N--CA 1.489 1.497 0 O-C-N 121.251 -0.906 . . . . 1.21 109.179 179.684 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 354' ' ' GLN . . . . . . . . . . . . . 3.1 tt0 -81.6 0.55 37.88 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.343 -0.848 . . . . 1.69 109.466 179.747 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 355' ' ' ALA . . . . . 0.445 ' HB1' ' O ' ' B' ' 352' ' ' ASP . . . -69.05 -77.83 0.08 Allowed 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.194 -0.941 . . . . 1.3 109.471 -179.868 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' B' B ' 356' ' ' GLY . . . . . . . . . . . . . . . -81.61 58.48 4.88 Favored Glycine 0 N--CA 1.492 2.383 0 N-CA-C 110.569 -1.012 . . . . 1.29 110.569 -179.64 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 357' ' ' LYS . . . . . . . . . . . . . 12.9 ttmt -90.28 92.37 8.89 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 120.959 -1.318 . . . . 4.45 109.045 179.434 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 358' ' ' GLU . . . . . . . . . . . . . 37.7 tp10 -49.96 117.81 8.01 Favored Pre-proline 0 N--CA 1.489 1.516 0 O-C-N 121.114 -0.991 . . . . 5.72 109.507 -179.785 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 359' ' ' PRO . . . . . . . . . . . . . 2.7 Cg_endo -61.79 156.58 47.54 Favored 'Trans proline' 0 C--N 1.313 -1.311 0 C-N-CA 121.91 1.74 . . . . 5.6 110.031 179.911 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 360' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.273 0 N-CA-C 109.517 -1.433 . . . . 6.98 109.517 179.995 . . . . . . . . 0 0 . 1 . 023 nuclear orig full ' C' C ' 319' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.491 1.591 0 N-CA-C 109.348 -0.612 . . . . 7.03 109.348 . . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' C' C ' 320' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER 60.89 84.56 0.13 Allowed 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.281 -0.887 . . . . 6.84 109.669 179.877 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' C' C ' 321' ' ' LYS . . . . . 0.602 ' CB ' ' HD3' ' C' ' 322' ' ' PRO . 0.3 OUTLIER -160.47 -62.45 0.02 OUTLIER Pre-proline 0 N--CA 1.49 1.568 0 O-C-N 121.185 -0.947 . . . . 6.78 109.77 179.497 . . . . . . . . 3 3 . 1 . 023 nuclear orig full ' C' C ' 322' ' ' PRO . . . . . 0.602 ' HD3' ' CB ' ' C' ' 321' ' ' LYS . 2.4 Cg_endo -67.03 -4.94 12.39 Favored 'Trans proline' 0 C--N 1.318 -1.075 0 C-N-CA 121.334 1.356 . . . . 3.98 110.334 179.507 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' C' C ' 323' ' ' LEU . . . . . . . . . . . . . 85.5 mt -81.41 96.68 7.44 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.044 -1.035 . . . . 4.31 109.492 -179.955 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' C' C ' 324' ' ' ASP . . . . . 0.484 ' N ' ' OD1' ' C' ' 324' ' ' ASP . 0.5 OUTLIER -84.3 90.87 7.63 Favored 'General case' 0 N--CA 1.489 1.483 0 O-C-N 121.251 -0.906 . . . . 1.63 109.437 179.891 . . . . . . . . 3 3 . 1 . 023 nuclear orig full ' C' C ' 325' ' ' GLY . . . . . 0.563 ' O ' ' CD2' ' C' ' 327' ' ' TYR . . . -72.2 -164.7 7.37 Favored Glycine 0 N--CA 1.491 2.327 0 N-CA-C 109.41 -1.476 . . . . 0.82 109.41 179.879 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' C' C ' 326' ' ' GLU . . . . . . . . . . . . . 2.3 mp0 -58.48 164.36 2.64 Favored 'General case' 0 N--CA 1.489 1.491 0 O-C-N 121.282 -1.128 . . . . 2.17 109.057 179.57 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' C' C ' 327' ' ' TYR . . . . . 0.563 ' CD2' ' O ' ' C' ' 325' ' ' GLY . 38.7 m-85 -148.88 108.1 3.92 Favored 'General case' 0 C--N 1.302 -1.467 0 O-C-N 121.121 -0.987 . . . . 1.03 109.865 179.973 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' C' C ' 328' ' ' PHE . . . . . 0.414 ' CE1' ' HA ' ' A' ' 335' ' ' ARG . 88.8 m-85 -112.55 -166.71 1.1 Allowed 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.457 -0.777 . . . . 0.37 108.929 179.743 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' C' C ' 329' ' ' THR . . . . . . . . . . . . . 21.2 p -152.67 165.09 36.36 Favored 'General case' 0 N--CA 1.489 1.48 0 O-C-N 121.089 -1.007 . . . . 1.04 109.608 179.966 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' C' C ' 330' ' ' LEU . . . . . . . . . . . . . 51.5 tp -150.68 126.18 10.16 Favored 'General case' 0 N--CA 1.488 1.453 0 O-C-N 121.258 -0.901 . . . . 1.09 109.448 179.77 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' C' C ' 331' ' ' GLN . . . . . . . . . . . . . 4.4 tp-100 -86.74 117.37 25.45 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.325 -0.859 . . . . 1.48 109.3 179.883 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' C' C ' 332' ' ' ILE . . . . . . . . . . . . . 21.8 mt -103.49 110.12 28.99 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.554 0 O-C-N 121.119 -0.988 . . . . 1.08 109.684 179.949 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' C' C ' 333' ' ' ARG . . . . . 0.516 ' HG2' ' CE2' ' A' ' 327' ' ' TYR . 11.8 mtm180 -73.71 143.44 46.17 Favored 'General case' 0 N--CA 1.488 1.469 0 O-C-N 121.174 -0.954 . . . . 3.36 109.046 179.355 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' C' C ' 334' ' ' GLY . . . . . . . . . . . . . . . 90.16 134.67 5.71 Favored Glycine 0 N--CA 1.489 2.219 0 N-CA-C 109.618 -1.393 . . . . 0.35 109.618 179.931 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' C' C ' 335' ' ' ARG . . . . . 0.486 ' NH1' ' CG ' ' C' ' 335' ' ' ARG . 0.0 OUTLIER -79.49 -46.09 18.09 Favored 'General case' 0 N--CA 1.488 1.466 0 O-C-N 121.374 -1.074 . . . . 3.23 109.752 -179.939 . . . . . . . . 3 3 . 1 . 023 nuclear orig full ' C' C ' 336' ' ' GLU . . . . . . . . . . . . . 3.8 mt-10 -57.34 -48.52 78.79 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.274 -0.891 . . . . 2.62 109.687 -179.747 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' C' C ' 337' ' ' ARG . . . . . . . . . . . . . 1.9 mtp180 -59.31 -34.93 72.91 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.36 -0.837 . . . . 3.61 109.788 -179.712 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' C' C ' 338' ' ' PHE . . . . . . . . . . . . . 51.4 t80 -55.81 -54.06 49.14 Favored 'General case' 0 N--CA 1.489 1.501 0 O-C-N 121.219 -0.926 . . . . 0.43 110.296 -179.65 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' C' C ' 339' ' ' GLU . . . . . . . . . . . . . 7.9 mt-10 -51.27 -34.71 34.04 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.186 -0.946 . . . . 2.05 110.705 -179.161 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' C' C ' 340' ' ' MET . . . . . . . . . . . . . 38.1 ttp -64.78 -55.02 22.28 Favored 'General case' 0 N--CA 1.493 1.722 0 O-C-N 120.962 -1.087 . . . . 1.1 110.626 -179.094 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' C' C ' 341' ' ' PHE . . . . . . . . . . . . . 49.3 m-85 -59.87 -44.8 93.98 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.143 -0.973 . . . . 0.21 110.126 -179.053 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' C' C ' 342' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -50.24 -42.86 52.52 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.164 -0.96 . . . . 3.42 110.27 -179.562 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' C' C ' 343' ' ' GLU . . . . . . . . . . . . . 1.8 tt0 -58.06 -48.93 78.64 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.154 -0.966 . . . . 2.14 110.072 -179.362 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' C' C ' 344' ' ' LEU . . . . . 0.46 HD23 HD23 ' D' ' 344' ' ' LEU . 66.2 mt -61.79 -36.63 81.65 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.125 -0.984 . . . . 1.09 109.763 -179.714 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' C' C ' 345' ' ' ASN . . . . . . . . . . . . . 23.0 t-20 -57.89 -57.19 13.89 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.228 -0.92 . . . . 1.38 109.785 -179.814 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' C' C ' 346' ' ' GLU . . . . . . . . . . . . . 2.0 tm-20 -60.6 -29.3 69.13 Favored 'General case' 0 N--CA 1.489 1.525 0 O-C-N 121.291 -0.881 . . . . 2.21 109.752 -179.651 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' C' C ' 347' ' ' ALA . . . . . . . . . . . . . . . -62.08 -52.93 61.91 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.289 -0.882 . . . . 1.03 109.934 -179.864 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' C' C ' 348' ' ' LEU . . . . . 0.516 HD23 ' N ' ' C' ' 348' ' ' LEU . 3.8 mm? -61.26 -52.33 65.19 Favored 'General case' 0 N--CA 1.492 1.675 0 O-C-N 121.223 -0.923 . . . . 1.06 109.915 -179.487 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' C' C ' 349' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -56.57 -31.64 64.41 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.217 -0.927 . . . . 2.19 109.588 -179.568 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' C' C ' 350' ' ' LEU . . . . . 0.551 ' CD2' ' CD1' ' D' ' 350' ' ' LEU . 10.0 tt -64.92 -44.2 90.33 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.236 -0.915 . . . . 1.2 109.24 179.816 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' C' C ' 351' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -57.53 -40.84 79.67 Favored 'General case' 0 N--CA 1.488 1.47 0 O-C-N 121.466 -0.771 . . . . 1.92 109.128 179.878 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' C' C ' 352' ' ' ASP . . . . . . . . . . . . . 30.0 m-20 -57.56 -34.71 69.47 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.358 -0.839 . . . . 1.19 109.352 179.7 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' C' C ' 353' ' ' ALA . . . . . . . . . . . . . . . -66.54 -29.0 68.98 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.334 -0.854 . . . . 1.15 109.53 -179.857 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' C' C ' 354' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -81.49 -9.23 59.75 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.124 -0.985 . . . . 1.7 109.269 179.907 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' C' C ' 355' ' ' ALA . . . . . . . . . . . . . . . -72.57 -10.16 59.46 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.243 -0.911 . . . . 1.3 109.464 179.806 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' C' C ' 356' ' ' GLY . . . . . . . . . . . . . . . -80.26 -90.33 0.49 Allowed Glycine 0 N--CA 1.491 2.323 0 N-CA-C 109.418 -1.473 . . . . 1.33 109.418 179.972 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' C' C ' 357' ' ' LYS . . . . . . . . . . . . . 3.0 mtpm? -86.15 117.18 24.81 Favored 'General case' 0 N--CA 1.488 1.47 0 O-C-N 121.287 -1.126 . . . . 4.39 109.168 179.857 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' C' C ' 358' ' ' GLU . . . . . 0.446 ' HB3' ' HD2' ' C' ' 359' ' ' PRO . 23.0 mt-10 -48.67 160.49 0.46 Allowed Pre-proline 0 N--CA 1.49 1.544 0 O-C-N 121.268 -0.895 . . . . 5.75 109.632 -179.602 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' C' C ' 359' ' ' PRO . . . . . 0.446 ' HD2' ' HB3' ' C' ' 358' ' ' GLU . 5.1 Cg_exo -59.77 96.02 0.1 OUTLIER 'Trans proline' 0 C--N 1.312 -1.383 0 C-N-CA 122.259 1.973 . . . . 5.54 110.488 -179.708 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' C' C ' 360' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.296 0 CA-C-O 117.995 -1.447 . . . . 6.5 109.494 179.82 . . . . . . . . 0 0 . 1 . 023 nuclear orig full ' D' D ' 319' ' ' LYS . . . . . . . . . . . . . 8.2 pttt . . . . . 0 N--CA 1.49 1.547 0 N-CA-C 109.319 -0.623 . . . . 7.93 109.319 . . . . . . . . . 0 0 . 1 . 023 nuclear orig full ' D' D ' 320' ' ' LYS . . . . . . . . . . . . . 41.4 mtmt 55.45 73.01 0.44 Allowed 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.288 -0.883 . . . . 6.7 109.419 -179.727 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' D' D ' 321' ' ' LYS . . . . . . . . . . . . . 8.0 mtpt -82.27 120.79 77.82 Favored Pre-proline 0 N--CA 1.487 1.423 0 O-C-N 121.164 -0.96 . . . . 6.49 109.375 179.989 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' D' D ' 322' ' ' PRO . . . . . . . . . . . . . 5.1 Cg_exo -59.74 95.5 0.1 OUTLIER 'Trans proline' 0 C--N 1.311 -1.41 0 C-N-CA 121.846 1.697 . . . . 3.29 110.041 179.902 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' D' D ' 323' ' ' LEU . . . . . . . . . . . . . 71.7 mt -80.35 94.37 6.12 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.172 -0.955 . . . . 3.16 109.49 -179.891 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' D' D ' 324' ' ' ASP . . . . . . . . . . . . . 64.1 m-20 -84.32 88.82 7.27 Favored 'General case' 0 N--CA 1.488 1.431 0 O-C-N 121.039 -1.038 . . . . 1.54 108.965 179.664 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' D' D ' 325' ' ' GLY . . . . . 0.549 ' O ' ' CD1' ' D' ' 327' ' ' TYR . . . -72.08 -157.21 3.16 Favored Glycine 0 N--CA 1.49 2.247 0 N-CA-C 109.14 -1.584 . . . . 0.65 109.14 179.814 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' D' D ' 326' ' ' GLU . . . . . . . . . . . . . 61.6 mm-40 -58.39 168.99 0.95 Allowed 'General case' 0 C--N 1.303 -1.413 0 O-C-N 121.147 -1.208 . . . . 2.13 108.87 179.555 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' D' D ' 327' ' ' TYR . . . . . 0.549 ' CD1' ' O ' ' D' ' 325' ' ' GLY . 38.7 m-85 -148.88 105.4 3.54 Favored 'General case' 0 C--N 1.301 -1.525 0 O-C-N 121.151 -0.968 . . . . 1.0 109.57 179.874 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' D' D ' 328' ' ' PHE . . . . . . . . . . . . . 98.1 m-85 -107.47 -166.92 1.2 Allowed 'General case' 0 C--N 1.302 -1.464 0 N-CA-C 108.953 -0.758 . . . . 0.34 108.953 179.815 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' D' D ' 329' ' ' THR . . . . . . . . . . . . . 66.8 p -151.24 164.54 36.36 Favored 'General case' 0 C--N 1.301 -1.539 0 O-C-N 121.204 -0.935 . . . . 1.05 109.212 -179.965 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' D' D ' 330' ' ' LEU . . . . . . . . . . . . . 15.8 tp -148.68 131.52 16.09 Favored 'General case' 0 C--N 1.302 -1.475 0 O-C-N 121.192 -0.943 . . . . 1.07 109.437 -179.557 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' D' D ' 331' ' ' GLN . . . . . . . . . . . . . 1.6 tp60 -85.43 114.22 22.31 Favored 'General case' 0 C--N 1.303 -1.429 0 O-C-N 121.338 -0.852 . . . . 0.93 109.167 179.868 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' D' D ' 332' ' ' ILE . . . . . . . . . . . . . 53.0 mt -102.98 102.52 13.73 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.513 0 O-C-N 121.272 -0.892 . . . . 1.07 109.38 -179.962 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' D' D ' 333' ' ' ARG . . . . . 0.448 ' HG2' ' CE2' ' B' ' 327' ' ' TYR . 80.5 mtt180 -72.46 154.88 40.63 Favored 'General case' 0 N--CA 1.489 1.477 0 O-C-N 121.256 -0.903 . . . . 3.42 109.517 -179.9 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' D' D ' 334' ' ' GLY . . . . . . . . . . . . . . . 79.6 134.57 1.14 Allowed Glycine 0 N--CA 1.49 2.262 0 N-CA-C 109.512 -1.435 . . . . 0.41 109.512 -179.918 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' D' D ' 335' ' ' ARG . . . . . 0.532 ' HG2' ' NH1' ' D' ' 335' ' ' ARG . 1.4 ttt-85 -80.0 -50.4 10.45 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.208 -1.172 . . . . 3.58 109.79 -179.731 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' D' D ' 336' ' ' GLU . . . . . . . . . . . . . 1.2 pt-20 -55.38 -48.11 74.81 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.178 -0.951 . . . . 2.26 109.631 -179.618 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' D' D ' 337' ' ' ARG . . . . . 0.442 ' NH1' ' CG ' ' D' ' 337' ' ' ARG . 0.0 OUTLIER -60.41 -34.98 74.72 Favored 'General case' 0 N--CA 1.489 1.488 0 O-C-N 121.137 -0.977 . . . . 3.64 109.507 179.914 . . . . . . . . 3 3 . 1 . 023 nuclear orig full ' D' D ' 338' ' ' PHE . . . . . . . . . . . . . 62.5 t80 -55.55 -56.02 25.12 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.298 -0.876 . . . . 0.4 109.656 179.937 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' D' D ' 339' ' ' GLU . . . . . . . . . . . . . 3.4 mm-40 -51.02 -32.22 20.75 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.199 -0.938 . . . . 1.99 110.163 -179.643 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' D' D ' 340' ' ' MET . . . . . . . . . . . . . 19.3 ttp -64.45 -53.36 49.5 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.162 -0.961 . . . . 1.13 110.175 -179.433 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' D' D ' 341' ' ' PHE . . . . . . . . . . . . . 40.2 m-85 -62.47 -46.37 88.81 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.123 -0.986 . . . . 0.21 110.166 -179.188 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' D' D ' 342' ' ' ARG . . . . . . . . . . . . . 10.7 ttp180 -48.15 -41.13 25.9 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.08 -1.013 . . . . 3.15 109.787 -179.765 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' D' D ' 343' ' ' GLU . . . . . . . . . . . . . 9.3 tp10 -59.25 -45.77 90.3 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.292 -0.88 . . . . 2.35 109.933 -179.697 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' D' D ' 344' ' ' LEU . . . . . 0.46 HD23 HD23 ' C' ' 344' ' ' LEU . 46.3 mt -62.76 -44.56 95.88 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.164 -0.96 . . . . 1.06 110.013 -179.639 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' D' D ' 345' ' ' ASN . . . . . . . . . . . . . 56.5 t-20 -55.37 -49.45 72.25 Favored 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.204 -0.935 . . . . 1.35 109.64 -179.643 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' D' D ' 346' ' ' GLU . . . . . . . . . . . . . 1.1 tt0 -61.15 -35.92 78.38 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.236 -0.915 . . . . 1.69 109.652 -179.878 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' D' D ' 347' ' ' ALA . . . . . . . . . . . . . . . -60.25 -50.25 74.38 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.182 -0.949 . . . . 1.03 109.89 -179.892 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' D' D ' 348' ' ' LEU . . . . . 0.458 HD21 ' O ' ' D' ' 344' ' ' LEU . 3.7 mm? -62.04 -48.96 77.94 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.146 -0.971 . . . . 1.04 109.889 -179.685 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' D' D ' 349' ' ' GLU . . . . . . . . . . . . . 77.2 mt-10 -55.64 -35.04 65.49 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.114 -0.991 . . . . 1.95 109.81 -179.538 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' D' D ' 350' ' ' LEU . . . . . 0.551 ' CD1' ' CD2' ' C' ' 350' ' ' LEU . 5.8 tt -63.38 -44.47 94.65 Favored 'General case' 0 N--CA 1.489 1.479 0 O-C-N 121.267 -0.895 . . . . 1.16 109.233 179.943 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' D' D ' 351' ' ' LYS . . . . . . . . . . . . . 19.2 tttm -57.16 -38.28 73.34 Favored 'General case' 0 N--CA 1.489 1.481 0 O-C-N 121.446 -0.784 . . . . 1.97 109.416 179.879 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' D' D ' 352' ' ' ASP . . . . . 0.459 ' O ' ' HB1' ' D' ' 355' ' ' ALA . 5.2 m-20 -55.85 -45.9 78.33 Favored 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.242 -0.911 . . . . 1.17 109.355 179.696 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' D' D ' 353' ' ' ALA . . . . . . . . . . . . . . . -68.04 -27.94 66.96 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.201 -0.937 . . . . 1.21 109.179 179.67 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' D' D ' 354' ' ' GLN . . . . . 0.455 ' NE2' ' CD1' ' C' ' 350' ' ' LEU . 3.1 tt0 -81.53 0.45 38.03 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.392 -0.818 . . . . 1.68 109.49 179.791 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' D' D ' 355' ' ' ALA . . . . . 0.459 ' HB1' ' O ' ' D' ' 352' ' ' ASP . . . -69.22 -77.54 0.08 Allowed 'General case' 0 N--CA 1.489 1.49 0 O-C-N 121.231 -0.918 . . . . 1.29 109.516 -179.879 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' D' D ' 356' ' ' GLY . . . . . . . . . . . . . . . -81.72 57.71 4.92 Favored Glycine 0 N--CA 1.492 2.404 0 N-CA-C 110.542 -1.023 . . . . 1.28 110.542 -179.563 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' D' D ' 357' ' ' LYS . . . . . . . . . . . . . 12.3 ttmt -89.6 92.02 8.92 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 120.82 -1.4 . . . . 4.45 109.152 179.434 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' D' D ' 358' ' ' GLU . . . . . . . . . . . . . 40.6 tp10 -49.82 117.81 7.83 Favored Pre-proline 0 N--CA 1.492 1.649 0 O-C-N 121.14 -0.975 . . . . 5.71 109.387 -179.864 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' D' D ' 359' ' ' PRO . . . . . . . . . . . . . 2.5 Cg_endo -61.57 157.39 41.96 Favored 'Trans proline' 0 C--N 1.314 -1.288 0 C-N-CA 121.818 1.678 . . . . 5.6 109.873 179.806 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' D' D ' 360' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 2.371 0 CA-C-O 118.018 -1.434 . . . . 6.97 109.633 -179.955 . . . . . . . . 0 0 . 1 . 024 nuclear orig full ' A' A ' 319' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 N--CA 1.492 1.666 0 N-CA-C 109.379 -0.6 . . . . 7.95 109.379 . . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 320' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 63.09 115.99 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.384 -0.823 . . . . 6.71 109.659 179.85 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 321' ' ' LYS . . . . . . . . . . . . . 8.4 mttt -81.81 144.03 51.26 Favored Pre-proline 0 N--CA 1.49 1.553 0 O-C-N 121.251 -0.906 . . . . 6.5 109.097 179.851 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 322' ' ' PRO . . . . . . . . . . . . . 2.2 Cg_endo -61.98 -81.61 0.01 OUTLIER 'Trans proline' 0 C--N 1.31 -1.476 0 C-N-CA 122.105 1.87 . . . . 3.3 110.485 -179.624 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 323' ' ' LEU . . . . . . . . . . . . . 46.2 mt -82.91 104.88 13.46 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.178 -0.952 . . . . 3.16 109.791 -179.682 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 324' ' ' ASP . . . . . . . . . . . . . 8.0 m-20 -81.79 -154.82 0.12 Allowed 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.245 -0.91 . . . . 1.53 109.49 179.828 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 325' ' ' GLY . . . . . . . . . . . . . . . -69.69 -168.04 6.18 Favored Glycine 0 N--CA 1.491 2.366 0 N-CA-C 109.748 -1.341 . . . . 0.67 109.748 179.978 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 326' ' ' GLU . . . . . . . . . . . . . 2.2 mm-40 -59.14 -173.72 0.02 OUTLIER 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.352 -1.087 . . . . 2.13 109.627 -179.96 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 327' ' ' TYR . . . . . 0.516 ' CE1' ' HG2' ' C' ' 333' ' ' ARG . 43.2 m-85 -149.83 112.18 4.69 Favored 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.297 -0.877 . . . . 1.0 109.737 179.889 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 328' ' ' PHE . . . . . 0.502 ' CE1' ' HA ' ' C' ' 335' ' ' ARG . 71.0 m-85 -113.93 -168.81 1.4 Allowed 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.252 -0.905 . . . . 0.34 109.187 179.69 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 329' ' ' THR . . . . . . . . . . . . . 40.3 p -154.58 167.54 29.77 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.2 -0.938 . . . . 1.05 109.451 -179.992 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 330' ' ' LEU . . . . . . . . . . . . . 24.2 tp -150.37 131.42 14.36 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.254 -0.904 . . . . 1.07 109.477 -179.888 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 331' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -87.13 111.94 21.44 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.3 -0.875 . . . . 0.91 109.436 179.861 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 332' ' ' ILE . . . . . 0.443 HD12 ' HB2' ' A' ' 341' ' ' PHE . 97.0 mt -103.56 104.03 16.07 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.592 0 O-C-N 121.232 -0.918 . . . . 1.09 109.529 -179.986 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 333' ' ' ARG . . . . . 0.584 ' HG2' ' CE2' ' C' ' 327' ' ' TYR . 13.3 mtp180 -72.53 149.99 43.59 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.259 -0.9 . . . . 3.41 109.479 179.868 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 334' ' ' GLY . . . . . . . . . . . . . . . 86.37 131.14 2.86 Favored Glycine 0 N--CA 1.493 2.438 0 N-CA-C 109.84 -1.304 . . . . 0.4 109.84 179.606 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 335' ' ' ARG . . . . . 0.443 ' O ' ' HB3' ' A' ' 338' ' ' PHE . 0.0 OUTLIER -80.26 -39.07 29.66 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.33 -1.1 . . . . 3.55 109.586 179.874 . . . . . . . . 3 3 . 1 . 024 nuclear orig full ' A' A ' 336' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -57.99 -61.74 2.32 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.17 -0.956 . . . . 2.29 110.106 -179.561 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 337' ' ' ARG . . . . . 0.483 ' NH1' ' HG2' ' A' ' 337' ' ' ARG . 0.0 OUTLIER -59.96 -26.37 65.94 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.137 -0.977 . . . . 3.64 109.788 -179.509 . . . . . . . . 3 3 . 1 . 024 nuclear orig full ' A' A ' 338' ' ' PHE . . . . . 0.443 ' HB3' ' O ' ' A' ' 335' ' ' ARG . 50.8 t80 -55.67 -58.6 7.13 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.149 -0.969 . . . . 0.41 109.732 -179.869 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 339' ' ' GLU . . . . . . . . . . . . . 55.9 mt-10 -50.71 -32.94 20.97 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.269 -0.894 . . . . 1.97 109.876 -179.653 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 340' ' ' MET . . . . . . . . . . . . . 23.0 ttp -63.56 -51.19 66.44 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.107 -0.996 . . . . 1.14 110.044 -179.509 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 341' ' ' PHE . . . . . 0.443 ' HB2' HD12 ' A' ' 332' ' ' ILE . 36.7 m-85 -62.0 -45.84 91.85 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.166 -0.959 . . . . 0.21 110.081 -179.557 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 342' ' ' ARG . . . . . 0.466 ' NH1' ' HG3' ' A' ' 342' ' ' ARG . 0.0 OUTLIER -49.58 -42.55 44.78 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.14 -0.975 . . . . 3.15 110.047 -179.499 . . . . . . . . 3 3 . 1 . 024 nuclear orig full ' A' A ' 343' ' ' GLU . . . . . . . . . . . . . 1.6 tt0 -58.61 -47.93 82.69 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.099 -1.0 . . . . 2.35 109.817 -179.57 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 344' ' ' LEU . . . . . 0.586 ' CD2' ' CD2' ' B' ' 344' ' ' LEU . 50.3 mt -61.39 -33.28 73.4 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.163 -0.961 . . . . 1.06 109.536 -179.794 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 345' ' ' ASN . . . . . . . . . . . . . 21.6 t-20 -57.82 -59.25 5.52 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.249 -0.907 . . . . 1.36 109.807 -179.944 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 346' ' ' GLU . . . . . . . . . . . . . 72.4 tt0 -62.16 -28.19 69.48 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.284 -0.885 . . . . 1.65 110.136 -179.592 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 347' ' ' ALA . . . . . . . . . . . . . . . -60.71 -56.91 15.64 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.11 -0.994 . . . . 1.03 110.006 -179.64 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 348' ' ' LEU . . . . . 0.513 ' N ' HD23 ' A' ' 348' ' ' LEU . 4.0 mm? -61.92 -46.49 89.13 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.13 -0.981 . . . . 1.04 110.134 -179.56 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 349' ' ' GLU . . . . . . . . . . . . . 33.3 mm-40 -57.17 -33.22 67.21 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.196 -0.94 . . . . 1.94 109.973 -179.452 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 350' ' ' LEU . . . . . 0.497 HD23 HD23 ' B' ' 350' ' ' LEU . 5.8 tt -64.66 -48.54 74.4 Favored 'General case' 0 N--CA 1.489 1.482 0 O-C-N 121.133 -0.98 . . . . 1.17 109.516 -179.883 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 351' ' ' LYS . . . . . . . . . . . . . 22.1 tttm -58.1 -39.57 78.98 Favored 'General case' 0 N--CA 1.488 1.469 0 O-C-N 121.343 -0.848 . . . . 1.97 109.413 -179.916 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 352' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -57.82 -52.5 65.21 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.295 -0.878 . . . . 1.16 109.856 179.975 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 353' ' ' ALA . . . . . . . . . . . . . . . -66.47 -10.01 40.04 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.26 -0.9 . . . . 1.22 109.823 -179.547 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 354' ' ' GLN . . . . . . . . . . . . . 2.5 tt0 -84.13 -53.83 5.25 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.132 -0.98 . . . . 1.71 109.692 -179.98 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 355' ' ' ALA . . . . . . . . . . . . . . . -71.07 -8.47 53.61 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.254 -0.904 . . . . 1.3 109.815 -179.672 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 356' ' ' GLY . . . . . . . . . . . . . . . -81.38 -23.08 59.31 Favored Glycine 0 N--CA 1.491 2.316 0 N-CA-C 109.445 -1.462 . . . . 1.3 109.445 179.816 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 357' ' ' LYS . . . . . . . . . . . . . 15.1 mtpp -89.54 143.33 26.9 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.309 -1.112 . . . . 4.46 109.38 179.923 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 358' ' ' GLU . . . . . 0.435 ' HG2' ' HD2' ' A' ' 359' ' ' PRO . 2.5 tt0 -49.61 143.67 10.45 Favored Pre-proline 0 N--CA 1.49 1.558 0 O-C-N 121.256 -0.902 . . . . 5.75 109.33 179.928 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 359' ' ' PRO . . . . . 0.435 ' HD2' ' HG2' ' A' ' 358' ' ' GLU . 2.3 Cg_endo -62.31 -164.56 0.04 OUTLIER 'Trans proline' 0 C--N 1.311 -1.396 0 C-N-CA 122.105 1.87 . . . . 5.63 110.228 -179.991 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 360' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.324 0 CA-C-O 117.961 -1.466 . . . . 6.97 109.571 179.974 . . . . . . . . 0 0 . 1 . 024 nuclear orig full ' B' B ' 319' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 N--CA 1.49 1.545 0 N-CA-C 109.414 -0.588 . . . . 7.95 109.414 . . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 320' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 62.91 115.82 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.258 -0.901 . . . . 6.73 109.629 179.826 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' B' B ' 321' ' ' LYS . . . . . . . . . . . . . 8.4 mttt -81.59 143.94 51.9 Favored Pre-proline 0 N--CA 1.49 1.534 0 O-C-N 121.223 -0.923 . . . . 6.5 109.195 179.741 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 322' ' ' PRO . . . . . . . . . . . . . 2.1 Cg_endo -61.85 -81.73 0.01 OUTLIER 'Trans proline' 0 C--N 1.31 -1.461 0 C-N-CA 122.148 1.898 . . . . 3.29 110.454 -179.648 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 323' ' ' LEU . . . . . . . . . . . . . 46.6 mt -82.8 105.01 13.47 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.201 -0.937 . . . . 3.18 109.844 -179.725 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 324' ' ' ASP . . . . . . . . . . . . . 8.3 m-20 -81.74 -154.43 0.12 Allowed 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.291 -0.881 . . . . 1.53 109.524 179.841 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 325' ' ' GLY . . . . . . . . . . . . . . . -70.49 -168.1 7.24 Favored Glycine 0 N--CA 1.491 2.307 0 N-CA-C 109.693 -1.363 . . . . 0.65 109.693 -179.952 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 326' ' ' GLU . . . . . . . . . . . . . 2.2 mm-40 -58.96 -173.63 0.02 OUTLIER 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.29 -1.124 . . . . 2.13 109.696 -179.895 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 327' ' ' TYR . . . . . 0.585 ' CE1' ' HG2' ' D' ' 333' ' ' ARG . 42.5 m-85 -149.93 112.11 4.64 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.298 -0.876 . . . . 0.99 109.755 179.977 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' B' B ' 328' ' ' PHE . . . . . 0.463 ' CE1' ' HA ' ' D' ' 335' ' ' ARG . 71.3 m-85 -113.81 -168.75 1.39 Allowed 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.242 -0.911 . . . . 0.36 109.252 179.754 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' B' B ' 329' ' ' THR . . . . . . . . . . . . . 40.1 p -154.6 167.3 30.59 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.269 -0.894 . . . . 1.05 109.379 179.981 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 330' ' ' LEU . . . . . . . . . . . . . 24.2 tp -150.25 131.29 14.35 Favored 'General case' 0 N--CA 1.489 1.497 0 O-C-N 121.158 -0.964 . . . . 1.07 109.483 -179.867 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 331' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -87.02 111.95 21.37 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.3 -0.875 . . . . 0.91 109.428 179.927 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' B' B ' 332' ' ' ILE . . . . . 0.441 HD12 ' HB2' ' B' ' 341' ' ' PHE . 97.0 mt -103.51 103.88 15.83 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.534 0 O-C-N 121.226 -0.921 . . . . 1.08 109.602 179.937 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' B' B ' 333' ' ' ARG . . . . . 0.532 ' HG2' ' CE1' ' D' ' 327' ' ' TYR . 12.9 mtp180 -72.5 150.32 43.35 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.364 -0.835 . . . . 3.42 109.544 179.835 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' B' B ' 334' ' ' GLY . . . . . . . . . . . . . . . 86.07 131.0 2.71 Favored Glycine 0 N--CA 1.492 2.41 0 N-CA-C 109.812 -1.315 . . . . 0.4 109.812 179.679 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 335' ' ' ARG . . . . . 0.448 ' O ' ' HB3' ' B' ' 338' ' ' PHE . 0.0 OUTLIER -80.31 -38.85 29.87 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.301 -1.117 . . . . 3.55 109.625 179.905 . . . . . . . . 3 3 . 1 . 024 nuclear orig full ' B' B ' 336' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -58.02 -61.83 2.26 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.21 -0.932 . . . . 2.28 110.056 -179.622 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' B' B ' 337' ' ' ARG . . . . . 0.497 ' HG2' ' NH1' ' B' ' 337' ' ' ARG . 0.0 OUTLIER -59.83 -26.55 65.88 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.067 -1.021 . . . . 3.64 109.818 -179.559 . . . . . . . . 3 3 . 1 . 024 nuclear orig full ' B' B ' 338' ' ' PHE . . . . . 0.448 ' HB3' ' O ' ' B' ' 335' ' ' ARG . 50.5 t80 -55.41 -58.85 6.06 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.11 -0.993 . . . . 0.39 109.692 -179.858 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' B' B ' 339' ' ' GLU . . . . . . . . . . . . . 56.8 mt-10 -50.62 -32.7 19.7 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.348 -0.845 . . . . 1.98 110.045 -179.666 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 340' ' ' MET . . . . . . . . . . . . . 23.9 ttp -63.79 -51.12 66.23 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.126 -0.983 . . . . 1.14 110.013 -179.54 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 341' ' ' PHE . . . . . 0.441 ' HB2' HD12 ' B' ' 332' ' ' ILE . 36.4 m-85 -62.09 -45.84 91.72 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.169 -0.957 . . . . 0.22 109.988 -179.569 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' B' B ' 342' ' ' ARG . . . . . 0.452 ' NH1' ' HG3' ' B' ' 342' ' ' ARG . 0.0 OUTLIER -49.59 -42.67 45.17 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.127 -0.983 . . . . 3.15 110.065 -179.578 . . . . . . . . 3 3 . 1 . 024 nuclear orig full ' B' B ' 343' ' ' GLU . . . . . . . . . . . . . 1.6 tt0 -58.61 -47.95 82.64 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.072 -1.017 . . . . 2.35 109.856 -179.575 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 344' ' ' LEU . . . . . 0.586 ' CD2' ' CD2' ' A' ' 344' ' ' LEU . 50.4 mt -61.32 -33.24 73.28 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.155 -0.966 . . . . 1.05 109.544 -179.848 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' B' B ' 345' ' ' ASN . . . . . . . . . . . . . 21.5 t-20 -57.93 -59.28 5.5 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.225 -0.922 . . . . 1.35 109.731 -179.952 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 346' ' ' GLU . . . . . . . . . . . . . 71.8 tt0 -62.05 -28.53 69.66 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.267 -0.896 . . . . 1.66 110.076 -179.605 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 347' ' ' ALA . . . . . . . . . . . . . . . -60.42 -56.94 15.38 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.09 -1.006 . . . . 1.02 109.992 -179.567 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 348' ' ' LEU . . . . . 0.504 ' N ' HD23 ' B' ' 348' ' ' LEU . 4.0 mm? -61.95 -46.64 88.41 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.179 -0.95 . . . . 1.05 110.131 -179.491 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' B' B ' 349' ' ' GLU . . . . . . . . . . . . . 32.7 mm-40 -56.98 -33.26 66.93 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.133 -0.979 . . . . 1.95 110.092 -179.469 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 350' ' ' LEU . . . . . 0.497 HD23 HD23 ' A' ' 350' ' ' LEU . 5.8 tt -64.65 -48.42 74.86 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.17 -0.956 . . . . 1.18 109.48 -179.919 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' B' B ' 351' ' ' LYS . . . . . . . . . . . . . 22.2 tttm -58.27 -39.33 78.97 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.349 -0.844 . . . . 1.96 109.359 -179.907 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 352' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -58.01 -52.47 65.38 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.313 -0.867 . . . . 1.16 109.88 -179.984 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 353' ' ' ALA . . . . . . . . . . . . . . . -66.55 -9.94 40.09 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.298 -0.877 . . . . 1.21 109.847 -179.56 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 354' ' ' GLN . . . . . . . . . . . . . 2.5 tt0 -84.14 -53.9 5.2 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.125 -0.984 . . . . 1.69 109.621 179.955 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 355' ' ' ALA . . . . . . . . . . . . . . . -70.87 -8.83 55.56 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.301 -0.874 . . . . 1.3 109.777 -179.68 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 356' ' ' GLY . . . . . . . . . . . . . . . -81.17 -22.86 60.09 Favored Glycine 0 N--CA 1.49 2.291 0 N-CA-C 109.505 -1.438 . . . . 1.29 109.505 179.968 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 357' ' ' LYS . . . . . . . . . . . . . 15.3 mtpp -89.84 143.16 27.03 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.316 -1.108 . . . . 4.45 109.493 179.88 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 358' ' ' GLU . . . . . 0.434 ' HG2' ' HD2' ' B' ' 359' ' ' PRO . 2.4 tt0 -49.44 143.91 9.56 Favored Pre-proline 0 N--CA 1.491 1.589 0 O-C-N 121.246 -0.909 . . . . 5.72 109.356 179.997 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' B' B ' 359' ' ' PRO . . . . . 0.434 ' HD2' ' HG2' ' B' ' 358' ' ' GLU . 2.3 Cg_endo -62.65 -164.62 0.04 OUTLIER 'Trans proline' 0 C--N 1.31 -1.471 0 C-N-CA 122.144 1.896 . . . . 5.6 110.168 -179.919 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' B' B ' 360' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.359 0 CA-C-O 118.009 -1.439 . . . . 6.98 109.618 179.974 . . . . . . . . 0 0 . 1 . 024 nuclear orig full ' C' C ' 319' ' ' LYS . . . . . 0.466 ' O ' ' O ' ' C' ' 320' ' ' LYS . 0.1 OUTLIER . . . . . 0 N--CA 1.49 1.57 0 N-CA-C 109.47 -0.567 . . . . 7.03 109.47 . . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' C' C ' 320' ' ' LYS . . . . . 0.466 ' O ' ' O ' ' C' ' 319' ' ' LYS . 1.9 tptt 59.21 152.63 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.241 -0.912 . . . . 6.84 109.273 -179.965 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' C' C ' 321' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -158.58 84.7 2.51 Favored Pre-proline 0 N--CA 1.49 1.566 0 O-C-N 121.207 -0.933 . . . . 6.78 109.678 -179.84 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' C' C ' 322' ' ' PRO . . . . . . . . . . . . . 2.0 Cg_endo -68.46 -1.03 6.66 Favored 'Trans proline' 0 C--N 1.309 -1.52 0 C-N-CA 122.259 1.973 . . . . 3.98 110.729 179.817 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' C' C ' 323' ' ' LEU . . . . . . . . . . . . . 56.3 mt -79.97 91.99 5.5 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 120.984 -1.072 . . . . 4.31 109.336 179.989 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' C' C ' 324' ' ' ASP . . . . . 0.436 ' HB3' ' CE1' ' C' ' 327' ' ' TYR . 3.8 m-20 -82.3 125.08 30.57 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.215 -0.928 . . . . 1.63 109.614 179.999 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' C' C ' 325' ' ' GLY . . . . . 0.554 ' O ' ' CD1' ' C' ' 327' ' ' TYR . . . -70.07 -168.22 6.77 Favored Glycine 0 N--CA 1.491 2.311 0 N-CA-C 109.565 -1.414 . . . . 0.82 109.565 179.965 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' C' C ' 326' ' ' GLU . . . . . 0.421 ' O ' ' CD1' ' C' ' 327' ' ' TYR . 30.6 mm-40 -59.17 171.68 0.7 Allowed 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.212 -1.169 . . . . 2.17 109.402 179.923 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' C' C ' 327' ' ' TYR . . . . . 0.584 ' CE2' ' HG2' ' A' ' 333' ' ' ARG . 44.1 m-85 -149.36 114.31 5.41 Favored 'General case' 0 N--CA 1.488 1.437 0 O-C-N 121.254 -0.904 . . . . 1.03 109.819 -179.878 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' C' C ' 328' ' ' PHE . . . . . 0.439 ' CE2' ' HA ' ' A' ' 335' ' ' ARG . 86.5 m-85 -113.27 -173.54 2.28 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.316 -0.865 . . . . 0.37 109.132 179.595 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' C' C ' 329' ' ' THR . . . . . . . . . . . . . 22.6 p -152.38 165.2 35.74 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.12 -0.987 . . . . 1.04 109.664 -179.851 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' C' C ' 330' ' ' LEU . . . . . . . . . . . . . 14.4 tp -151.32 129.23 11.7 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.339 -0.851 . . . . 1.09 109.508 -179.853 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' C' C ' 331' ' ' GLN . . . . . 0.416 ' OE1' ' HB3' ' A' ' 327' ' ' TYR . 0.0 OUTLIER -89.13 116.56 27.48 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.174 -0.954 . . . . 1.48 109.837 -179.971 . . . . . . . . 3 3 . 1 . 024 nuclear orig full ' C' C ' 332' ' ' ILE . . . . . . . . . . . . . 87.6 mt -104.06 112.36 37.3 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.621 0 O-C-N 121.201 -0.937 . . . . 1.08 109.555 179.661 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' C' C ' 333' ' ' ARG . . . . . 0.516 ' HG2' ' CE1' ' A' ' 327' ' ' TYR . 46.2 mtt180 -72.02 144.04 48.94 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.12 -0.988 . . . . 3.36 109.321 179.711 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' C' C ' 334' ' ' GLY . . . . . . . . . . . . . . . 89.15 128.34 3.27 Favored Glycine 0 N--CA 1.492 2.385 0 N-CA-C 109.48 -1.448 . . . . 0.35 109.48 -179.846 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' C' C ' 335' ' ' ARG . . . . . 0.502 ' HA ' ' CE1' ' A' ' 328' ' ' PHE . 37.1 ttp180 -78.98 -35.59 42.75 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.19 -1.183 . . . . 3.23 109.676 -179.88 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' C' C ' 336' ' ' GLU . . . . . . . . . . . . . 2.0 tt0 -57.0 -60.4 3.64 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.247 -0.908 . . . . 2.62 109.678 -179.808 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' C' C ' 337' ' ' ARG . . . . . 0.435 ' CG ' HH11 ' C' ' 337' ' ' ARG . 0.0 OUTLIER -59.51 -28.31 66.94 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.308 -0.87 . . . . 3.61 109.553 -179.811 . . . . . . . . 3 3 . 1 . 024 nuclear orig full ' C' C ' 338' ' ' PHE . . . . . 0.451 ' HB3' ' O ' ' C' ' 335' ' ' ARG . 58.1 t80 -54.07 -55.37 28.14 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.249 -0.907 . . . . 0.43 109.352 -179.962 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' C' C ' 339' ' ' GLU . . . . . . . . . . . . . 41.5 mt-10 -52.42 -32.08 37.46 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.242 -0.911 . . . . 2.05 109.755 -179.997 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' C' C ' 340' ' ' MET . . . . . 0.423 ' HB3' ' O ' ' C' ' 337' ' ' ARG . 3.8 ttp -63.92 -55.03 25.62 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.227 -0.921 . . . . 1.1 110.285 -179.402 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' C' C ' 341' ' ' PHE . . . . . . . . . . . . . 48.5 m-85 -61.0 -46.16 91.9 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.167 -0.958 . . . . 0.21 109.701 -179.448 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' C' C ' 342' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -47.72 -41.47 22.96 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.287 -0.883 . . . . 3.42 109.278 179.761 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' C' C ' 343' ' ' GLU . . . . . . . . . . . . . 43.3 tt0 -61.17 -48.74 80.18 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.245 -0.909 . . . . 2.14 109.951 -179.869 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' C' C ' 344' ' ' LEU . . . . . 0.461 ' O ' HD21 ' C' ' 348' ' ' LEU . 35.4 mt -60.88 -30.14 69.97 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.135 -0.978 . . . . 1.09 109.828 -179.517 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' C' C ' 345' ' ' ASN . . . . . . . . . . . . . 25.8 t-20 -57.77 -58.31 8.91 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.261 -0.9 . . . . 1.38 109.488 179.879 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' C' C ' 346' ' ' GLU . . . . . 0.416 ' O ' ' HB2' ' C' ' 350' ' ' LEU . 20.1 tt0 -61.67 -25.63 67.51 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.301 -0.875 . . . . 2.21 109.922 -179.71 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' C' C ' 347' ' ' ALA . . . . . 0.46 ' O ' ' HB3' ' C' ' 350' ' ' LEU . . . -62.41 -55.62 26.07 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.106 -0.996 . . . . 1.03 109.715 -179.815 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' C' C ' 348' ' ' LEU . . . . . 0.513 ' N ' ' CD2' ' C' ' 348' ' ' LEU . 4.1 mm? -63.19 -55.91 21.11 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.131 -0.981 . . . . 1.06 109.969 -179.557 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' C' C ' 349' ' ' GLU . . . . . 0.412 ' OE2' ' HD3' ' A' ' 333' ' ' ARG . 41.6 mt-10 -56.61 -25.89 54.23 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.103 -0.998 . . . . 2.19 109.24 -179.782 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' C' C ' 350' ' ' LEU . . . . . 0.548 ' CD1' HD11 ' D' ' 350' ' ' LEU . 0.5 OUTLIER -65.62 -49.45 68.66 Favored 'General case' 0 C--N 1.301 -1.516 0 N-CA-C 108.811 -0.811 . . . . 1.2 108.811 179.813 . . . . . . . . 3 3 . 1 . 024 nuclear orig full ' C' C ' 351' ' ' LYS . . . . . 0.546 ' N ' HD11 ' C' ' 350' ' ' LEU . 6.3 tttt -62.27 -41.95 98.92 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.291 -0.881 . . . . 1.92 109.298 179.319 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' C' C ' 352' ' ' ASP . . . . . . . . . . . . . 43.3 m-20 -56.06 -28.19 56.56 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.341 -0.849 . . . . 1.19 109.836 -179.867 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' C' C ' 353' ' ' ALA . . . . . . . . . . . . . . . -66.33 -46.52 76.57 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.227 -0.92 . . . . 1.15 109.78 -179.645 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' C' C ' 354' ' ' GLN . . . . . 0.488 ' NE2' ' HA ' ' C' ' 351' ' ' LYS . 0.0 OUTLIER -82.84 14.43 3.25 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.205 -0.934 . . . . 1.7 109.989 -179.773 . . . . . . . . 3 3 . 1 . 024 nuclear orig full ' C' C ' 355' ' ' ALA . . . . . . . . . . . . . . . -69.07 -72.71 0.17 Allowed 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.106 -0.996 . . . . 1.3 109.962 -179.813 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' C' C ' 356' ' ' GLY . . . . . . . . . . . . . . . -81.88 58.69 4.91 Favored Glycine 0 N--CA 1.494 2.53 0 N-CA-C 110.442 -1.063 . . . . 1.33 110.442 -179.624 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' C' C ' 357' ' ' LYS . . . . . . . . . . . . . 9.2 pttt -88.45 152.24 22.02 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 120.94 -1.33 . . . . 4.39 109.491 179.787 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' C' C ' 358' ' ' GLU . . . . . . . . . . . . . 2.1 mt-10 -50.54 148.77 6.43 Favored Pre-proline 0 N--CA 1.491 1.624 0 O-C-N 121.163 -0.961 . . . . 5.75 109.58 179.9 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' C' C ' 359' ' ' PRO . . . . . . . . . . . . . 1.4 Cg_endo -64.62 119.5 6.55 Favored 'Trans proline' 0 C--N 1.31 -1.47 0 C-N-CA 122.237 1.958 . . . . 5.54 110.14 179.927 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' C' C ' 360' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.255 0 CA-C-O 117.985 -1.453 . . . . 6.5 109.544 179.945 . . . . . . . . 0 0 . 1 . 024 nuclear orig full ' D' D ' 319' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 N--CA 1.491 1.577 0 CA-C-O 121.322 0.582 . . . . 7.93 109.465 . . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' D' D ' 320' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 62.87 116.06 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.202 -0.936 . . . . 6.7 109.628 -179.994 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' D' D ' 321' ' ' LYS . . . . . . . . . . . . . 8.3 mttt -81.67 144.06 51.84 Favored Pre-proline 0 N--CA 1.49 1.56 0 O-C-N 121.175 -0.953 . . . . 6.49 109.149 179.769 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' D' D ' 322' ' ' PRO . . . . . . . . . . . . . 2.1 Cg_endo -62.04 -81.67 0.01 OUTLIER 'Trans proline' 0 C--N 1.31 -1.484 0 C-N-CA 122.059 1.84 . . . . 3.29 110.484 -179.643 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' D' D ' 323' ' ' LEU . . . . . . . . . . . . . 46.4 mt -82.69 104.95 13.32 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.15 -0.969 . . . . 3.16 109.913 -179.747 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' D' D ' 324' ' ' ASP . . . . . . . . . . . . . 8.3 m-20 -81.76 -154.71 0.12 Allowed 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.317 -0.864 . . . . 1.54 109.483 179.807 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' D' D ' 325' ' ' GLY . . . . . . . . . . . . . . . -69.96 -167.99 6.49 Favored Glycine 0 N--CA 1.491 2.306 0 N-CA-C 109.733 -1.347 . . . . 0.65 109.733 -179.971 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' D' D ' 326' ' ' GLU . . . . . . . . . . . . . 2.2 mm-40 -59.21 -173.98 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.383 -1.069 . . . . 2.13 109.551 -179.945 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' D' D ' 327' ' ' TYR . . . . . 0.532 ' CE1' ' HG2' ' B' ' 333' ' ' ARG . 43.0 m-85 -149.71 112.34 4.76 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.367 -0.833 . . . . 1.0 109.74 179.936 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' D' D ' 328' ' ' PHE . . . . . . . . . . . . . 71.8 m-85 -113.94 -168.68 1.39 Allowed 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.277 -0.889 . . . . 0.34 109.201 179.737 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' D' D ' 329' ' ' THR . . . . . . . . . . . . . 39.5 p -154.59 167.34 30.43 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.19 -0.944 . . . . 1.05 109.41 179.987 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' D' D ' 330' ' ' LEU . . . . . . . . . . . . . 24.6 tp -150.24 131.36 14.43 Favored 'General case' 0 N--CA 1.488 1.472 0 O-C-N 121.239 -0.913 . . . . 1.07 109.512 -179.878 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' D' D ' 331' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -87.13 111.85 21.35 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.351 -0.843 . . . . 0.93 109.434 179.971 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' D' D ' 332' ' ' ILE . . . . . 0.451 HD12 ' HB2' ' D' ' 341' ' ' PHE . 97.0 mt -103.46 103.8 15.7 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.533 0 O-C-N 121.145 -0.972 . . . . 1.07 109.708 179.994 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' D' D ' 333' ' ' ARG . . . . . 0.585 ' HG2' ' CE1' ' B' ' 327' ' ' TYR . 13.2 mtp180 -72.57 150.11 43.42 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.256 -0.903 . . . . 3.42 109.458 179.887 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' D' D ' 334' ' ' GLY . . . . . . . . . . . . . . . 86.31 130.94 2.8 Favored Glycine 0 N--CA 1.491 2.333 0 N-CA-C 109.815 -1.314 . . . . 0.41 109.815 179.723 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' D' D ' 335' ' ' ARG . . . . . 0.463 ' HA ' ' CE1' ' B' ' 328' ' ' PHE . 0.0 OUTLIER -80.28 -38.94 29.83 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.308 -1.113 . . . . 3.58 109.575 179.883 . . . . . . . . 3 3 . 1 . 024 nuclear orig full ' D' D ' 336' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -58.08 -61.79 2.29 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.241 -0.912 . . . . 2.26 110.031 -179.597 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' D' D ' 337' ' ' ARG . . . . . 0.492 ' NH1' ' HG2' ' D' ' 337' ' ' ARG . 0.0 OUTLIER -59.86 -26.38 65.79 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.175 -0.953 . . . . 3.64 109.862 -179.579 . . . . . . . . 3 3 . 1 . 024 nuclear orig full ' D' D ' 338' ' ' PHE . . . . . 0.441 ' HB3' ' O ' ' D' ' 335' ' ' ARG . 51.0 t80 -55.58 -58.7 6.71 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.195 -0.941 . . . . 0.4 109.725 -179.869 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' D' D ' 339' ' ' GLU . . . . . . . . . . . . . 55.6 mt-10 -50.63 -32.7 19.72 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.301 -0.874 . . . . 1.99 110.067 -179.711 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' D' D ' 340' ' ' MET . . . . . . . . . . . . . 23.2 ttp -63.78 -51.18 65.99 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.181 -0.95 . . . . 1.13 110.008 -179.62 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' D' D ' 341' ' ' PHE . . . . . 0.451 ' HB2' HD12 ' D' ' 332' ' ' ILE . 36.6 m-85 -62.01 -45.88 91.66 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.224 -0.922 . . . . 0.21 110.064 -179.55 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' D' D ' 342' ' ' ARG . . . . . 0.45 ' NH1' ' HG3' ' D' ' 342' ' ' ARG . 0.0 OUTLIER -49.58 -42.42 44.39 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.086 -1.009 . . . . 3.15 110.094 -179.513 . . . . . . . . 3 3 . 1 . 024 nuclear orig full ' D' D ' 343' ' ' GLU . . . . . . . . . . . . . 1.6 tt0 -58.81 -47.69 83.93 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.018 -1.051 . . . . 2.35 109.886 -179.538 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' D' D ' 344' ' ' LEU . . . . . . . . . . . . . 49.5 mt -61.59 -33.13 73.35 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.106 -0.996 . . . . 1.06 109.435 -179.776 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' D' D ' 345' ' ' ASN . . . . . . . . . . . . . 21.7 t-20 -58.03 -59.14 5.73 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.299 -0.875 . . . . 1.35 109.716 -179.851 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' D' D ' 346' ' ' GLU . . . . . . . . . . . . . 72.1 tt0 -62.11 -28.61 69.75 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.337 -0.852 . . . . 1.69 110.059 -179.641 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' D' D ' 347' ' ' ALA . . . . . . . . . . . . . . . -60.24 -57.05 14.45 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.084 -1.01 . . . . 1.03 110.063 -179.641 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' D' D ' 348' ' ' LEU . . . . . 0.506 ' N ' HD23 ' D' ' 348' ' ' LEU . 4.0 mm? -61.92 -46.59 88.69 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.246 -0.909 . . . . 1.04 110.106 -179.426 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' D' D ' 349' ' ' GLU . . . . . . . . . . . . . 33.6 mm-40 -56.97 -33.41 67.06 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.187 -0.946 . . . . 1.95 109.964 -179.397 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' D' D ' 350' ' ' LEU . . . . . 0.548 HD11 ' CD1' ' C' ' 350' ' ' LEU . 5.8 tt -64.64 -48.19 75.74 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.15 -0.969 . . . . 1.16 109.666 -179.921 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' D' D ' 351' ' ' LYS . . . . . . . . . . . . . 22.3 tttm -58.43 -39.49 79.94 Favored 'General case' 0 N--CA 1.487 1.414 0 O-C-N 121.24 -0.913 . . . . 1.97 109.349 -179.874 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' D' D ' 352' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -57.97 -52.39 65.72 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.28 -0.887 . . . . 1.17 109.829 179.929 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' D' D ' 353' ' ' ALA . . . . . . . . . . . . . . . -66.58 -9.93 40.33 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.21 -0.931 . . . . 1.21 109.783 -179.483 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' D' D ' 354' ' ' GLN . . . . . . . . . . . . . 2.5 tt0 -84.2 -53.97 5.13 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.134 -0.979 . . . . 1.68 109.613 179.996 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' D' D ' 355' ' ' ALA . . . . . . . . . . . . . . . -70.81 -8.77 54.89 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.22 -0.925 . . . . 1.29 109.85 -179.676 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' D' D ' 356' ' ' GLY . . . . . . . . . . . . . . . -81.11 -23.01 59.89 Favored Glycine 0 N--CA 1.491 2.305 0 N-CA-C 109.477 -1.449 . . . . 1.28 109.477 179.807 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' D' D ' 357' ' ' LYS . . . . . . . . . . . . . 15.2 mtpp -89.47 143.21 27.0 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.328 -1.101 . . . . 4.45 109.504 179.85 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' D' D ' 358' ' ' GLU . . . . . 0.447 ' HG2' ' HD2' ' D' ' 359' ' ' PRO . 2.4 tt0 -49.73 144.07 10.31 Favored Pre-proline 0 N--CA 1.489 1.517 0 O-C-N 121.153 -0.967 . . . . 5.71 109.331 -179.996 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' D' D ' 359' ' ' PRO . . . . . 0.447 ' HD2' ' HG2' ' D' ' 358' ' ' GLU . 2.3 Cg_endo -62.53 -164.83 0.04 OUTLIER 'Trans proline' 0 C--N 1.31 -1.491 0 C-N-CA 122.07 1.846 . . . . 5.6 110.23 -179.948 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' D' D ' 360' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.322 0 N-CA-C 109.458 -1.457 . . . . 6.97 109.458 179.929 . . . . . . . . 0 0 . 1 . 025 nuclear orig full ' A' A ' 319' ' ' LYS . . . . . . . . . . . . . 9.9 mtmt . . . . . 0 N--CA 1.491 1.601 0 N-CA-C 109.418 -0.586 . . . . 7.95 109.418 . . . . . . . . . 0 0 . 1 . 025 nuclear orig full ' A' A ' 320' ' ' LYS . . . . . 0.464 ' O ' ' HD3' ' A' ' 322' ' ' PRO . 6.8 mttt 57.69 45.55 18.81 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.32 -0.862 . . . . 6.71 109.264 -179.932 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 321' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -82.11 114.26 49.57 Favored Pre-proline 0 N--CA 1.492 1.625 0 O-C-N 121.413 -0.805 . . . . 6.5 109.438 -179.882 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 322' ' ' PRO . . . . . 0.464 ' HD3' ' O ' ' A' ' 320' ' ' LYS . 1.9 Cg_endo -68.2 -4.84 13.46 Favored 'Trans proline' 0 C--N 1.313 -1.293 0 C-N-CA 121.83 1.686 . . . . 3.3 110.389 -179.819 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 323' ' ' LEU . . . . . . . . . . . . . 16.7 mt -84.87 46.69 1.29 Allowed 'General case' 0 N--CA 1.488 1.452 0 O-C-N 121.091 -1.006 . . . . 3.16 109.663 179.923 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 324' ' ' ASP . . . . . . . . . . . . . 19.4 m-20 -79.86 140.66 36.7 Favored 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.034 -1.041 . . . . 1.53 109.182 179.927 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 325' ' ' GLY . . . . . . . . . . . . . . . -67.96 179.99 17.31 Favored Glycine 0 N--CA 1.489 2.203 0 N-CA-C 109.475 -1.45 . . . . 0.67 109.475 -179.811 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 326' ' ' GLU . . . . . . . . . . . . . 3.0 mm-40 -57.72 179.61 0.06 Allowed 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.155 -1.203 . . . . 2.13 109.371 -179.938 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 327' ' ' TYR . . . . . 0.424 ' CE1' ' HG2' ' C' ' 333' ' ' ARG . 48.4 m-85 -148.92 106.28 3.63 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.163 -0.96 . . . . 1.0 109.629 -179.919 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 328' ' ' PHE . . . . . . . . . . . . . 68.6 m-85 -112.97 -164.08 0.89 Allowed 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.23 -0.919 . . . . 0.34 109.55 179.834 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 329' ' ' THR . . . . . . . . . . . . . 20.9 p -153.83 173.96 15.21 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.228 -0.92 . . . . 1.05 109.227 179.833 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 330' ' ' LEU . . . . . . . . . . . . . 28.8 tp -152.16 131.95 13.25 Favored 'General case' 0 N--CA 1.489 1.476 0 O-C-N 120.94 -1.1 . . . . 1.07 109.833 -179.891 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 331' ' ' GLN . . . . . 0.402 ' NE2' ' O ' ' C' ' 328' ' ' PHE . 45.4 tp60 -88.97 107.34 18.97 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.354 -0.841 . . . . 0.91 109.192 179.533 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 332' ' ' ILE . . . . . . . . . . . . . 36.9 mt -103.3 107.21 21.64 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.624 0 O-C-N 121.112 -0.993 . . . . 1.09 109.778 -179.792 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 333' ' ' ARG . . . . . 0.575 ' HG2' ' CE2' ' C' ' 327' ' ' TYR . 0.0 OUTLIER -73.45 155.88 38.82 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.39 -0.819 . . . . 3.41 109.393 179.702 . . . . . . . . 3 3 . 1 . 025 nuclear orig full ' A' A ' 334' ' ' GLY . . . . . . . . . . . . . . . 77.13 128.23 0.35 Allowed Glycine 0 N--CA 1.492 2.433 0 N-CA-C 109.898 -1.281 . . . . 0.4 109.898 179.584 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 335' ' ' ARG . . . . . 0.562 ' HG3' ' CE2' ' C' ' 328' ' ' PHE . 1.7 ttt-85 -80.0 -36.1 36.44 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.371 -1.076 . . . . 3.55 109.543 179.862 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 336' ' ' GLU . . . . . . . . . . . . . 2.2 tm-20 -56.22 -64.84 0.73 Allowed 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.27 -0.893 . . . . 2.29 109.723 -179.84 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 337' ' ' ARG . . . . . 0.439 ' NH1' ' CG ' ' A' ' 337' ' ' ARG . 0.0 OUTLIER -60.78 -28.9 69.09 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.339 -0.851 . . . . 3.64 109.542 -179.675 . . . . . . . . 3 3 . 1 . 025 nuclear orig full ' A' A ' 338' ' ' PHE . . . . . . . . . . . . . 52.3 t80 -55.52 -60.17 3.8 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.163 -0.96 . . . . 0.41 109.462 -179.925 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 339' ' ' GLU . . . . . . . . . . . . . 65.0 mm-40 -51.24 -30.09 16.45 Favored 'General case' 0 N--CA 1.488 1.456 0 O-C-N 121.357 -0.839 . . . . 1.97 109.757 -179.903 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 340' ' ' MET . . . . . 0.417 ' HB3' ' O ' ' A' ' 337' ' ' ARG . 7.6 ttp -64.19 -50.45 68.03 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.175 -0.953 . . . . 1.14 109.575 -179.95 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 341' ' ' PHE . . . . . . . . . . . . . 45.5 m-85 -63.0 -45.7 91.14 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.33 -0.856 . . . . 0.21 109.981 -179.703 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 342' ' ' ARG . . . . . . . . . . . . . 5.4 ttm180 -49.29 -40.99 36.82 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.122 -0.986 . . . . 3.15 109.915 -179.535 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 343' ' ' GLU . . . . . . . . . . . . . 1.4 tt0 -58.71 -43.78 90.18 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.145 -0.972 . . . . 2.35 109.806 -179.714 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 344' ' ' LEU . . . . . 0.466 ' O ' HD21 ' A' ' 348' ' ' LEU . 42.9 mt -63.28 -46.15 88.17 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.239 -0.913 . . . . 1.06 109.876 -179.749 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 345' ' ' ASN . . . . . . . . . . . . . 42.3 t-20 -55.61 -46.95 77.27 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.115 -0.991 . . . . 1.36 109.923 -179.481 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 346' ' ' GLU . . . . . . . . . . . . . 1.4 tp10 -60.72 -36.39 78.72 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.179 -0.951 . . . . 1.65 109.776 -179.66 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 347' ' ' ALA . . . . . . . . . . . . . . . -59.4 -51.1 71.37 Favored 'General case' 0 N--CA 1.493 1.692 0 O-C-N 121.222 -0.924 . . . . 1.03 109.944 -179.712 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 348' ' ' LEU . . . . . 0.466 HD21 ' O ' ' A' ' 344' ' ' LEU . 4.1 mm? -61.78 -43.86 98.01 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.237 -0.914 . . . . 1.04 109.658 -179.721 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 349' ' ' GLU . . . . . . . . . . . . . 2.2 mm-40 -59.17 -34.16 71.77 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.199 -0.938 . . . . 1.94 110.244 -179.551 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 350' ' ' LEU . . . . . 0.488 ' O ' HD22 ' A' ' 350' ' ' LEU . 6.7 tt -63.12 -43.72 97.63 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.074 -1.016 . . . . 1.17 109.465 -179.773 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 351' ' ' LYS . . . . . . . . . . . . . 25.5 tttm -56.67 -42.73 79.51 Favored 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.22 -0.925 . . . . 1.97 109.861 -179.679 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 352' ' ' ASP . . . . . . . . . . . . . 36.2 m-20 -58.69 -49.92 75.78 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.186 -0.946 . . . . 1.16 109.817 179.974 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 353' ' ' ALA . . . . . . . . . . . . . . . -67.65 -10.27 50.73 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.27 -0.894 . . . . 1.22 109.534 -179.776 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 354' ' ' GLN . . . . . 0.449 ' NE2' ' CD1' ' B' ' 350' ' ' LEU . 2.9 tt0 -84.72 -59.07 2.47 Favored 'General case' 0 C--N 1.302 -1.473 0 O-C-N 121.25 -0.906 . . . . 1.71 109.767 -179.917 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 355' ' ' ALA . . . . . . . . . . . . . . . -70.0 -4.22 19.83 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.327 -0.858 . . . . 1.3 110.152 -179.534 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 356' ' ' GLY . . . . . . . . . . . . . . . -79.64 -10.78 85.44 Favored Glycine 0 N--CA 1.492 2.399 0 N-CA-C 109.362 -1.495 . . . . 1.3 109.362 179.866 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 357' ' ' LYS . . . . . . . . . . . . . 51.9 mttt -88.49 170.76 10.61 Favored 'General case' 0 N--CA 1.487 1.411 0 O-C-N 121.279 -1.13 . . . . 4.46 109.372 179.735 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 358' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -48.74 150.99 2.27 Favored Pre-proline 0 N--CA 1.491 1.579 0 O-C-N 121.26 -0.9 . . . . 5.75 109.254 179.961 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 359' ' ' PRO . . . . . . . . . . . . . 5.3 Cg_exo -58.95 -159.9 0.02 OUTLIER 'Trans proline' 0 C--N 1.309 -1.525 0 C-N-CA 122.05 1.833 . . . . 5.63 110.164 -179.958 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 360' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.194 0 CA-C-O 117.972 -1.46 . . . . 6.97 109.551 -179.94 . . . . . . . . 0 0 . 1 . 025 nuclear orig full ' B' B ' 319' ' ' LYS . . . . . . . . . . . . . 10.0 mtmt . . . . . 0 N--CA 1.489 1.516 0 N-CA-C 109.485 -0.561 . . . . 7.95 109.485 . . . . . . . . . 0 0 . 1 . 025 nuclear orig full ' B' B ' 320' ' ' LYS . . . . . 0.462 ' O ' ' HD3' ' B' ' 322' ' ' PRO . 6.2 mttt 57.86 45.14 18.92 Favored 'General case' 0 N--CA 1.489 1.501 0 O-C-N 121.259 -0.901 . . . . 6.73 109.233 179.907 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' B' B ' 321' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -81.79 114.24 48.75 Favored Pre-proline 0 N--CA 1.491 1.603 0 O-C-N 121.39 -0.819 . . . . 6.5 109.437 -179.952 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' B' B ' 322' ' ' PRO . . . . . 0.462 ' HD3' ' O ' ' B' ' 320' ' ' LYS . 1.8 Cg_endo -68.34 -4.62 13.19 Favored 'Trans proline' 0 C--N 1.313 -1.293 0 C-N-CA 121.938 1.759 . . . . 3.29 110.534 -179.924 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' B' B ' 323' ' ' LEU . . . . . . . . . . . . . 17.0 mt -85.05 45.64 1.19 Allowed 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.215 -0.928 . . . . 3.18 109.739 -179.834 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 324' ' ' ASP . . . . . . . . . . . . . 20.1 m-20 -79.28 139.2 37.92 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.16 -0.963 . . . . 1.53 109.548 179.998 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 325' ' ' GLY . . . . . . . . . . . . . . . -66.12 179.72 10.9 Favored Glycine 0 N--CA 1.49 2.254 0 N-CA-C 109.476 -1.449 . . . . 0.65 109.476 179.99 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 326' ' ' GLU . . . . . . . . . . . . . 3.0 mm-40 -58.1 179.5 0.07 Allowed 'General case' 0 N--CA 1.488 1.452 0 O-C-N 121.259 -1.142 . . . . 2.13 109.349 179.952 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 327' ' ' TYR . . . . . 0.568 ' CE1' ' HG2' ' D' ' 333' ' ' ARG . 47.6 m-85 -148.55 106.16 3.67 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.224 -0.923 . . . . 0.99 109.633 -179.841 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' B' B ' 328' ' ' PHE . . . . . 0.427 ' CZ ' ' HG3' ' D' ' 335' ' ' ARG . 66.7 m-85 -113.22 -164.5 0.92 Allowed 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.287 -0.883 . . . . 0.36 109.546 179.797 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' B' B ' 329' ' ' THR . . . . . . . . . . . . . 20.8 p -153.4 174.41 14.39 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.297 -0.877 . . . . 1.05 109.276 -179.956 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 330' ' ' LEU . . . . . . . . . . . . . 28.3 tp -152.75 131.53 12.41 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.062 -1.024 . . . . 1.07 109.917 -179.826 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 331' ' ' GLN . . . . . 0.43 ' NE2' ' O ' ' D' ' 328' ' ' PHE . 45.8 tp60 -88.81 107.91 19.23 Favored 'General case' 0 N--CA 1.489 1.48 0 O-C-N 121.33 -0.857 . . . . 0.91 109.135 179.507 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' B' B ' 332' ' ' ILE . . . . . . . . . . . . . 35.2 mt -103.84 107.15 21.62 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.584 0 O-C-N 121.136 -0.977 . . . . 1.08 109.618 -179.728 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 333' ' ' ARG . . . . . 0.505 ' HG2' ' CE1' ' D' ' 327' ' ' TYR . 0.0 OUTLIER -73.66 155.05 39.42 Favored 'General case' 0 N--CA 1.488 1.46 0 O-C-N 121.293 -0.879 . . . . 3.42 109.347 179.695 . . . . . . . . 3 3 . 1 . 025 nuclear orig full ' B' B ' 334' ' ' GLY . . . . . . . . . . . . . . . 78.05 128.39 0.45 Allowed Glycine 0 N--CA 1.492 2.369 0 N-CA-C 109.965 -1.254 . . . . 0.4 109.965 179.702 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 335' ' ' ARG . . . . . 0.51 ' HG2' ' NH1' ' B' ' 335' ' ' ARG . 1.7 ttt-85 -80.01 -35.8 36.83 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.308 -1.113 . . . . 3.55 109.467 179.845 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' B' B ' 336' ' ' GLU . . . . . . . . . . . . . 2.3 tm-20 -56.49 -65.43 0.61 Allowed 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.333 -0.854 . . . . 2.28 109.725 -179.699 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 337' ' ' ARG . . . . . 0.432 ' CG ' ' NH1' ' B' ' 337' ' ' ARG . 0.0 OUTLIER -60.18 -29.25 68.57 Favored 'General case' 0 N--CA 1.488 1.463 0 O-C-N 121.283 -0.886 . . . . 3.64 109.647 -179.789 . . . . . . . . 3 3 . 1 . 025 nuclear orig full ' B' B ' 338' ' ' PHE . . . . . . . . . . . . . 53.1 t80 -55.03 -59.83 4.2 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.243 -0.911 . . . . 0.39 109.542 -179.949 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 339' ' ' GLU . . . . . . . . . . . . . 62.4 mm-40 -51.6 -30.08 19.8 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.34 -0.85 . . . . 1.98 109.71 -179.963 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 340' ' ' MET . . . . . 0.424 ' HB3' ' O ' ' B' ' 337' ' ' ARG . 7.0 ttp -64.16 -50.91 66.32 Favored 'General case' 0 N--CA 1.489 1.499 0 O-C-N 121.192 -0.942 . . . . 1.14 109.592 -179.732 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' B' B ' 341' ' ' PHE . . . . . . . . . . . . . 47.0 m-85 -62.46 -46.24 89.41 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.231 -0.918 . . . . 0.22 109.939 -179.822 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 342' ' ' ARG . . . . . . . . . . . . . 5.4 ttm180 -48.98 -41.04 32.91 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.182 -0.949 . . . . 3.15 109.9 -179.437 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 343' ' ' GLU . . . . . . . . . . . . . 1.4 tt0 -58.91 -43.92 91.15 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.171 -0.956 . . . . 2.35 109.673 -179.641 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 344' ' ' LEU . . . . . 0.454 ' O ' HD21 ' B' ' 348' ' ' LEU . 41.3 mt -62.95 -46.27 88.54 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.217 -0.927 . . . . 1.05 109.939 -179.8 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' B' B ' 345' ' ' ASN . . . . . . . . . . . . . 41.7 t-20 -55.42 -46.85 76.63 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.253 -0.904 . . . . 1.35 109.823 -179.527 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 346' ' ' GLU . . . . . . . . . . . . . 1.4 tp10 -60.76 -36.66 79.49 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.239 -0.913 . . . . 1.66 109.825 -179.714 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 347' ' ' ALA . . . . . . . . . . . . . . . -59.23 -51.46 69.88 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.177 -0.952 . . . . 1.02 109.886 -179.731 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 348' ' ' LEU . . . . . 0.454 HD21 ' O ' ' B' ' 344' ' ' LEU . 4.1 mm? -61.21 -44.36 97.4 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.234 -0.917 . . . . 1.05 109.723 -179.751 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' B' B ' 349' ' ' GLU . . . . . . . . . . . . . 2.3 mm-40 -58.51 -34.75 71.29 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.257 -0.902 . . . . 1.95 110.214 -179.584 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 350' ' ' LEU . . . . . 0.477 HD22 ' O ' ' B' ' 350' ' ' LEU . 6.4 tt -62.53 -44.14 97.09 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.058 -1.026 . . . . 1.18 109.579 -179.888 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' B' B ' 351' ' ' LYS . . . . . . . . . . . . . 26.3 tttm -56.5 -43.24 79.51 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.312 -0.867 . . . . 1.96 109.797 -179.728 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 352' ' ' ASP . . . . . . . . . . . . . 35.0 m-20 -58.0 -50.41 73.5 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.218 -0.926 . . . . 1.16 109.712 179.972 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 353' ' ' ALA . . . . . . . . . . . . . . . -67.08 -10.96 55.55 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.087 -1.008 . . . . 1.21 109.62 -179.662 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 354' ' ' GLN . . . . . . . . . . . . . 3.0 tt0 -84.09 -59.05 2.52 Favored 'General case' 0 N--CA 1.489 1.497 0 O-C-N 121.324 -0.86 . . . . 1.69 109.781 -179.774 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 355' ' ' ALA . . . . . . . . . . . . . . . -70.14 -4.13 19.95 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.32 -0.863 . . . . 1.3 110.202 -179.321 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 356' ' ' GLY . . . . . . . . . . . . . . . -80.17 -9.71 86.3 Favored Glycine 0 N--CA 1.49 2.262 0 N-CA-C 109.398 -1.481 . . . . 1.29 109.398 179.848 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 357' ' ' LYS . . . . . . . . . . . . . 54.1 mttt -89.31 171.06 10.04 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.348 -1.089 . . . . 4.45 109.289 179.621 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 358' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -48.5 151.0 2.12 Favored Pre-proline 0 N--CA 1.491 1.579 0 O-C-N 121.145 -0.972 . . . . 5.72 109.288 179.958 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' B' B ' 359' ' ' PRO . . . . . . . . . . . . . 4.9 Cg_exo -59.01 -159.6 0.02 OUTLIER 'Trans proline' 0 C--N 1.311 -1.446 0 C-N-CA 122.169 1.912 . . . . 5.6 110.13 179.844 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 360' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.319 0 N-CA-C 109.475 -1.45 . . . . 6.98 109.475 179.997 . . . . . . . . 0 0 . 1 . 025 nuclear orig full ' C' C ' 319' ' ' LYS . . . . . . . . . . . . . 3.4 mttm . . . . . 0 N--CA 1.49 1.549 0 N-CA-C 109.297 -0.631 . . . . 7.03 109.297 . . . . . . . . . 0 0 . 1 . 025 nuclear orig full ' C' C ' 320' ' ' LYS . . . . . . . . . . . . . 17.1 mmtt 58.58 97.33 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.27 -0.894 . . . . 6.84 109.981 179.673 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' C' C ' 321' ' ' LYS . . . . . 0.505 ' HB2' ' HD2' ' C' ' 322' ' ' PRO . 0.0 OUTLIER -81.6 163.24 55.07 Favored Pre-proline 0 N--CA 1.489 1.508 0 N-CA-C 108.582 -0.896 . . . . 6.78 108.582 179.32 . . . . . . . . 3 3 . 1 . 025 nuclear orig full ' C' C ' 322' ' ' PRO . . . . . 0.505 ' HD2' ' HB2' ' C' ' 321' ' ' LYS . 4.2 Cg_exo -56.82 -149.14 0.0 OUTLIER 'Trans proline' 0 C--N 1.308 -1.602 0 C-N-CA 121.709 1.606 . . . . 3.98 109.988 -179.869 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' C' C ' 323' ' ' LEU . . . . . . . . . . . . . 71.2 mt -77.82 138.76 39.14 Favored 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.0 -1.063 . . . . 4.31 109.131 -179.875 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' C' C ' 324' ' ' ASP . . . . . . . . . . . . . 79.7 m-20 -76.89 161.68 28.22 Favored 'General case' 0 N--CA 1.488 1.468 0 O-C-N 121.235 -0.915 . . . . 1.63 109.707 -179.477 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' C' C ' 325' ' ' GLY . . . . . . . . . . . . . . . -68.25 -177.3 12.45 Favored Glycine 0 N--CA 1.487 2.093 0 N-CA-C 109.587 -1.405 . . . . 0.82 109.587 -179.848 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' C' C ' 326' ' ' GLU . . . . . . . . . . . . . 42.1 mm-40 -58.57 -177.27 0.03 OUTLIER 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.195 -1.179 . . . . 2.17 109.653 -179.853 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' C' C ' 327' ' ' TYR . . . . . 0.575 ' CE2' ' HG2' ' A' ' 333' ' ' ARG . 47.7 m-85 -149.66 101.88 3.11 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.325 -0.859 . . . . 1.03 109.258 -179.956 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' C' C ' 328' ' ' PHE . . . . . 0.562 ' CE2' ' HG3' ' A' ' 335' ' ' ARG . 71.1 m-85 -110.15 -161.34 0.75 Allowed 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.164 -0.96 . . . . 0.37 110.075 -179.799 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' C' C ' 329' ' ' THR . . . . . . . . . . . . . 33.8 p -154.95 169.76 23.31 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.482 -0.761 . . . . 1.04 109.071 179.834 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' C' C ' 330' ' ' LEU . . . . . . . . . . . . . 16.8 tp -149.89 127.23 11.43 Favored 'General case' 0 N--CA 1.489 1.494 0 O-C-N 121.219 -0.925 . . . . 1.09 109.851 -179.924 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' C' C ' 331' ' ' GLN . . . . . . . . . . . . . 12.5 tp60 -87.76 113.2 23.21 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.401 -0.812 . . . . 1.48 109.162 179.658 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' C' C ' 332' ' ' ILE . . . . . 0.418 HG23 ' HA ' ' C' ' 338' ' ' PHE . 32.1 mt -103.14 110.11 28.79 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.6 0 O-C-N 121.117 -0.99 . . . . 1.08 109.782 -179.789 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' C' C ' 333' ' ' ARG . . . . . 0.424 ' HG2' ' CE1' ' A' ' 327' ' ' TYR . 18.7 mtt180 -73.08 148.13 44.32 Favored 'General case' 0 N--CA 1.488 1.435 0 O-C-N 121.368 -0.833 . . . . 3.36 109.3 179.594 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' C' C ' 334' ' ' GLY . . . . . . . . . . . . . . . 80.07 128.6 0.73 Allowed Glycine 0 N--CA 1.489 2.221 0 N-CA-C 109.749 -1.34 . . . . 0.35 109.749 179.945 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' C' C ' 335' ' ' ARG . . . . . 0.445 ' NH1' ' CG ' ' C' ' 335' ' ' ARG . 0.1 OUTLIER -78.38 -30.25 47.77 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.323 -1.104 . . . . 3.23 109.478 179.919 . . . . . . . . 3 3 . 1 . 025 nuclear orig full ' C' C ' 336' ' ' GLU . . . . . . . . . . . . . 24.6 mt-10 -58.26 -66.02 0.55 Allowed 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.309 -0.869 . . . . 2.62 109.751 -179.924 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' C' C ' 337' ' ' ARG . . . . . . . . . . . . . 1.2 mtp180 -59.26 -26.92 65.33 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.211 -0.931 . . . . 3.61 109.614 -179.805 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' C' C ' 338' ' ' PHE . . . . . 0.418 ' HA ' HG23 ' C' ' 332' ' ' ILE . 74.3 t80 -56.03 -59.1 5.4 Favored 'General case' 0 N--CA 1.489 1.476 0 O-C-N 121.154 -0.966 . . . . 0.43 109.808 -179.88 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' C' C ' 339' ' ' GLU . . . . . . . . . . . . . 4.2 mt-10 -50.5 -33.89 23.1 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.208 -0.932 . . . . 2.05 110.09 -179.512 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' C' C ' 340' ' ' MET . . . . . . . . . . . . . 31.2 ttp -63.72 -51.56 64.43 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.195 -0.941 . . . . 1.1 110.101 -179.498 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' C' C ' 341' ' ' PHE . . . . . . . . . . . . . 47.8 m-85 -61.22 -46.58 89.84 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.114 -0.991 . . . . 0.21 110.012 -179.417 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' C' C ' 342' ' ' ARG . . . . . 0.484 ' NH1' ' HG3' ' C' ' 342' ' ' ARG . 0.0 OUTLIER -48.31 -42.52 31.3 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.246 -0.909 . . . . 3.42 110.252 -179.508 . . . . . . . . 3 3 . 1 . 025 nuclear orig full ' C' C ' 343' ' ' GLU . . . . . . . . . . . . . 44.4 tt0 -58.5 -47.37 84.31 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.165 -0.959 . . . . 2.14 110.095 -179.459 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' C' C ' 344' ' ' LEU . . . . . 0.468 HD21 HD21 ' D' ' 344' ' ' LEU . 92.6 mt -61.14 -44.58 97.1 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.119 -0.988 . . . . 1.09 109.952 -179.58 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' C' C ' 345' ' ' ASN . . . . . . . . . . . . . 64.7 t-20 -56.04 -51.72 66.79 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.218 -0.927 . . . . 1.38 110.045 -179.557 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' C' C ' 346' ' ' GLU . . . . . . . . . . . . . 7.7 tp10 -61.36 -31.95 71.84 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.059 -1.025 . . . . 2.21 109.553 -179.898 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' C' C ' 347' ' ' ALA . . . . . . . . . . . . . . . -59.97 -54.48 45.57 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.16 -0.962 . . . . 1.03 109.96 179.954 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' C' C ' 348' ' ' LEU . . . . . 0.515 ' N ' ' CD2' ' C' ' 348' ' ' LEU . 4.0 mm? -61.11 -40.68 94.68 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.177 -0.952 . . . . 1.06 109.791 -179.839 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' C' C ' 349' ' ' GLU . . . . . . . . . . . . . 11.7 mm-40 -57.74 -38.83 76.01 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.277 -0.89 . . . . 2.19 110.01 -179.469 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' C' C ' 350' ' ' LEU . . . . . 0.541 HD21 ' CD1' ' D' ' 350' ' ' LEU . 6.7 tt -63.18 -39.9 95.98 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.113 -0.992 . . . . 1.2 109.612 -179.839 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' C' C ' 351' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -59.16 -50.64 73.26 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.19 -0.944 . . . . 1.92 109.484 -179.843 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' C' C ' 352' ' ' ASP . . . . . . . . . . . . . 73.5 m-20 -55.69 -38.41 69.63 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.344 -0.847 . . . . 1.19 109.864 179.953 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' C' C ' 353' ' ' ALA . . . . . . . . . . . . . . . -68.74 -31.98 71.42 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.33 -0.856 . . . . 1.15 110.554 -179.328 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' C' C ' 354' ' ' GLN . . . . . . . . . . . . . 1.5 mt-30 -82.28 -16.49 49.26 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.007 -1.058 . . . . 1.7 109.991 -179.394 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' C' C ' 355' ' ' ALA . . . . . . . . . . . . . . . -74.55 -23.09 58.74 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.174 -0.954 . . . . 1.3 109.576 179.881 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' C' C ' 356' ' ' GLY . . . . . . . . . . . . . . . -79.38 -0.07 82.22 Favored Glycine 0 N--CA 1.49 2.29 0 N-CA-C 109.899 -1.28 . . . . 1.33 109.899 -179.748 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' C' C ' 357' ' ' LYS . . . . . 0.528 ' HA ' ' CE ' ' C' ' 357' ' ' LYS . 0.3 OUTLIER -84.99 138.39 32.49 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.187 -1.184 . . . . 4.39 109.399 -179.951 . . . . . . . . 3 3 . 1 . 025 nuclear orig full ' C' C ' 358' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -50.58 154.06 2.46 Favored Pre-proline 0 N--CA 1.491 1.589 0 O-C-N 121.336 -0.853 . . . . 5.75 109.924 -179.614 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' C' C ' 359' ' ' PRO . . . . . . . . . . . . . 1.9 Cg_endo -62.96 -81.05 0.01 OUTLIER 'Trans proline' 0 C--N 1.309 -1.542 0 C-N-CA 122.297 1.998 . . . . 5.54 109.961 179.647 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' C' C ' 360' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.256 0 N-CA-C 109.466 -1.454 . . . . 6.5 109.466 179.927 . . . . . . . . 0 0 . 1 . 025 nuclear orig full ' D' D ' 319' ' ' LYS . . . . . . . . . . . . . 10.1 mtmt . . . . . 0 N--CA 1.49 1.551 0 N-CA-C 109.271 -0.64 . . . . 7.93 109.271 . . . . . . . . . 0 0 . 1 . 025 nuclear orig full ' D' D ' 320' ' ' LYS . . . . . 0.48 ' O ' ' HD3' ' D' ' 322' ' ' PRO . 5.7 mttt 57.98 45.1 18.6 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.192 -0.942 . . . . 6.7 109.356 -179.937 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' D' D ' 321' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -81.78 113.79 45.39 Favored Pre-proline 0 N--CA 1.491 1.618 0 O-C-N 121.474 -0.766 . . . . 6.49 109.454 -179.949 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' D' D ' 322' ' ' PRO . . . . . 0.48 ' HD3' ' O ' ' D' ' 320' ' ' LYS . 1.9 Cg_endo -68.42 -4.77 13.57 Favored 'Trans proline' 0 C--N 1.312 -1.359 0 C-N-CA 121.899 1.732 . . . . 3.29 110.463 -179.775 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' D' D ' 323' ' ' LEU . . . . . . . . . . . . . 17.3 mt -84.84 46.11 1.23 Allowed 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.077 -1.015 . . . . 3.16 109.746 179.919 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' D' D ' 324' ' ' ASP . . . . . . . . . . . . . 22.0 m-20 -79.65 140.5 37.05 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.175 -0.953 . . . . 1.54 109.312 -179.979 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' D' D ' 325' ' ' GLY . . . . . . . . . . . . . . . -67.3 -179.87 13.8 Favored Glycine 0 N--CA 1.489 2.19 0 N-CA-C 109.437 -1.465 . . . . 0.65 109.437 -179.991 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' D' D ' 326' ' ' GLU . . . . . . . . . . . . . 3.1 mm-40 -58.08 179.78 0.06 Allowed 'General case' 0 N--CA 1.489 1.478 0 O-C-N 121.214 -1.168 . . . . 2.13 109.379 179.906 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' D' D ' 327' ' ' TYR . . . . . 0.505 ' CE1' ' HG2' ' B' ' 333' ' ' ARG . 48.7 m-85 -148.99 105.76 3.57 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.201 -0.937 . . . . 1.0 109.676 -179.8 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' D' D ' 328' ' ' PHE . . . . . 0.43 ' O ' ' NE2' ' B' ' 331' ' ' GLN . 67.3 m-85 -112.8 -163.9 0.88 Allowed 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.281 -0.887 . . . . 0.34 109.613 179.782 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' D' D ' 329' ' ' THR . . . . . . . . . . . . . 21.1 p -153.97 174.17 15.01 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.178 -0.951 . . . . 1.05 109.192 179.94 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' D' D ' 330' ' ' LEU . . . . . . . . . . . . . 29.1 tp -152.29 132.07 13.22 Favored 'General case' 0 N--CA 1.489 1.494 0 O-C-N 121.166 -0.959 . . . . 1.07 109.852 -179.864 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' D' D ' 331' ' ' GLN . . . . . 0.408 ' NE2' ' O ' ' B' ' 328' ' ' PHE . 46.3 tp60 -89.31 107.98 19.37 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.355 -0.841 . . . . 0.93 109.095 179.463 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' D' D ' 332' ' ' ILE . . . . . . . . . . . . . 33.5 mt -103.67 106.98 21.21 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.518 0 O-C-N 121.195 -0.94 . . . . 1.07 109.766 -179.855 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' D' D ' 333' ' ' ARG . . . . . 0.568 ' HG2' ' CE1' ' B' ' 327' ' ' TYR . 0.0 OUTLIER -73.58 154.35 39.84 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.37 -0.831 . . . . 3.42 109.402 179.693 . . . . . . . . 3 3 . 1 . 025 nuclear orig full ' D' D ' 334' ' ' GLY . . . . . . . . . . . . . . . 78.93 128.42 0.55 Allowed Glycine 0 N--CA 1.492 2.403 0 N-CA-C 109.94 -1.264 . . . . 0.41 109.94 179.607 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' D' D ' 335' ' ' ARG . . . . . 0.51 ' HG2' ' NH1' ' D' ' 335' ' ' ARG . 1.6 ttt-85 -80.24 -35.19 36.44 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.371 -1.076 . . . . 3.58 109.453 179.93 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' D' D ' 336' ' ' GLU . . . . . . . . . . . . . 2.4 tm-20 -57.19 -65.5 0.61 Allowed 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.311 -0.868 . . . . 2.26 109.685 -179.663 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' D' D ' 337' ' ' ARG . . . . . 0.431 HH11 ' CG ' ' D' ' 337' ' ' ARG . 0.0 OUTLIER -60.19 -29.11 68.49 Favored 'General case' 0 N--CA 1.489 1.486 0 O-C-N 121.392 -0.818 . . . . 3.64 109.543 -179.924 . . . . . . . . 3 3 . 1 . 025 nuclear orig full ' D' D ' 338' ' ' PHE . . . . . . . . . . . . . 54.9 t80 -54.84 -60.04 3.9 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.246 -0.909 . . . . 0.4 109.554 179.883 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' D' D ' 339' ' ' GLU . . . . . . . . . . . . . 60.7 mm-40 -51.63 -29.59 18.27 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.287 -0.883 . . . . 1.99 109.838 -179.813 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' D' D ' 340' ' ' MET . . . . . 0.409 ' HB3' ' O ' ' D' ' 337' ' ' ARG . 6.6 ttp -64.6 -50.61 66.52 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.15 -0.969 . . . . 1.13 109.58 -179.818 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' D' D ' 341' ' ' PHE . . . . . . . . . . . . . 46.5 m-85 -62.8 -46.26 88.78 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.347 -0.846 . . . . 0.21 109.954 -179.735 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' D' D ' 342' ' ' ARG . . . . . . . . . . . . . 5.5 ttm180 -49.09 -41.38 35.35 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.262 -0.899 . . . . 3.15 109.922 -179.429 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' D' D ' 343' ' ' GLU . . . . . . . . . . . . . 1.4 tt0 -58.66 -44.02 90.01 Favored 'General case' 0 N--CA 1.489 1.5 0 O-C-N 121.215 -0.928 . . . . 2.35 109.543 -179.621 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' D' D ' 344' ' ' LEU . . . . . 0.468 HD21 HD21 ' C' ' 344' ' ' LEU . 40.1 mt -62.92 -46.22 88.81 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.346 -0.846 . . . . 1.06 110.025 -179.743 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' D' D ' 345' ' ' ASN . . . . . . . . . . . . . 41.6 t-20 -55.59 -46.56 77.25 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.159 -0.963 . . . . 1.35 109.837 -179.519 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' D' D ' 346' ' ' GLU . . . . . . . . . . . . . 1.4 tp10 -60.67 -36.75 79.5 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.152 -0.967 . . . . 1.69 109.774 -179.806 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' D' D ' 347' ' ' ALA . . . . . . . . . . . . . . . -59.05 -50.95 72.14 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.091 -1.006 . . . . 1.03 110.025 -179.737 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' D' D ' 348' ' ' LEU . . . . . 0.457 HD21 ' O ' ' D' ' 344' ' ' LEU . 4.0 mm? -61.89 -43.84 98.02 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.129 -0.982 . . . . 1.04 109.829 -179.791 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' D' D ' 349' ' ' GLU . . . . . . . . . . . . . 2.3 mm-40 -59.05 -34.47 71.97 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.318 -0.864 . . . . 1.95 110.085 -179.531 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' D' D ' 350' ' ' LEU . . . . . 0.541 ' CD1' HD21 ' C' ' 350' ' ' LEU . 6.2 tt -62.83 -43.8 97.84 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.135 -0.978 . . . . 1.16 109.518 -179.87 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' D' D ' 351' ' ' LYS . . . . . . . . . . . . . 27.2 tttm -56.98 -42.7 80.69 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.352 -0.842 . . . . 1.97 109.728 -179.676 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' D' D ' 352' ' ' ASP . . . . . . . . . . . . . 33.7 m-20 -58.55 -50.36 74.07 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.118 -0.989 . . . . 1.17 109.613 -179.969 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' D' D ' 353' ' ' ALA . . . . . . . . . . . . . . . -66.93 -11.01 55.03 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.28 -0.888 . . . . 1.21 109.634 -179.794 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' D' D ' 354' ' ' GLN . . . . . 0.408 ' NE2' ' CD1' ' C' ' 350' ' ' LEU . 3.1 tt0 -84.16 -58.92 2.57 Favored 'General case' 0 C--N 1.3 -1.552 0 O-C-N 121.281 -0.887 . . . . 1.68 109.775 -179.774 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' D' D ' 355' ' ' ALA . . . . . . . . . . . . . . . -70.0 -4.07 19.16 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.373 -0.83 . . . . 1.29 110.14 -179.264 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' D' D ' 356' ' ' GLY . . . . . . . . . . . . . . . -79.75 -10.78 85.38 Favored Glycine 0 N--CA 1.491 2.308 0 N-CA-C 109.369 -1.492 . . . . 1.28 109.369 179.908 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' D' D ' 357' ' ' LYS . . . . . . . . . . . . . 56.5 mttt -88.89 171.43 9.91 Favored 'General case' 0 N--CA 1.488 1.456 0 O-C-N 121.264 -1.139 . . . . 4.45 109.51 179.805 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' D' D ' 358' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -48.46 151.15 2.05 Favored Pre-proline 0 N--CA 1.49 1.53 0 O-C-N 121.099 -1.001 . . . . 5.71 109.275 179.885 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' D' D ' 359' ' ' PRO . . . . . . . . . . . . . 4.8 Cg_exo -59.43 -159.48 0.02 OUTLIER 'Trans proline' 0 C--N 1.308 -1.573 0 C-N-CA 122.185 1.923 . . . . 5.6 110.156 -179.985 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' D' D ' 360' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.218 0 CA-C-O 118.025 -1.431 . . . . 6.97 109.592 -179.99 . . . . . . . . 0 0 . 1 . 026 nuclear orig full ' A' A ' 319' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.49 1.557 0 N-CA-C 109.673 -0.491 . . . . 7.95 109.673 . . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 320' ' ' LYS . . . . . . . . . . . . . 8.7 ttmm 59.56 84.91 0.11 Allowed 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.132 -0.98 . . . . 6.71 109.306 -179.826 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 321' ' ' LYS . . . . . 0.499 ' N ' ' HD3' ' A' ' 322' ' ' PRO . 0.0 OUTLIER -159.08 60.8 1.7 Allowed Pre-proline 0 N--CA 1.491 1.58 0 O-C-N 121.172 -0.955 . . . . 6.5 109.747 -179.86 . . . . . . . . 3 3 . 1 . 026 nuclear orig full ' A' A ' 322' ' ' PRO . . . . . 0.499 ' HD3' ' N ' ' A' ' 321' ' ' LYS . 2.6 Cg_endo -61.75 116.35 3.38 Favored 'Trans proline' 0 C--N 1.309 -1.545 0 C-N-CA 122.093 1.862 . . . . 3.3 110.188 179.729 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 323' ' ' LEU . . . . . . . . . . . . . 20.0 mt -81.45 118.01 22.35 Favored 'General case' 0 N--CA 1.489 1.501 0 O-C-N 121.234 -0.916 . . . . 3.16 109.399 179.936 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 324' ' ' ASP . . . . . 0.456 ' HB2' ' OH ' ' A' ' 327' ' ' TYR . 16.8 m-20 -79.46 179.71 7.3 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.198 -0.939 . . . . 1.53 109.574 -179.765 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 325' ' ' GLY . . . . . . . . . . . . . . . -69.18 -149.31 0.29 Allowed Glycine 0 N--CA 1.492 2.39 0 N-CA-C 109.86 -1.296 . . . . 0.67 109.86 -179.764 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 326' ' ' GLU . . . . . . . . . . . . . 32.4 mp0 -58.45 -168.41 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.336 -1.097 . . . . 2.13 109.611 -179.935 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 327' ' ' TYR . . . . . 0.566 ' CE1' ' HG2' ' C' ' 333' ' ' ARG . 41.5 m-85 -148.78 112.6 5.11 Favored 'General case' 0 N--CA 1.489 1.5 0 O-C-N 121.373 -0.829 . . . . 1.0 109.555 180.0 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 328' ' ' PHE . . . . . . . . . . . . . 98.0 m-85 -113.88 -169.43 1.51 Allowed 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.258 -0.901 . . . . 0.34 109.369 179.804 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 329' ' ' THR . . . . . . . . . . . . . 20.8 p -153.29 168.95 24.32 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.302 -0.874 . . . . 1.05 109.665 -179.761 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 330' ' ' LEU . . . . . . . . . . . . . 41.7 tp -152.19 129.11 10.98 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.29 -0.881 . . . . 1.07 109.591 -179.856 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 331' ' ' GLN . . . . . . . . . . . . . 1.4 tt0 -87.13 114.61 23.89 Favored 'General case' 0 N--CA 1.488 1.429 0 O-C-N 121.403 -0.81 . . . . 0.91 109.14 179.537 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 332' ' ' ILE . . . . . . . . . . . . . 45.8 mt -103.32 104.3 16.44 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.54 0 O-C-N 121.095 -1.003 . . . . 1.09 109.487 -179.933 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 333' ' ' ARG . . . . . 0.489 ' HG2' ' CE2' ' C' ' 327' ' ' TYR . 49.4 mtt180 -72.82 143.58 47.82 Favored 'General case' 0 N--CA 1.488 1.433 0 O-C-N 121.306 -0.871 . . . . 3.41 109.108 179.822 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 334' ' ' GLY . . . . . . . . . . . . . . . 89.2 125.72 2.7 Favored Glycine 0 N--CA 1.491 2.342 0 N-CA-C 109.423 -1.471 . . . . 0.4 109.423 -179.93 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 335' ' ' ARG . . . . . . . . . . . . . 15.1 ttt180 -76.41 -40.39 50.97 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.202 -1.175 . . . . 3.55 109.742 -179.897 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 336' ' ' GLU . . . . . . . . . . . . . 20.0 tt0 -58.09 -58.76 7.03 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.42 -0.8 . . . . 2.29 109.928 -179.746 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 337' ' ' ARG . . . . . 0.433 ' NH1' ' CG ' ' A' ' 337' ' ' ARG . 0.0 OUTLIER -61.18 -32.51 72.25 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.229 -0.919 . . . . 3.64 109.509 -179.833 . . . . . . . . 3 3 . 1 . 026 nuclear orig full ' A' A ' 338' ' ' PHE . . . . . . . . . . . . . 53.0 t80 -55.75 -53.88 51.25 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.303 -0.873 . . . . 0.41 109.392 179.908 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 339' ' ' GLU . . . . . . . . . . . . . 43.1 mt-10 -50.8 -32.49 20.18 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.247 -0.908 . . . . 1.97 109.861 -179.644 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 340' ' ' MET . . . . . . . . . . . . . 19.6 ttp -63.1 -51.64 65.77 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.088 -1.007 . . . . 1.14 109.79 -179.551 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 341' ' ' PHE . . . . . . . . . . . . . 37.3 m-85 -62.06 -41.47 98.19 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.133 -0.98 . . . . 0.21 109.816 -179.829 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 342' ' ' ARG . . . . . . . . . . . . . 6.1 tpt180 -49.1 -43.46 41.32 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.261 -0.899 . . . . 3.15 110.105 -179.497 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 343' ' ' GLU . . . . . . . . . . . . . 1.3 tt0 -59.95 -46.02 90.75 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.202 -0.936 . . . . 2.35 109.639 -179.757 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 344' ' ' LEU . . . . . 0.419 ' O ' HD21 ' A' ' 348' ' ' LEU . 57.6 mt -62.04 -30.28 70.87 Favored 'General case' 0 N--CA 1.488 1.467 0 O-C-N 121.315 -0.866 . . . . 1.06 109.372 -179.954 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 345' ' ' ASN . . . . . . . . . . . . . 12.4 t-20 -59.24 -58.09 10.14 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.346 -0.846 . . . . 1.36 109.965 -179.725 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 346' ' ' GLU . . . . . . . . . . . . . 15.8 tt0 -61.74 -28.15 69.23 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.212 -0.93 . . . . 1.65 109.731 -179.555 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 347' ' ' ALA . . . . . . . . . . . . . . . -60.9 -61.71 2.38 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.099 -1.001 . . . . 1.03 110.011 -179.607 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 348' ' ' LEU . . . . . 0.462 ' N ' HD23 ' A' ' 348' ' ' LEU . 3.8 mm? -61.52 -45.65 93.3 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.278 -0.889 . . . . 1.04 110.21 -179.396 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 349' ' ' GLU . . . . . 0.43 ' OE2' ' HD2' ' C' ' 333' ' ' ARG . 3.5 mt-10 -57.69 -32.93 67.84 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.226 -0.921 . . . . 1.94 110.072 -179.339 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 350' ' ' LEU . . . . . 0.486 HD21 HD21 ' B' ' 350' ' ' LEU . 7.8 tt -65.75 -43.99 87.24 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.032 -1.043 . . . . 1.17 109.391 -179.91 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 351' ' ' LYS . . . . . . . . . . . . . 13.3 tttt -59.07 -50.95 72.11 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.381 -0.824 . . . . 1.97 109.352 -179.937 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 352' ' ' ASP . . . . . . . . . . . . . 2.3 m-20 -56.24 -31.23 63.36 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.205 -0.934 . . . . 1.16 109.82 -179.922 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 353' ' ' ALA . . . . . . . . . . . . . . . -67.25 -33.25 74.93 Favored 'General case' 0 N--CA 1.495 1.776 0 O-C-N 121.13 -0.981 . . . . 1.22 110.072 -179.731 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 354' ' ' GLN . . . . . . . . . . . . . 20.1 mt-30 -83.11 -10.12 58.84 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.128 -0.983 . . . . 1.71 109.576 -179.696 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 355' ' ' ALA . . . . . . . . . . . . . . . -73.49 -3.3 26.8 Favored 'General case' 0 N--CA 1.493 1.717 0 O-C-N 121.312 -0.867 . . . . 1.3 110.135 -179.901 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 356' ' ' GLY . . . . . . . . . . . . . . . -79.72 -33.38 34.24 Favored Glycine 0 N--CA 1.489 2.22 0 N-CA-C 109.769 -1.332 . . . . 1.3 109.769 -179.528 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 357' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -87.1 149.94 24.34 Favored 'General case' 0 N--CA 1.489 1.494 0 O-C-N 121.315 -1.109 . . . . 4.46 109.633 -179.912 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 358' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -49.15 117.38 6.52 Favored Pre-proline 0 N--CA 1.492 1.664 0 O-C-N 121.157 -0.964 . . . . 5.75 109.453 -179.975 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 359' ' ' PRO . . . . . . . . . . . . . 4.4 Cg_exo -59.29 131.19 39.62 Favored 'Trans proline' 0 C--N 1.313 -1.303 0 C-N-CA 121.866 1.711 . . . . 5.63 110.307 -179.826 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 360' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.255 0 CA-C-O 117.973 -1.459 . . . . 6.97 109.499 -179.902 . . . . . . . . 0 0 . 1 . 026 nuclear orig full ' B' B ' 319' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.49 1.551 0 CA-C-O 121.195 0.521 . . . . 7.95 109.798 . . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' B' B ' 320' ' ' LYS . . . . . . . . . . . . . 8.9 ttmm 59.38 84.5 0.11 Allowed 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.17 -0.956 . . . . 6.73 109.448 -179.852 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' B' B ' 321' ' ' LYS . . . . . 0.518 ' N ' ' HD3' ' B' ' 322' ' ' PRO . 0.0 OUTLIER -158.39 59.41 1.55 Allowed Pre-proline 0 N--CA 1.492 1.649 0 O-C-N 121.153 -0.967 . . . . 6.5 109.959 -179.689 . . . . . . . . 3 3 . 1 . 026 nuclear orig full ' B' B ' 322' ' ' PRO . . . . . 0.518 ' HD3' ' N ' ' B' ' 321' ' ' LYS . 2.6 Cg_endo -61.28 116.11 3.17 Favored 'Trans proline' 0 C--N 1.309 -1.508 0 C-N-CA 122.169 1.913 . . . . 3.29 110.166 179.752 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' B' B ' 323' ' ' LEU . . . . . . . . . . . . . 18.6 mt -80.91 118.62 22.56 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.261 -0.9 . . . . 3.18 109.359 179.952 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' B' B ' 324' ' ' ASP . . . . . 0.419 ' HB2' ' OH ' ' B' ' 327' ' ' TYR . 17.2 m-20 -79.64 179.36 7.55 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.203 -0.936 . . . . 1.53 109.494 179.992 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' B' B ' 325' ' ' GLY . . . . . . . . . . . . . . . -68.88 -148.97 0.24 Allowed Glycine 0 N--CA 1.491 2.312 0 N-CA-C 109.908 -1.277 . . . . 0.65 109.908 -179.768 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' B' B ' 326' ' ' GLU . . . . . . . . . . . . . 34.5 mp0 -58.77 -168.18 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.29 -1.123 . . . . 2.13 109.768 -179.724 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' B' B ' 327' ' ' TYR . . . . . 0.419 ' OH ' ' HB2' ' B' ' 324' ' ' ASP . 41.8 m-85 -149.37 112.2 4.83 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.354 -0.841 . . . . 0.99 109.898 -179.994 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' B' B ' 328' ' ' PHE . . . . . 0.449 ' CE2' ' HA ' ' D' ' 335' ' ' ARG . 97.3 m-85 -113.52 -169.51 1.51 Allowed 'General case' 0 N--CA 1.487 1.411 0 O-C-N 121.342 -0.849 . . . . 0.36 109.503 179.942 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' B' B ' 329' ' ' THR . . . . . . . . . . . . . 18.0 p -152.94 169.27 23.28 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.182 -0.948 . . . . 1.05 109.792 -179.661 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' B' B ' 330' ' ' LEU . . . . . . . . . . . . . 39.6 tp -152.4 129.31 10.99 Favored 'General case' 0 N--CA 1.489 1.478 0 O-C-N 121.365 -0.835 . . . . 1.07 109.668 179.998 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' B' B ' 331' ' ' GLN . . . . . . . . . . . . . 1.3 tt0 -87.01 115.27 24.28 Favored 'General case' 0 N--CA 1.488 1.475 0 O-C-N 121.36 -0.837 . . . . 0.91 109.115 179.504 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' B' B ' 332' ' ' ILE . . . . . . . . . . . . . 42.6 mt -103.48 103.59 15.38 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.599 0 O-C-N 120.945 -1.097 . . . . 1.08 109.7 179.964 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' B' B ' 333' ' ' ARG . . . . . . . . . . . . . 50.3 mtt180 -72.4 142.75 48.7 Favored 'General case' 0 C--N 1.302 -1.463 0 O-C-N 121.085 -1.01 . . . . 3.42 109.261 179.759 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' B' B ' 334' ' ' GLY . . . . . . . . . . . . . . . 89.79 125.6 2.86 Favored Glycine 0 N--CA 1.49 2.29 0 N-CA-C 109.583 -1.407 . . . . 0.4 109.583 -179.821 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' B' B ' 335' ' ' ARG . . . . . . . . . . . . . 16.6 ttt180 -76.45 -40.37 50.69 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.151 -1.206 . . . . 3.55 109.72 -179.928 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' B' B ' 336' ' ' GLU . . . . . . . . . . . . . 24.1 tt0 -58.23 -59.31 5.51 Favored 'General case' 0 N--CA 1.489 1.49 0 O-C-N 121.083 -1.011 . . . . 2.28 109.69 -179.577 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' B' B ' 337' ' ' ARG . . . . . 0.451 ' CG ' ' NH1' ' B' ' 337' ' ' ARG . 0.0 OUTLIER -60.26 -32.42 71.14 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.12 -0.987 . . . . 3.64 109.766 -179.795 . . . . . . . . 3 3 . 1 . 026 nuclear orig full ' B' B ' 338' ' ' PHE . . . . . . . . . . . . . 52.4 t80 -55.93 -52.94 62.36 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.226 -0.921 . . . . 0.39 109.625 -179.895 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' B' B ' 339' ' ' GLU . . . . . . . . . . . . . 35.3 mt-10 -51.12 -33.03 24.71 Favored 'General case' 0 N--CA 1.488 1.461 0 O-C-N 121.35 -0.844 . . . . 1.98 109.848 -179.574 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' B' B ' 340' ' ' MET . . . . . . . . . . . . . 20.0 ttp -62.83 -51.36 67.32 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.115 -0.99 . . . . 1.14 109.924 -179.512 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' B' B ' 341' ' ' PHE . . . . . . . . . . . . . 35.6 m-85 -62.41 -41.72 98.9 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.128 -0.982 . . . . 0.22 109.796 -179.834 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' B' B ' 342' ' ' ARG . . . . . . . . . . . . . 5.7 tpt180 -48.88 -44.32 39.82 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.383 -0.823 . . . . 3.15 109.68 -179.806 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' B' B ' 343' ' ' GLU . . . . . . . . . . . . . 1.3 tt0 -58.44 -47.42 84.04 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.085 -1.009 . . . . 2.35 109.705 -179.85 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' B' B ' 344' ' ' LEU . . . . . 0.431 ' O ' HD21 ' B' ' 348' ' ' LEU . 51.6 mt -61.01 -30.52 70.35 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.158 -0.964 . . . . 1.05 109.684 -179.831 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' B' B ' 345' ' ' ASN . . . . . . . . . . . . . 12.1 t-20 -58.91 -58.33 9.12 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.314 -0.866 . . . . 1.35 110.132 -179.837 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' B' B ' 346' ' ' GLU . . . . . . . . . . . . . 17.7 tt0 -61.65 -28.44 69.38 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.112 -0.993 . . . . 1.66 109.568 -179.464 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' B' B ' 347' ' ' ALA . . . . . . . . . . . . . . . -60.59 -61.14 2.81 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.248 -0.908 . . . . 1.02 110.199 -179.778 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' B' B ' 348' ' ' LEU . . . . . 0.431 HD21 ' O ' ' B' ' 344' ' ' LEU . 3.8 mm? -62.36 -46.05 90.44 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.307 -0.871 . . . . 1.05 110.023 -179.279 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' B' B ' 349' ' ' GLU . . . . . . . . . . . . . 3.9 mt-10 -57.09 -33.2 67.07 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.025 -1.047 . . . . 1.95 110.099 -179.48 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' B' B ' 350' ' ' LEU . . . . . 0.486 HD21 HD21 ' A' ' 350' ' ' LEU . 7.8 tt -65.41 -44.3 87.87 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.159 -0.963 . . . . 1.18 109.442 -179.923 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' B' B ' 351' ' ' LYS . . . . . . . . . . . . . 15.0 tttt -58.74 -50.65 73.12 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.233 -0.917 . . . . 1.96 109.454 -179.984 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' B' B ' 352' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 -56.35 -31.92 64.23 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.224 -0.922 . . . . 1.16 109.841 -179.85 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' B' B ' 353' ' ' ALA . . . . . . . . . . . . . . . -66.82 -33.0 74.65 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.194 -0.941 . . . . 1.21 109.896 -179.661 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' B' B ' 354' ' ' GLN . . . . . . . . . . . . . 20.3 mt-30 -82.89 -9.9 59.09 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.107 -0.995 . . . . 1.69 109.515 -179.914 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' B' B ' 355' ' ' ALA . . . . . . . . . . . . . . . -73.93 -3.22 27.65 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.11 -0.994 . . . . 1.3 110.217 -179.722 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' B' B ' 356' ' ' GLY . . . . . . . . . . . . . . . -80.37 -32.03 35.91 Favored Glycine 0 N--CA 1.491 2.336 0 N-CA-C 109.803 -1.319 . . . . 1.29 109.803 -179.742 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' B' B ' 357' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -87.74 149.37 24.25 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.104 -1.233 . . . . 4.45 109.402 179.866 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' B' B ' 358' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -49.01 116.88 5.87 Favored Pre-proline 0 N--CA 1.488 1.448 0 O-C-N 121.363 -0.836 . . . . 5.72 109.333 179.903 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' B' B ' 359' ' ' PRO . . . . . . . . . . . . . 4.3 Cg_exo -59.44 132.14 44.57 Favored 'Trans proline' 0 C--N 1.31 -1.449 0 C-N-CA 122.052 1.834 . . . . 5.6 110.321 -179.9 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' B' B ' 360' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.494 2.529 0 N-CA-C 109.408 -1.477 . . . . 6.98 109.408 -179.847 . . . . . . . . 0 0 . 1 . 026 nuclear orig full ' C' C ' 319' ' ' LYS . . . . . 0.477 ' O ' ' O ' ' C' ' 320' ' ' LYS . 0.0 OUTLIER . . . . . 0 N--CA 1.488 1.44 0 N-CA-C 109.49 -0.559 . . . . 7.03 109.49 . . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' C' C ' 320' ' ' LYS . . . . . 0.477 ' O ' ' O ' ' C' ' 319' ' ' LYS . 1.4 tttp 56.21 162.33 0.02 OUTLIER 'General case' 0 N--CA 1.489 1.477 0 O-C-N 121.26 -0.9 . . . . 6.84 109.378 179.996 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' C' C ' 321' ' ' LYS . . . . . . . . . . . . . 1.8 mptt -159.73 83.71 2.26 Favored Pre-proline 0 N--CA 1.489 1.503 0 O-C-N 121.275 -0.891 . . . . 6.78 109.556 179.898 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' C' C ' 322' ' ' PRO . . . . . . . . . . . . . 6.1 Cg_endo -71.39 16.11 0.32 Allowed 'Trans proline' 0 C--N 1.309 -1.541 0 C-N-CA 122.727 2.285 . . . . 3.98 111.943 -179.83 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' C' C ' 323' ' ' LEU . . . . . . . . . . . . . 15.8 mt -80.24 86.94 5.58 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 120.597 -1.314 . . . . 4.31 109.601 -179.857 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' C' C ' 324' ' ' ASP . . . . . 0.533 ' CB ' ' OH ' ' C' ' 327' ' ' TYR . 0.9 OUTLIER -86.57 148.15 25.62 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.17 -0.956 . . . . 1.63 110.165 -179.94 . . . . . . . . 3 3 . 1 . 026 nuclear orig full ' C' C ' 325' ' ' GLY . . . . . . . . . . . . . . . -71.25 -158.53 3.05 Favored Glycine 0 N--CA 1.49 2.278 0 N-CA-C 109.395 -1.482 . . . . 0.82 109.395 179.415 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' C' C ' 326' ' ' GLU . . . . . 0.408 ' O ' ' CD1' ' C' ' 327' ' ' TYR . 3.5 mt-10 -59.49 -166.86 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.193 -1.181 . . . . 2.17 109.382 179.695 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' C' C ' 327' ' ' TYR . . . . . 0.533 ' OH ' ' CB ' ' C' ' 324' ' ' ASP . 33.7 m-85 -149.33 112.09 4.81 Favored 'General case' 0 N--CA 1.488 1.45 0 O-C-N 121.375 -0.828 . . . . 1.03 110.458 179.721 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' C' C ' 328' ' ' PHE . . . . . . . . . . . . . 68.9 m-85 -112.96 -166.36 1.07 Allowed 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.423 -0.798 . . . . 0.37 108.975 179.458 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' C' C ' 329' ' ' THR . . . . . . . . . . . . . 4.4 p -154.28 166.01 34.5 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.259 -0.901 . . . . 1.04 109.492 -179.944 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' C' C ' 330' ' ' LEU . . . . . . . . . . . . . 42.0 tp -150.07 129.42 12.9 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.24 -0.912 . . . . 1.09 109.762 -179.692 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' C' C ' 331' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -87.59 116.48 25.74 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.278 -0.889 . . . . 1.48 109.095 179.683 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' C' C ' 332' ' ' ILE . . . . . 0.465 HG22 ' HA ' ' C' ' 338' ' ' PHE . 76.1 mt -104.14 110.71 31.16 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.559 0 O-C-N 121.195 -0.941 . . . . 1.08 109.828 -179.748 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' C' C ' 333' ' ' ARG . . . . . 0.566 ' HG2' ' CE1' ' A' ' 327' ' ' TYR . 58.2 mtt180 -73.89 143.01 45.98 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.238 -0.914 . . . . 3.36 109.368 179.64 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' C' C ' 334' ' ' GLY . . . . . . . . . . . . . . . 80.92 133.71 1.38 Allowed Glycine 0 N--CA 1.491 2.341 0 N-CA-C 109.884 -1.286 . . . . 0.35 109.884 179.845 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' C' C ' 335' ' ' ARG . . . . . . . . . . . . . 3.8 ttt180 -77.69 -35.35 52.27 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.271 -1.135 . . . . 3.23 109.402 179.81 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' C' C ' 336' ' ' GLU . . . . . . . . . . . . . 2.0 mp0 -56.93 -57.38 12.78 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.239 -0.913 . . . . 2.62 109.763 -179.85 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' C' C ' 337' ' ' ARG . . . . . 0.423 HH11 ' HG3' ' C' ' 337' ' ' ARG . 0.3 OUTLIER -59.44 -34.52 72.62 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.158 -0.964 . . . . 3.61 109.683 -179.746 . . . . . . . . 3 3 . 1 . 026 nuclear orig full ' C' C ' 338' ' ' PHE . . . . . 0.465 ' HA ' HG22 ' C' ' 332' ' ' ILE . 61.2 t80 -54.87 -55.65 28.07 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.415 -0.803 . . . . 0.43 109.747 -179.841 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' C' C ' 339' ' ' GLU . . . . . . . . . . . . . 11.4 mm-40 -50.92 -35.85 35.4 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.319 -0.863 . . . . 2.05 110.367 -179.592 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' C' C ' 340' ' ' MET . . . . . . . . . . . . . 34.6 ttp -63.33 -48.66 77.11 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.112 -0.993 . . . . 1.1 110.054 -179.343 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' C' C ' 341' ' ' PHE . . . . . . . . . . . . . 30.9 m-85 -63.23 -46.32 87.5 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.187 -0.946 . . . . 0.21 110.251 -179.351 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' C' C ' 342' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -48.89 -39.96 27.95 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.015 -1.053 . . . . 3.42 109.799 -179.663 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' C' C ' 343' ' ' GLU . . . . . . . . . . . . . 31.3 tt0 -58.41 -52.82 63.99 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.08 -1.013 . . . . 2.14 109.507 179.913 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' C' C ' 344' ' ' LEU . . . . . . . . . . . . . 86.4 mt -62.02 -25.02 67.41 Favored 'General case' 0 N--CA 1.488 1.454 0 O-C-N 121.344 -0.848 . . . . 1.09 109.23 -179.943 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' C' C ' 345' ' ' ASN . . . . . . . . . . . . . 6.9 t-20 -60.31 -61.43 2.61 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.322 -0.861 . . . . 1.38 109.341 -179.942 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' C' C ' 346' ' ' GLU . . . . . . . . . . . . . 34.5 tt0 -61.29 -23.2 65.53 Favored 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.316 -0.865 . . . . 2.21 109.487 -179.931 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' C' C ' 347' ' ' ALA . . . . . . . . . . . . . . . -63.2 -62.8 1.45 Allowed 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.308 -0.87 . . . . 1.03 109.776 -179.941 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' C' C ' 348' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -61.6 -40.77 95.99 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.333 -0.854 . . . . 1.06 109.712 -179.676 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' C' C ' 349' ' ' GLU . . . . . 0.438 ' HA ' ' OE1' ' C' ' 349' ' ' GLU . 7.8 mm-40 -57.28 -38.66 74.26 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 120.994 -1.066 . . . . 2.19 109.52 -179.825 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' C' C ' 350' ' ' LEU . . . . . 0.554 ' CD2' HD12 ' D' ' 350' ' ' LEU . 9.5 tt -63.74 -44.02 94.75 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.429 -0.794 . . . . 1.2 109.07 179.853 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' C' C ' 351' ' ' LYS . . . . . . . . . . . . . 2.6 tttt -59.46 -39.4 83.52 Favored 'General case' 0 C--N 1.301 -1.532 0 O-C-N 121.504 -0.748 . . . . 1.92 109.431 179.981 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' C' C ' 352' ' ' ASP . . . . . . . . . . . . . 24.6 m-20 -58.44 -39.9 81.1 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.316 -0.865 . . . . 1.19 109.561 -179.781 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' C' C ' 353' ' ' ALA . . . . . . . . . . . . . . . -67.27 -22.27 65.67 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.276 -0.89 . . . . 1.15 109.795 -179.657 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' C' C ' 354' ' ' GLN . . . . . . . . . . . . . 3.4 tt0 -80.85 -11.65 59.56 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.093 -1.004 . . . . 1.7 109.315 -179.977 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' C' C ' 355' ' ' ALA . . . . . . . . . . . . . . . -72.3 -3.04 21.45 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.234 -0.916 . . . . 1.3 109.454 179.464 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' C' C ' 356' ' ' GLY . . . . . . . . . . . . . . . -71.68 -81.42 0.31 Allowed Glycine 0 N--CA 1.489 2.215 0 N-CA-C 110.057 -1.217 . . . . 1.33 110.057 -179.527 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' C' C ' 357' ' ' LYS . . . . . . . . . . . . . 5.8 mttp -83.99 -173.94 5.0 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.293 -1.122 . . . . 4.39 109.503 -179.746 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' C' C ' 358' ' ' GLU . . . . . . . . . . . . . 12.5 pt-20 -48.74 146.91 4.83 Favored Pre-proline 0 N--CA 1.489 1.508 0 O-C-N 121.358 -0.839 . . . . 5.75 109.529 -179.725 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' C' C ' 359' ' ' PRO . . . . . . . . . . . . . 1.8 Cg_endo -62.5 85.05 0.11 Allowed 'Trans proline' 0 C--N 1.311 -1.4 0 C-N-CA 122.132 1.888 . . . . 5.54 110.395 -179.909 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' C' C ' 360' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.343 0 N-CA-C 109.463 -1.455 . . . . 6.5 109.463 179.86 . . . . . . . . 0 0 . 1 . 026 nuclear orig full ' D' D ' 319' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.49 1.534 0 CA-C-O 121.326 0.584 . . . . 7.93 109.774 . . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' D' D ' 320' ' ' LYS . . . . . . . . . . . . . 9.3 ttmm 59.89 84.92 0.11 Allowed 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.284 -0.885 . . . . 6.7 109.494 -179.928 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' D' D ' 321' ' ' LYS . . . . . 0.524 ' N ' ' HD3' ' D' ' 322' ' ' PRO . 0.0 OUTLIER -158.51 58.46 1.33 Allowed Pre-proline 0 N--CA 1.491 1.602 0 O-C-N 121.113 -0.992 . . . . 6.49 109.882 -179.742 . . . . . . . . 3 3 . 1 . 026 nuclear orig full ' D' D ' 322' ' ' PRO . . . . . 0.524 ' HD3' ' N ' ' D' ' 321' ' ' LYS . 3.0 Cg_exo -60.68 115.91 3.0 Favored 'Trans proline' 0 C--N 1.309 -1.528 0 C-N-CA 122.182 1.921 . . . . 3.29 110.112 179.857 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' D' D ' 323' ' ' LEU . . . . . . . . . . . . . 16.3 mt -81.46 117.74 22.14 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.24 -0.912 . . . . 3.16 109.689 -179.748 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' D' D ' 324' ' ' ASP . . . . . 0.416 ' HB2' ' OH ' ' D' ' 327' ' ' TYR . 14.9 m-20 -78.36 179.74 6.8 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.381 -0.824 . . . . 1.54 109.69 179.977 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' D' D ' 325' ' ' GLY . . . . . . . . . . . . . . . -68.85 -149.54 0.27 Allowed Glycine 0 N--CA 1.49 2.266 0 N-CA-C 109.957 -1.257 . . . . 0.65 109.957 -179.823 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' D' D ' 326' ' ' GLU . . . . . . . . . . . . . 33.9 mp0 -58.65 -168.1 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.478 0 O-C-N 121.379 -1.071 . . . . 2.13 109.642 -179.923 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' D' D ' 327' ' ' TYR . . . . . 0.416 ' OH ' ' HB2' ' D' ' 324' ' ' ASP . 41.6 m-85 -149.62 112.21 4.76 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.321 -0.862 . . . . 1.0 109.784 -179.866 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' D' D ' 328' ' ' PHE . . . . . . . . . . . . . 98.7 m-85 -113.1 -169.41 1.48 Allowed 'General case' 0 C--N 1.302 -1.498 0 O-C-N 121.315 -0.866 . . . . 0.34 109.381 -179.969 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' D' D ' 329' ' ' THR . . . . . . . . . . . . . 16.9 p -152.66 168.71 24.73 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.222 -0.924 . . . . 1.05 109.639 -179.753 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' D' D ' 330' ' ' LEU . . . . . . . . . . . . . 41.4 tp -152.1 129.28 11.18 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.283 -0.885 . . . . 1.07 109.754 -179.982 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' D' D ' 331' ' ' GLN . . . . . . . . . . . . . 1.5 tt0 -87.55 115.31 24.89 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.112 -0.992 . . . . 0.93 109.291 179.654 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' D' D ' 332' ' ' ILE . . . . . . . . . . . . . 39.3 mt -103.2 102.92 14.33 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.562 0 O-C-N 121.165 -0.959 . . . . 1.07 109.739 -179.886 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' D' D ' 333' ' ' ARG . . . . . . . . . . . . . 49.3 mtt180 -71.84 141.88 49.61 Favored 'General case' 0 N--CA 1.487 1.403 0 O-C-N 121.372 -0.83 . . . . 3.42 109.189 179.626 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' D' D ' 334' ' ' GLY . . . . . . . . . . . . . . . 90.87 125.04 3.08 Favored Glycine 0 N--CA 1.492 2.377 0 N-CA-C 109.376 -1.49 . . . . 0.41 109.376 -179.931 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' D' D ' 335' ' ' ARG . . . . . 0.449 ' HA ' ' CE2' ' B' ' 328' ' ' PHE . 18.5 ttt180 -76.64 -40.64 48.57 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.158 -1.201 . . . . 3.58 109.734 -179.971 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' D' D ' 336' ' ' GLU . . . . . . . . . . . . . 24.1 tt0 -57.86 -58.58 7.76 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.269 -0.895 . . . . 2.26 109.785 -179.771 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' D' D ' 337' ' ' ARG . . . . . 0.46 ' NH1' ' CG ' ' D' ' 337' ' ' ARG . 0.0 OUTLIER -61.45 -32.33 72.31 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.072 -1.017 . . . . 3.64 109.581 -179.669 . . . . . . . . 3 3 . 1 . 026 nuclear orig full ' D' D ' 338' ' ' PHE . . . . . . . . . . . . . 52.7 t80 -55.6 -53.24 58.91 Favored 'General case' 0 N--CA 1.489 1.492 0 O-C-N 121.304 -0.872 . . . . 0.4 109.527 179.926 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' D' D ' 339' ' ' GLU . . . . . . . . . . . . . 28.7 mt-10 -50.91 -32.3 20.22 Favored 'General case' 0 N--CA 1.494 1.762 0 O-C-N 121.308 -0.87 . . . . 1.99 110.109 -179.806 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' D' D ' 340' ' ' MET . . . . . . . . . . . . . 20.7 ttp -63.7 -51.28 65.75 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.069 -1.019 . . . . 1.13 109.642 -179.626 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' D' D ' 341' ' ' PHE . . . . . . . . . . . . . 34.9 m-85 -62.48 -41.59 98.89 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.11 -0.994 . . . . 0.21 109.937 -179.656 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' D' D ' 342' ' ' ARG . . . . . . . . . . . . . 6.4 tpt180 -49.27 -43.51 43.09 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.162 -0.961 . . . . 3.15 109.819 -179.793 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' D' D ' 343' ' ' GLU . . . . . . . . . . . . . 1.3 tt0 -59.26 -47.3 85.87 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.293 -0.879 . . . . 2.35 109.679 -179.766 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' D' D ' 344' ' ' LEU . . . . . 0.427 ' O ' HD21 ' D' ' 348' ' ' LEU . 48.3 mt -61.42 -30.22 70.43 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.241 -0.912 . . . . 1.06 109.354 -179.89 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' D' D ' 345' ' ' ASN . . . . . . . . . . . . . 11.8 t-20 -58.67 -59.18 5.81 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.186 -0.946 . . . . 1.35 109.981 -179.979 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' D' D ' 346' ' ' GLU . . . . . . . . . . . . . 19.1 tt0 -60.87 -27.81 68.39 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.228 -0.92 . . . . 1.69 109.927 -179.542 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' D' D ' 347' ' ' ALA . . . . . . . . . . . . . . . -61.09 -61.49 2.53 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.082 -1.011 . . . . 1.03 110.111 -179.705 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' D' D ' 348' ' ' LEU . . . . . 0.444 ' N ' HD23 ' D' ' 348' ' ' LEU . 3.8 mm? -62.1 -45.89 91.49 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.368 -0.832 . . . . 1.04 110.239 -179.441 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' D' D ' 349' ' ' GLU . . . . . . . . . . . . . 3.8 mt-10 -57.6 -33.19 67.94 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.186 -0.946 . . . . 1.95 109.784 -179.299 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' D' D ' 350' ' ' LEU . . . . . 0.554 HD12 ' CD2' ' C' ' 350' ' ' LEU . 7.7 tt -65.01 -43.88 91.03 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.302 -0.874 . . . . 1.16 109.531 -179.98 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' D' D ' 351' ' ' LYS . . . . . . . . . . . . . 16.7 tttt -59.5 -50.16 74.98 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.502 -0.749 . . . . 1.97 109.543 -179.783 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' D' D ' 352' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 -56.62 -32.37 65.24 Favored 'General case' 0 N--CA 1.488 1.458 0 O-C-N 121.293 -0.879 . . . . 1.17 109.767 -179.799 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' D' D ' 353' ' ' ALA . . . . . . . . . . . . . . . -66.51 -32.31 73.58 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.296 -0.878 . . . . 1.21 109.929 -179.732 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' D' D ' 354' ' ' GLN . . . . . . . . . . . . . 19.9 mt-30 -83.54 -9.68 58.79 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.1 -1.0 . . . . 1.68 109.687 -179.702 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' D' D ' 355' ' ' ALA . . . . . . . . . . . . . . . -74.07 -3.19 27.93 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.253 -0.905 . . . . 1.29 110.321 -179.783 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' D' D ' 356' ' ' GLY . . . . . . . . . . . . . . . -80.66 -31.33 36.85 Favored Glycine 0 N--CA 1.492 2.402 0 N-CA-C 109.934 -1.266 . . . . 1.28 109.934 -179.44 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' D' D ' 357' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -88.15 149.3 23.98 Favored 'General case' 0 C--N 1.302 -1.458 0 O-C-N 121.186 -1.185 . . . . 4.45 109.498 -179.963 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' D' D ' 358' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -49.28 116.02 5.33 Favored Pre-proline 0 N--CA 1.489 1.502 0 O-C-N 121.292 -0.88 . . . . 5.71 109.392 -179.917 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' D' D ' 359' ' ' PRO . . . . . . . . . . . . . 4.5 Cg_exo -59.06 131.8 43.58 Favored 'Trans proline' 0 C--N 1.315 -1.202 0 C-N-CA 121.998 1.798 . . . . 5.6 110.395 -179.614 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' D' D ' 360' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.328 0 CA-C-O 117.968 -1.462 . . . . 6.97 109.592 179.99 . . . . . . . . 0 0 . 1 . 027 nuclear orig full ' A' A ' 319' ' ' LYS . . . . . . . . . . . . . 13.6 mttt . . . . . 0 N--CA 1.49 1.557 0 N-CA-C 109.606 -0.516 . . . . 7.95 109.606 . . . . . . . . . 0 0 . 1 . 027 nuclear orig full ' A' A ' 320' ' ' LYS . . . . . 0.482 ' O ' ' HD3' ' A' ' 322' ' ' PRO . 11.4 mttt 59.85 -129.73 1.04 Allowed 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.085 -1.009 . . . . 6.71 109.145 179.988 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 321' ' ' LYS . . . . . . . . . . . . . 32.1 mttt -80.62 113.59 41.06 Favored Pre-proline 0 N--CA 1.491 1.616 0 O-C-N 120.886 -1.134 . . . . 6.5 109.34 179.932 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 322' ' ' PRO . . . . . 0.482 ' HD3' ' O ' ' A' ' 320' ' ' LYS . 1.0 OUTLIER -66.45 127.74 17.9 Favored 'Trans proline' 0 C--N 1.315 -1.193 0 C-N-CA 122.004 1.803 . . . . 3.3 109.848 -179.57 . . . . . . . . 3 3 . 1 . 027 nuclear orig full ' A' A ' 323' ' ' LEU . . . . . . . . . . . . . 95.5 mt -80.43 90.69 5.65 Favored 'General case' 0 C--N 1.303 -1.456 0 O-C-N 121.136 -0.978 . . . . 3.16 109.583 -179.816 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 324' ' ' ASP . . . . . . . . . . . . . 37.3 m-20 -82.16 102.41 11.07 Favored 'General case' 0 N--CA 1.489 1.484 0 O-C-N 121.228 -0.92 . . . . 1.53 109.369 179.759 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 325' ' ' GLY . . . . . 0.583 ' O ' ' CD2' ' A' ' 327' ' ' TYR . . . -68.97 -167.29 4.89 Favored Glycine 0 N--CA 1.489 2.21 0 N-CA-C 109.246 -1.542 . . . . 0.67 109.246 179.859 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 326' ' ' GLU . . . . . . . . . . . . . 5.7 mm-40 -59.42 159.44 8.07 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.217 -1.166 . . . . 2.13 109.242 179.785 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 327' ' ' TYR . . . . . 0.583 ' CD2' ' O ' ' A' ' 325' ' ' GLY . 41.0 m-85 -148.76 108.07 3.94 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.25 -0.906 . . . . 1.0 109.849 -179.909 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 328' ' ' PHE . . . . . 0.476 ' CE2' ' HA ' ' C' ' 335' ' ' ARG . 46.7 m-85 -113.35 -166.45 1.09 Allowed 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.214 -0.929 . . . . 0.34 109.297 179.691 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 329' ' ' THR . . . . . . . . . . . . . 20.2 p -152.75 171.29 18.46 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.131 -0.98 . . . . 1.05 109.238 179.729 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 330' ' ' LEU . . . . . 0.431 HD23 ' HB2' ' C' ' 345' ' ' ASN . 35.0 tp -151.47 130.29 12.43 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.109 -0.995 . . . . 1.07 109.815 -179.799 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 331' ' ' GLN . . . . . . . . . . . . . 13.4 tp60 -88.22 109.12 19.67 Favored 'General case' 0 N--CA 1.488 1.471 0 O-C-N 121.446 -0.784 . . . . 0.91 108.938 179.463 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 332' ' ' ILE . . . . . . . . . . . . . 30.6 mt -103.21 106.68 20.55 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.6 0 O-C-N 120.965 -1.084 . . . . 1.09 109.641 -179.814 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 333' ' ' ARG . . . . . 0.47 ' HG2' ' CE1' ' C' ' 327' ' ' TYR . 61.8 mtt180 -72.81 148.67 44.29 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.205 -0.935 . . . . 3.41 109.585 179.873 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 334' ' ' GLY . . . . . . . . . . . . . . . 83.27 129.52 1.5 Allowed Glycine 0 N--CA 1.492 2.377 0 N-CA-C 109.648 -1.381 . . . . 0.4 109.648 179.734 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 335' ' ' ARG . . . . . . . . . . . . . 15.2 ttt180 -79.76 -32.8 41.03 Favored 'General case' 0 N--CA 1.489 1.476 0 O-C-N 121.27 -1.135 . . . . 3.55 109.486 179.774 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 336' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -56.87 -62.87 1.44 Allowed 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.359 -0.838 . . . . 2.29 109.415 -179.812 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 337' ' ' ARG . . . . . . . . . . . . . 1.4 mmt180 -60.92 -29.89 69.87 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.323 -0.861 . . . . 3.64 109.638 179.974 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 338' ' ' PHE . . . . . . . . . . . . . 72.0 t80 -54.72 -57.75 10.27 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.344 -0.848 . . . . 0.41 109.759 -179.881 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 339' ' ' GLU . . . . . . . . . . . . . 50.7 mt-10 -52.11 -36.18 50.26 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.087 -1.008 . . . . 1.97 109.958 -179.869 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 340' ' ' MET . . . . . . . . . . . . . 41.5 ttp -63.44 -46.39 86.54 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.137 -0.977 . . . . 1.14 109.888 -179.647 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 341' ' ' PHE . . . . . . . . . . . . . 39.9 m-85 -62.79 -46.25 88.86 Favored 'General case' 0 N--CA 1.494 1.74 0 O-C-N 121.106 -0.997 . . . . 0.21 110.076 -179.734 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 342' ' ' ARG . . . . . . . . . . . . . 22.3 ttt180 -49.38 -44.12 44.66 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.219 -0.926 . . . . 3.15 110.296 -179.414 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 343' ' ' GLU . . . . . . . . . . . . . 1.8 tp10 -57.33 -45.34 84.38 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.115 -0.991 . . . . 2.35 110.005 -179.735 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 344' ' ' LEU . . . . . 0.472 HD21 ' CD2' ' B' ' 344' ' ' LEU . 69.6 mt -62.59 -41.5 99.0 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.17 -0.956 . . . . 1.06 110.034 -179.558 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 345' ' ' ASN . . . . . . . . . . . . . 62.9 t-20 -56.95 -49.78 74.64 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.244 -0.91 . . . . 1.36 109.665 -179.737 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 346' ' ' GLU . . . . . . . . . . . . . 4.5 tp10 -62.72 -34.41 77.11 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.167 -0.958 . . . . 1.65 110.14 -179.788 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 347' ' ' ALA . . . . . . . . . . . . . . . -59.26 -55.44 34.83 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.083 -1.01 . . . . 1.03 109.956 -179.602 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 348' ' ' LEU . . . . . 0.408 HD23 ' N ' ' A' ' 348' ' ' LEU . 3.9 mm? -61.19 -44.62 97.01 Favored 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.345 -0.847 . . . . 1.04 109.871 -179.552 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 349' ' ' GLU . . . . . . . . . . . . . 2.5 mt-10 -57.4 -33.46 67.87 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.359 -0.838 . . . . 1.94 109.93 -179.364 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 350' ' ' LEU . . . . . 0.454 ' O ' HD22 ' A' ' 350' ' ' LEU . 4.8 tt -63.29 -46.27 87.51 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.175 -0.953 . . . . 1.17 109.299 -179.604 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 351' ' ' LYS . . . . . . . . . . . . . 42.8 tttt -59.58 -37.61 78.97 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.42 -0.8 . . . . 1.97 109.312 179.946 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 352' ' ' ASP . . . . . . . . . . . . . 3.5 m-20 -57.43 -43.6 84.0 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.34 -0.85 . . . . 1.16 109.698 179.837 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 353' ' ' ALA . . . . . . . . . . . . . . . -67.65 -18.69 65.04 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.183 -0.948 . . . . 1.22 109.936 -179.357 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 354' ' ' GLN . . . . . . . . . . . . . 5.7 tt0 -82.6 -11.91 58.07 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.086 -1.009 . . . . 1.71 109.445 -179.887 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 355' ' ' ALA . . . . . . . . . . . . . . . -73.06 -2.01 19.58 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.339 -0.85 . . . . 1.3 109.594 179.758 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 356' ' ' GLY . . . . . . . . . . . . . . . -77.84 -5.49 86.61 Favored Glycine 0 N--CA 1.489 2.169 0 N-CA-C 109.733 -1.347 . . . . 1.3 109.733 -179.743 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 357' ' ' LYS . . . . . . . . . . . . . 23.9 mttt -87.59 143.87 26.97 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.184 -1.186 . . . . 4.46 109.125 179.647 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 358' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -48.65 164.66 0.27 Allowed Pre-proline 0 N--CA 1.49 1.559 0 O-C-N 121.236 -0.915 . . . . 5.75 109.417 -179.895 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 359' ' ' PRO . . . . . . . . . . . . . 1.9 Cg_endo -62.53 134.44 47.86 Favored 'Trans proline' 0 C--N 1.309 -1.535 0 C-N-CA 122.285 1.99 . . . . 5.63 110.226 179.916 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 360' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.488 2.159 0 CA-C-O 117.999 -1.445 . . . . 6.97 109.602 179.782 . . . . . . . . 0 0 . 1 . 027 nuclear orig full ' B' B ' 319' ' ' LYS . . . . . . . . . . . . . 13.2 mttt . . . . . 0 N--CA 1.49 1.541 0 N-CA-C 109.423 -0.584 . . . . 7.95 109.423 . . . . . . . . . 0 0 . 1 . 027 nuclear orig full ' B' B ' 320' ' ' LYS . . . . . 0.495 ' O ' ' HD3' ' B' ' 322' ' ' PRO . 10.4 mttt 60.28 -130.01 0.95 Allowed 'General case' 0 N--CA 1.489 1.478 0 O-C-N 121.152 -0.968 . . . . 6.73 108.981 -179.57 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' B' B ' 321' ' ' LYS . . . . . . . . . . . . . 27.4 mttt -80.18 113.75 41.24 Favored Pre-proline 0 N--CA 1.488 1.472 0 O-C-N 120.935 -1.103 . . . . 6.5 109.498 -179.931 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' B' B ' 322' ' ' PRO . . . . . 0.495 ' HD3' ' O ' ' B' ' 320' ' ' LYS . 1.2 Cg_endo -66.52 127.26 16.92 Favored 'Trans proline' 0 C--N 1.315 -1.23 0 C-N-CA 122.1 1.866 . . . . 3.29 110.016 -179.845 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' B' B ' 323' ' ' LEU . . . . . . . . . . . . . 92.7 mt -80.33 90.63 5.58 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.159 -0.963 . . . . 3.18 109.528 -179.817 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' B' B ' 324' ' ' ASP . . . . . . . . . . . . . 39.9 m-20 -82.31 103.18 11.71 Favored 'General case' 0 N--CA 1.488 1.459 0 O-C-N 121.228 -0.92 . . . . 1.53 109.294 179.603 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' B' B ' 325' ' ' GLY . . . . . 0.591 ' O ' ' CD2' ' B' ' 327' ' ' TYR . . . -69.31 -166.99 5.13 Favored Glycine 0 N--CA 1.491 2.328 0 N-CA-C 109.295 -1.522 . . . . 0.65 109.295 179.976 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' B' B ' 326' ' ' GLU . . . . . . . . . . . . . 5.4 mm-40 -59.13 160.04 6.72 Favored 'General case' 0 C--N 1.304 -1.401 0 O-C-N 121.062 -1.258 . . . . 2.13 109.209 179.833 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' B' B ' 327' ' ' TYR . . . . . 0.591 ' CD2' ' O ' ' B' ' 325' ' ' GLY . 40.0 m-85 -149.36 107.22 3.69 Favored 'General case' 0 C--N 1.303 -1.421 0 O-C-N 121.183 -0.948 . . . . 0.99 109.824 -179.983 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' B' B ' 328' ' ' PHE . . . . . . . . . . . . . 45.3 m-85 -113.03 -166.13 1.05 Allowed 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.213 -0.929 . . . . 0.36 109.12 179.8 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' B' B ' 329' ' ' THR . . . . . . . . . . . . . 22.4 p -153.33 170.63 20.17 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.321 -0.862 . . . . 1.05 109.197 -179.934 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' B' B ' 330' ' ' LEU . . . . . . . . . . . . . 33.4 tp -150.64 130.64 13.42 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.22 -0.925 . . . . 1.07 110.023 -179.804 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' B' B ' 331' ' ' GLN . . . . . . . . . . . . . 12.6 tp60 -88.49 108.87 19.62 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.335 -0.853 . . . . 0.91 108.934 179.415 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' B' B ' 332' ' ' ILE . . . . . . . . . . . . . 30.4 mt -103.08 106.75 20.65 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.546 0 O-C-N 121.171 -0.955 . . . . 1.08 109.651 -179.621 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' B' B ' 333' ' ' ARG . . . . . 0.418 ' HG2' ' CE1' ' D' ' 327' ' ' TYR . 62.2 mtt180 -72.89 148.81 44.03 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.361 -0.837 . . . . 3.42 109.632 179.911 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' B' B ' 334' ' ' GLY . . . . . . . . . . . . . . . 83.16 129.9 1.52 Allowed Glycine 0 N--CA 1.49 2.281 0 N-CA-C 109.569 -1.412 . . . . 0.4 109.569 179.585 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' B' B ' 335' ' ' ARG . . . . . . . . . . . . . 16.7 ttt180 -79.88 -32.81 40.37 Favored 'General case' 0 N--CA 1.489 1.5 0 O-C-N 121.351 -1.087 . . . . 3.55 109.425 179.929 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' B' B ' 336' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -57.22 -62.42 1.78 Allowed 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.063 -1.023 . . . . 2.28 109.677 -179.853 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' B' B ' 337' ' ' ARG . . . . . . . . . . . . . 1.1 mmt180 -61.11 -30.61 70.46 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.223 -0.923 . . . . 3.64 109.625 -179.907 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' B' B ' 338' ' ' PHE . . . . . . . . . . . . . 69.0 t80 -54.4 -56.8 15.0 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.315 -0.865 . . . . 0.39 109.731 -179.82 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' B' B ' 339' ' ' GLU . . . . . . . . . . . . . 51.7 mt-10 -52.86 -35.59 57.79 Favored 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.24 -0.912 . . . . 1.98 109.824 -179.692 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' B' B ' 340' ' ' MET . . . . . . . . . . . . . 42.1 ttp -63.87 -46.46 84.82 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.211 -0.931 . . . . 1.14 109.874 -179.678 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' B' B ' 341' ' ' PHE . . . . . . . . . . . . . 39.6 m-85 -62.73 -46.12 89.58 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.212 -0.93 . . . . 0.22 110.055 -179.57 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' B' B ' 342' ' ' ARG . . . . . . . . . . . . . 23.0 ttt180 -48.98 -43.93 40.56 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.302 -0.874 . . . . 3.15 110.318 -179.584 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' B' B ' 343' ' ' GLU . . . . . . . . . . . . . 1.9 tp10 -58.14 -45.0 88.12 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.224 -0.922 . . . . 2.35 109.934 -179.309 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' B' B ' 344' ' ' LEU . . . . . 0.472 ' CD2' HD21 ' A' ' 344' ' ' LEU . 70.6 mt -62.68 -42.26 99.53 Favored 'General case' 0 N--CA 1.488 1.459 0 O-C-N 121.18 -0.95 . . . . 1.05 109.808 -179.693 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' B' B ' 345' ' ' ASN . . . . . . . . . . . . . 63.2 t-20 -55.9 -49.97 71.96 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.197 -0.939 . . . . 1.35 109.786 -179.804 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' B' B ' 346' ' ' GLU . . . . . . . . . . . . . 4.3 tp10 -62.98 -34.65 78.0 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.261 -0.899 . . . . 1.66 109.909 -179.584 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' B' B ' 347' ' ' ALA . . . . . . . . . . . . . . . -58.99 -55.79 30.57 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.072 -1.018 . . . . 1.02 110.047 -179.587 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' B' B ' 348' ' ' LEU . . . . . 0.436 ' N ' HD23 ' B' ' 348' ' ' LEU . 3.9 mm? -60.86 -45.05 96.06 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.213 -0.93 . . . . 1.05 109.804 -179.709 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' B' B ' 349' ' ' GLU . . . . . . . . . . . . . 2.6 mt-10 -57.21 -32.84 66.91 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.442 -0.786 . . . . 1.95 110.06 -179.509 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' B' B ' 350' ' ' LEU . . . . . 0.451 HD23 HD23 ' A' ' 350' ' ' LEU . 4.8 tt -63.82 -46.7 83.91 Favored 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.091 -1.006 . . . . 1.18 109.399 -179.685 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' B' B ' 351' ' ' LYS . . . . . . . . . . . . . 42.6 tttt -59.19 -37.15 76.69 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.299 -0.876 . . . . 1.96 109.294 179.716 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' B' B ' 352' ' ' ASP . . . . . . . . . . . . . 2.3 m-20 -57.84 -43.46 85.86 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.336 -0.853 . . . . 1.16 109.873 -179.979 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' B' B ' 353' ' ' ALA . . . . . . . . . . . . . . . -67.42 -19.4 65.37 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.313 -0.867 . . . . 1.21 109.834 -179.722 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' B' B ' 354' ' ' GLN . . . . . . . . . . . . . 5.7 tt0 -82.09 -12.39 58.25 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.037 -1.039 . . . . 1.69 109.534 -179.713 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' B' B ' 355' ' ' ALA . . . . . . . . . . . . . . . -72.45 -1.8 17.08 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.308 -0.87 . . . . 1.3 109.683 179.733 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' B' B ' 356' ' ' GLY . . . . . . . . . . . . . . . -78.07 -5.92 87.27 Favored Glycine 0 N--CA 1.491 2.355 0 N-CA-C 109.905 -1.278 . . . . 1.29 109.905 -179.528 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' B' B ' 357' ' ' LYS . . . . . . . . . . . . . 23.2 mttt -87.14 143.17 27.42 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.161 -1.199 . . . . 4.45 109.317 179.614 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' B' B ' 358' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -48.13 164.78 0.25 Allowed Pre-proline 0 N--CA 1.491 1.605 0 O-C-N 121.203 -0.936 . . . . 5.72 109.69 -179.83 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' B' B ' 359' ' ' PRO . . . . . . . . . . . . . 1.8 Cg_endo -62.54 134.8 49.64 Favored 'Trans proline' 0 C--N 1.309 -1.511 0 C-N-CA 121.969 1.779 . . . . 5.6 110.039 179.847 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' B' B ' 360' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.355 0 N-CA-C 109.409 -1.476 . . . . 6.98 109.409 -179.95 . . . . . . . . 0 0 . 1 . 027 nuclear orig full ' C' C ' 319' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.49 1.541 0 N-CA-C 109.475 -0.565 . . . . 7.03 109.475 . . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' C' C ' 320' ' ' LYS . . . . . 0.463 ' O ' ' HG2' ' C' ' 321' ' ' LYS . 2.1 tttm 57.59 85.28 0.09 Allowed 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.249 -0.907 . . . . 6.84 109.347 179.914 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' C' C ' 321' ' ' LYS . . . . . 0.463 ' HG2' ' O ' ' C' ' 320' ' ' LYS . 1.1 mttt -155.13 108.45 2.27 Favored Pre-proline 0 N--CA 1.488 1.463 0 O-C-N 121.364 -0.835 . . . . 6.78 108.949 179.991 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' C' C ' 322' ' ' PRO . . . . . . . . . . . . . 3.1 Cg_exo -60.46 -166.19 0.04 OUTLIER 'Trans proline' 0 C--N 1.311 -1.446 0 C-N-CA 121.894 1.729 . . . . 3.98 110.19 -179.557 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' C' C ' 323' ' ' LEU . . . . . . . . . . . . . 85.1 mt -80.93 110.37 16.4 Favored 'General case' 0 C--N 1.303 -1.431 0 O-C-N 121.267 -0.896 . . . . 4.31 109.534 -179.897 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' C' C ' 324' ' ' ASP . . . . . . . . . . . . . 73.9 m-20 -79.35 111.42 15.58 Favored 'General case' 0 N--CA 1.487 1.398 0 O-C-N 121.114 -0.991 . . . . 1.63 108.673 179.389 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' C' C ' 325' ' ' GLY . . . . . 0.528 ' O ' ' CD2' ' C' ' 327' ' ' TYR . . . -67.04 179.91 12.93 Favored Glycine 0 N--CA 1.491 2.334 0 N-CA-C 109.102 -1.599 . . . . 0.82 109.102 -179.679 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' C' C ' 326' ' ' GLU . . . . . . . . . . . . . 1.8 mt-10 -56.25 174.73 0.12 Allowed 'General case' 0 N--CA 1.488 1.444 0 O-C-N 121.246 -1.149 . . . . 2.17 109.066 179.789 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' C' C ' 327' ' ' TYR . . . . . 0.528 ' CD2' ' O ' ' C' ' 325' ' ' GLY . 39.9 m-85 -150.81 108.37 3.65 Favored 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.139 -0.976 . . . . 1.03 109.86 -179.99 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' C' C ' 328' ' ' PHE . . . . . . . . . . . . . 98.4 m-85 -113.79 -166.97 1.14 Allowed 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.149 -0.97 . . . . 0.37 109.453 179.731 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' C' C ' 329' ' ' THR . . . . . 0.412 ' HA ' ' O ' ' A' ' 330' ' ' LEU . 6.7 p -152.03 172.41 16.34 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.107 -0.996 . . . . 1.04 109.595 -179.929 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' C' C ' 330' ' ' LEU . . . . . . . . . . . . . 31.1 tp -151.69 130.14 12.15 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.137 -0.977 . . . . 1.09 109.757 -179.609 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' C' C ' 331' ' ' GLN . . . . . . . . . . . . . 2.4 tp60 -86.85 109.85 19.58 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.208 -0.933 . . . . 1.48 109.355 179.8 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' C' C ' 332' ' ' ILE . . . . . 0.512 HD12 ' CB ' ' C' ' 341' ' ' PHE . 70.1 mt -103.16 106.04 19.37 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.518 0 O-C-N 121.185 -0.947 . . . . 1.08 109.945 -179.616 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' C' C ' 333' ' ' ARG . . . . . 0.561 ' HG3' ' CE1' ' A' ' 327' ' ' TYR . 0.0 OUTLIER -72.27 151.61 42.69 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.381 -0.825 . . . . 3.36 109.174 179.588 . . . . . . . . 3 3 . 1 . 027 nuclear orig full ' C' C ' 334' ' ' GLY . . . . . . . . . . . . . . . 80.19 129.92 0.84 Allowed Glycine 0 N--CA 1.49 2.237 0 N-CA-C 109.434 -1.466 . . . . 0.35 109.434 -179.91 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' C' C ' 335' ' ' ARG . . . . . 0.476 ' HA ' ' CE2' ' A' ' 328' ' ' PHE . 10.1 ttp180 -79.18 -35.8 41.28 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.246 -1.15 . . . . 3.23 109.876 -179.678 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' C' C ' 336' ' ' GLU . . . . . . . . . . . . . 89.4 mt-10 -58.6 -63.01 1.44 Allowed 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.201 -0.937 . . . . 2.62 109.921 -179.697 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' C' C ' 337' ' ' ARG . . . . . 0.46 ' NH1' ' CG ' ' C' ' 337' ' ' ARG . 0.3 OUTLIER -59.16 -31.06 68.63 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.126 -0.983 . . . . 3.61 109.278 179.966 . . . . . . . . 3 3 . 1 . 027 nuclear orig full ' C' C ' 338' ' ' PHE . . . . . 0.461 ' HB3' ' O ' ' C' ' 335' ' ' ARG . 66.8 t80 -52.95 -58.58 6.48 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.272 -0.892 . . . . 0.43 109.071 179.57 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' C' C ' 339' ' ' GLU . . . . . . . . . . . . . 2.7 mm-40 -51.55 -31.29 23.84 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.341 -0.849 . . . . 2.05 109.741 179.713 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' C' C ' 340' ' ' MET . . . . . . . . . . . . . 29.5 ttp -63.74 -53.14 55.66 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.153 -0.967 . . . . 1.1 109.681 -179.811 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' C' C ' 341' ' ' PHE . . . . . 0.512 ' CB ' HD12 ' C' ' 332' ' ' ILE . 46.0 m-85 -60.58 -38.1 83.51 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.345 -0.847 . . . . 0.21 109.413 -179.989 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' C' C ' 342' ' ' ARG . . . . . . . . . . . . . 11.7 ttp180 -51.71 -53.14 42.54 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.449 -0.782 . . . . 3.42 110.283 -179.683 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' C' C ' 343' ' ' GLU . . . . . . . . . . . . . 15.9 tp10 -55.73 -42.16 74.93 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.199 -0.938 . . . . 2.14 110.26 -179.135 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' C' C ' 344' ' ' LEU . . . . . 0.471 ' O ' HD21 ' C' ' 348' ' ' LEU . 57.7 mt -61.83 -40.85 96.74 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.117 -0.99 . . . . 1.09 109.503 -179.706 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' C' C ' 345' ' ' ASN . . . . . 0.431 ' HB2' HD23 ' A' ' 330' ' ' LEU . 46.8 t-20 -57.6 -51.08 70.97 Favored 'General case' 0 C--N 1.303 -1.451 0 O-C-N 121.441 -0.787 . . . . 1.38 109.331 179.803 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' C' C ' 346' ' ' GLU . . . . . . . . . . . . . 3.6 tm-20 -61.75 -32.4 72.65 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.376 -0.828 . . . . 2.21 109.751 -179.993 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' C' C ' 347' ' ' ALA . . . . . . . . . . . . . . . -62.79 -52.85 61.56 Favored 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.249 -0.907 . . . . 1.03 109.821 -179.846 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' C' C ' 348' ' ' LEU . . . . . 0.506 HD23 ' N ' ' C' ' 348' ' ' LEU . 4.2 mm? -61.13 -48.89 79.54 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.284 -0.885 . . . . 1.06 109.644 -179.544 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' C' C ' 349' ' ' GLU . . . . . . . . . . . . . 61.1 mt-10 -58.71 -31.21 68.06 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.293 -0.88 . . . . 2.19 109.754 -179.797 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' C' C ' 350' ' ' LEU . . . . . 0.599 ' CD2' ' CD1' ' D' ' 350' ' ' LEU . 10.2 tt -63.37 -40.72 98.02 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.218 -0.926 . . . . 1.2 109.109 179.838 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' C' C ' 351' ' ' LYS . . . . . . . . . . . . . 36.1 tttm -61.4 -43.22 99.25 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.362 -0.836 . . . . 1.92 109.483 179.869 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' C' C ' 352' ' ' ASP . . . . . . . . . . . . . 4.4 m-20 -56.23 -49.04 75.27 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.246 -0.909 . . . . 1.19 109.551 -179.957 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' C' C ' 353' ' ' ALA . . . . . . . . . . . . . . . -68.25 -17.57 64.33 Favored 'General case' 0 N--CA 1.488 1.471 0 O-C-N 121.312 -0.868 . . . . 1.15 109.363 -179.886 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' C' C ' 354' ' ' GLN . . . . . 0.485 ' NE2' ' CD1' ' D' ' 350' ' ' LEU . 0.0 OUTLIER -83.77 -14.74 50.77 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.331 -0.856 . . . . 1.7 109.082 179.853 . . . . . . . . 3 3 . 1 . 027 nuclear orig full ' C' C ' 355' ' ' ALA . . . . . . . . . . . . . . . -73.46 -4.51 34.14 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.409 -0.807 . . . . 1.3 110.037 -179.925 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' C' C ' 356' ' ' GLY . . . . . . . . . . . . . . . -77.29 -3.61 82.43 Favored Glycine 0 N--CA 1.49 2.293 0 N-CA-C 109.744 -1.342 . . . . 1.33 109.744 -179.62 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' C' C ' 357' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -86.91 134.19 33.54 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.266 -1.138 . . . . 4.39 109.322 179.881 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' C' C ' 358' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -47.81 137.55 10.11 Favored Pre-proline 0 C--N 1.303 -1.416 0 O-C-N 121.254 -0.904 . . . . 5.75 109.553 -179.841 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' C' C ' 359' ' ' PRO . . . . . . . . . . . . . 1.4 Cg_endo -65.33 98.93 0.34 Allowed 'Trans proline' 0 C--N 1.312 -1.369 0 C-N-CA 122.15 1.9 . . . . 5.54 109.888 179.548 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' C' C ' 360' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.312 0 N-CA-C 109.313 -1.515 . . . . 6.5 109.313 -179.942 . . . . . . . . 0 0 . 1 . 027 nuclear orig full ' D' D ' 319' ' ' LYS . . . . . 0.404 ' O ' ' HB2' ' D' ' 320' ' ' LYS . 13.8 mttt . . . . . 0 N--CA 1.488 1.46 0 N-CA-C 109.419 -0.586 . . . . 7.93 109.419 . . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' D' D ' 320' ' ' LYS . . . . . 0.498 ' O ' ' HD3' ' D' ' 322' ' ' PRO . 10.2 mttt 60.28 -128.72 1.0 Allowed 'General case' 0 N--CA 1.491 1.598 0 O-C-N 120.988 -1.07 . . . . 6.7 109.284 179.783 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' D' D ' 321' ' ' LYS . . . . . . . . . . . . . 22.3 mttt -81.22 113.77 43.88 Favored Pre-proline 0 N--CA 1.492 1.626 0 O-C-N 120.843 -1.161 . . . . 6.49 109.462 179.987 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' D' D ' 322' ' ' PRO . . . . . 0.498 ' HD3' ' O ' ' D' ' 320' ' ' LYS . 0.9 OUTLIER -66.64 128.27 18.74 Favored 'Trans proline' 0 C--N 1.311 -1.405 0 C-N-CA 121.931 1.754 . . . . 3.29 109.985 179.98 . . . . . . . . 3 3 . 1 . 027 nuclear orig full ' D' D ' 323' ' ' LEU . . . . . . . . . . . . . 90.7 mt -81.12 91.15 6.09 Favored 'General case' 0 C--N 1.303 -1.454 0 O-C-N 121.223 -0.923 . . . . 3.16 109.472 -179.892 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' D' D ' 324' ' ' ASP . . . . . . . . . . . . . 44.8 m-20 -82.62 103.46 12.16 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.203 -0.936 . . . . 1.54 109.037 179.701 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' D' D ' 325' ' ' GLY . . . . . 0.573 ' O ' ' CD2' ' D' ' 327' ' ' TYR . . . -69.24 -166.22 4.67 Favored Glycine 0 N--CA 1.489 2.18 0 N-CA-C 109.242 -1.543 . . . . 0.65 109.242 -179.947 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' D' D ' 326' ' ' GLU . . . . . . . . . . . . . 5.6 mm-40 -59.83 160.22 7.91 Favored 'General case' 0 N--CA 1.489 1.476 0 O-C-N 121.171 -1.193 . . . . 2.13 109.039 179.664 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' D' D ' 327' ' ' TYR . . . . . 0.573 ' CD2' ' O ' ' D' ' 325' ' ' GLY . 41.2 m-85 -149.54 107.25 3.67 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.106 -0.996 . . . . 1.0 109.75 -179.899 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' D' D ' 328' ' ' PHE . . . . . . . . . . . . . 45.9 m-85 -112.99 -166.06 1.05 Allowed 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.336 -0.852 . . . . 0.34 109.458 179.708 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' D' D ' 329' ' ' THR . . . . . . . . . . . . . 30.8 p -153.07 170.46 20.41 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.167 -0.958 . . . . 1.05 109.348 179.879 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' D' D ' 330' ' ' LEU . . . . . . . . . . . . . 32.4 tp -150.46 130.41 13.4 Favored 'General case' 0 C--N 1.304 -1.41 0 O-C-N 121.125 -0.984 . . . . 1.07 109.911 -179.973 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' D' D ' 331' ' ' GLN . . . . . . . . . . . . . 11.0 tp60 -88.41 108.56 19.43 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.427 -0.795 . . . . 0.93 108.961 179.526 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' D' D ' 332' ' ' ILE . . . . . . . . . . . . . 25.3 mt -103.0 106.41 20.01 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.617 0 O-C-N 121.045 -1.034 . . . . 1.07 109.831 -179.632 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' D' D ' 333' ' ' ARG . . . . . . . . . . . . . 60.6 mtt180 -72.46 148.35 45.21 Favored 'General case' 0 N--CA 1.488 1.452 0 O-C-N 121.403 -0.811 . . . . 3.42 109.574 179.956 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' D' D ' 334' ' ' GLY . . . . . . . . . . . . . . . 83.47 130.43 1.71 Allowed Glycine 0 N--CA 1.492 2.37 0 N-CA-C 109.834 -1.306 . . . . 0.41 109.834 179.676 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' D' D ' 335' ' ' ARG . . . . . . . . . . . . . 19.5 ttt180 -79.82 -32.81 40.67 Favored 'General case' 0 N--CA 1.489 1.478 0 O-C-N 121.293 -1.122 . . . . 3.58 109.499 179.851 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' D' D ' 336' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -57.44 -63.49 1.21 Allowed 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.272 -0.892 . . . . 2.26 109.636 -179.91 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' D' D ' 337' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -60.45 -29.88 69.3 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.112 -0.992 . . . . 3.64 109.694 -179.983 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' D' D ' 338' ' ' PHE . . . . . . . . . . . . . 69.2 t80 -55.23 -56.7 16.95 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.224 -0.922 . . . . 0.4 109.648 -179.722 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' D' D ' 339' ' ' GLU . . . . . . . . . . . . . 52.9 mt-10 -52.53 -35.62 53.81 Favored 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.278 -0.889 . . . . 1.99 109.948 -179.824 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' D' D ' 340' ' ' MET . . . . . . . . . . . . . 42.4 ttp -63.94 -45.98 86.74 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.25 -0.906 . . . . 1.13 109.916 -179.615 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' D' D ' 341' ' ' PHE . . . . . . . . . . . . . 40.1 m-85 -63.44 -45.53 90.47 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.306 -0.871 . . . . 0.21 110.005 -179.464 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' D' D ' 342' ' ' ARG . . . . . . . . . . . . . 22.1 ttt180 -49.4 -43.5 44.47 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.172 -0.955 . . . . 3.15 110.145 -179.401 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' D' D ' 343' ' ' GLU . . . . . . . . . . . . . 2.1 tp10 -57.98 -45.44 86.75 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.138 -0.976 . . . . 2.35 109.96 -179.263 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' D' D ' 344' ' ' LEU . . . . . 0.41 ' O ' HD21 ' D' ' 348' ' ' LEU . 70.9 mt -62.5 -42.28 99.4 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.257 -0.902 . . . . 1.06 109.956 -179.661 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' D' D ' 345' ' ' ASN . . . . . . . . . . . . . 63.5 t-20 -56.27 -49.56 73.87 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.145 -0.972 . . . . 1.35 109.471 -179.723 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' D' D ' 346' ' ' GLU . . . . . . . . . . . . . 4.1 tp10 -62.64 -34.96 78.13 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.269 -0.894 . . . . 1.69 110.116 -179.932 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' D' D ' 347' ' ' ALA . . . . . . . . . . . . . . . -59.44 -56.04 27.09 Favored 'General case' 0 N--CA 1.493 1.692 0 O-C-N 120.984 -1.072 . . . . 1.03 110.104 -179.611 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' D' D ' 348' ' ' LEU . . . . . 0.458 ' N ' HD23 ' D' ' 348' ' ' LEU . 3.9 mm? -60.67 -44.84 95.99 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.156 -0.965 . . . . 1.04 109.789 -179.761 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' D' D ' 349' ' ' GLU . . . . . . . . . . . . . 2.5 mt-10 -57.71 -32.62 67.58 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.421 -0.8 . . . . 1.95 109.97 -179.45 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' D' D ' 350' ' ' LEU . . . . . 0.599 ' CD1' ' CD2' ' C' ' 350' ' ' LEU . 4.9 tt -63.8 -46.75 83.74 Favored 'General case' 0 N--CA 1.489 1.479 0 O-C-N 120.927 -1.108 . . . . 1.16 109.365 -179.79 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' D' D ' 351' ' ' LYS . . . . . . . . . . . . . 39.0 tttt -59.29 -36.7 76.07 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.443 -0.786 . . . . 1.97 109.413 -179.935 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' D' D ' 352' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -58.31 -43.08 87.99 Favored 'General case' 0 N--CA 1.489 1.475 0 O-C-N 121.34 -0.85 . . . . 1.17 109.634 -179.961 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' D' D ' 353' ' ' ALA . . . . . . . . . . . . . . . -67.59 -19.06 65.2 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.201 -0.937 . . . . 1.21 110.091 -179.413 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' D' D ' 354' ' ' GLN . . . . . . . . . . . . . 5.9 tt0 -82.41 -11.59 58.45 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.285 -0.885 . . . . 1.68 109.554 -179.744 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' D' D ' 355' ' ' ALA . . . . . . . . . . . . . . . -73.18 -1.34 17.24 Favored 'General case' 0 N--CA 1.489 1.492 0 O-C-N 121.271 -0.893 . . . . 1.29 109.703 179.742 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' D' D ' 356' ' ' GLY . . . . . . . . . . . . . . . -77.9 -5.83 86.92 Favored Glycine 0 N--CA 1.491 2.337 0 N-CA-C 110.055 -1.218 . . . . 1.28 110.055 -179.646 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' D' D ' 357' ' ' LYS . . . . . . . . . . . . . 26.7 mttt -87.36 143.21 27.36 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.112 -1.228 . . . . 4.45 109.251 179.716 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' D' D ' 358' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -48.13 165.83 0.23 Allowed Pre-proline 0 N--CA 1.491 1.614 0 O-C-N 121.259 -0.9 . . . . 5.71 109.326 -179.943 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' D' D ' 359' ' ' PRO . . . . . . . . . . . . . 1.9 Cg_endo -62.19 134.42 48.88 Favored 'Trans proline' 0 C--N 1.308 -1.577 0 C-N-CA 122.291 1.994 . . . . 5.6 110.049 179.879 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' D' D ' 360' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.321 0 CA-C-O 118.054 -1.414 . . . . 6.97 109.649 179.99 . . . . . . . . 0 0 . 1 . 028 nuclear orig full ' A' A ' 319' ' ' LYS . . . . . 0.425 ' O ' ' O ' ' A' ' 320' ' ' LYS . 3.1 mmtt . . . . . 0 N--CA 1.491 1.582 0 N-CA-C 109.38 -0.6 . . . . 7.95 109.38 . . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 320' ' ' LYS . . . . . 0.425 ' O ' ' O ' ' A' ' 319' ' ' LYS . 1.1 tptt 62.31 131.75 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.142 -0.974 . . . . 6.71 109.868 179.701 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 321' ' ' LYS . . . . . . . . . . . . . 8.4 mttt -157.43 141.9 11.86 Favored Pre-proline 0 N--CA 1.487 1.407 0 O-C-N 121.243 -0.911 . . . . 6.5 109.575 -179.889 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 322' ' ' PRO . . . . . . . . . . . . . 1.6 Cg_endo -64.24 -80.83 0.01 OUTLIER 'Trans proline' 0 C--N 1.309 -1.513 0 C-N-CA 121.944 1.763 . . . . 3.3 109.656 179.727 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 323' ' ' LEU . . . . . . . . . . . . . 22.2 mt -79.66 114.09 18.31 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.292 -0.88 . . . . 3.16 109.119 179.782 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 324' ' ' ASP . . . . . . . . . . . . . 41.4 m-20 -79.64 147.8 31.88 Favored 'General case' 0 N--CA 1.489 1.477 0 O-C-N 121.195 -0.94 . . . . 1.53 109.407 -179.774 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 325' ' ' GLY . . . . . . . . . . . . . . . -67.66 167.34 41.42 Favored Glycine 0 N--CA 1.49 2.256 0 N-CA-C 109.269 -1.533 . . . . 0.67 109.269 -179.937 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 326' ' ' GLU . . . . . . . . . . . . . 32.2 mm-40 -57.08 174.26 0.18 Allowed 'General case' 0 N--CA 1.488 1.447 0 O-C-N 121.04 -1.27 . . . . 2.13 109.594 -179.776 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 327' ' ' TYR . . . . . 0.407 ' CE1' ' HG2' ' C' ' 333' ' ' ARG . 39.4 m-85 -148.24 110.99 4.77 Favored 'General case' 0 C--N 1.303 -1.416 0 O-C-N 121.246 -0.909 . . . . 1.0 109.759 179.998 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 328' ' ' PHE . . . . . 0.474 ' O ' HG21 ' A' ' 329' ' ' THR . 29.5 m-85 -113.9 -171.78 1.96 Allowed 'General case' 0 C--N 1.301 -1.533 0 O-C-N 121.428 -0.795 . . . . 0.34 109.395 179.753 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 329' ' ' THR . . . . . 0.474 HG21 ' O ' ' A' ' 328' ' ' PHE . 3.3 p -149.16 167.0 27.14 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.307 -0.871 . . . . 1.05 109.059 179.898 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 330' ' ' LEU . . . . . 0.406 ' O ' ' HA ' ' C' ' 329' ' ' THR . 63.3 tp -149.82 129.29 13.01 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.313 -0.867 . . . . 1.07 109.762 -179.576 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 331' ' ' GLN . . . . . . . . . . . . . 1.1 tp60 -87.32 113.2 22.83 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.394 -0.816 . . . . 0.91 109.418 179.701 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 332' ' ' ILE . . . . . . . . . . . . . 69.7 mt -102.19 107.63 22.16 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.527 0 O-C-N 121.112 -0.993 . . . . 1.09 109.611 -179.959 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 333' ' ' ARG . . . . . 0.471 ' HG2' ' CE1' ' C' ' 327' ' ' TYR . 76.1 mtt180 -72.51 143.75 48.25 Favored 'General case' 0 C--N 1.303 -1.445 0 O-C-N 121.492 -0.755 . . . . 3.41 109.456 179.925 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 334' ' ' GLY . . . . . . . . . . . . . . . 85.43 128.26 1.98 Allowed Glycine 0 N--CA 1.49 2.252 0 N-CA-C 109.596 -1.402 . . . . 0.4 109.596 179.949 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 335' ' ' ARG . . . . . . . . . . . . . 9.2 ttp180 -77.06 -33.36 57.22 Favored 'General case' 0 C--N 1.303 -1.433 0 O-C-N 121.388 -1.066 . . . . 3.55 109.197 179.903 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 336' ' ' GLU . . . . . . . . . . . . . 15.1 mt-10 -59.19 -63.89 1.14 Allowed 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.326 -0.859 . . . . 2.29 109.936 -179.781 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 337' ' ' ARG . . . . . 0.46 ' NH1' ' CG ' ' A' ' 337' ' ' ARG . 0.0 OUTLIER -59.25 -29.83 67.83 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 120.985 -1.072 . . . . 3.64 109.496 -179.791 . . . . . . . . 3 3 . 1 . 028 nuclear orig full ' A' A ' 338' ' ' PHE . . . . . . . . . . . . . 66.5 t80 -55.3 -54.14 47.22 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.199 -0.938 . . . . 0.41 109.544 179.867 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 339' ' ' GLU . . . . . . . . . . . . . 44.6 mt-10 -53.89 -35.37 61.51 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.26 -0.9 . . . . 1.97 109.91 179.979 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 340' ' ' MET . . . . . . . . . . . . . 6.7 ttp -63.46 -52.74 60.12 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.17 -0.956 . . . . 1.14 110.442 -179.075 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 341' ' ' PHE . . . . . . . . . . . . . 51.7 m-85 -60.74 -42.38 97.22 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.05 -1.031 . . . . 0.21 109.816 -179.353 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 342' ' ' ARG . . . . . . . . . . . . . 60.6 ttt180 -50.86 -43.34 59.31 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.357 -0.84 . . . . 3.15 109.884 -179.73 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 343' ' ' GLU . . . . . . . . . . . . . 3.9 tt0 -59.67 -45.99 90.4 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.178 -0.951 . . . . 2.35 109.954 -179.553 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 344' ' ' LEU . . . . . . . . . . . . . 42.8 mt -61.3 -38.69 87.72 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.248 -0.907 . . . . 1.06 109.889 -179.625 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 345' ' ' ASN . . . . . . . . . . . . . 64.2 t-20 -57.77 -49.64 75.9 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.202 -0.936 . . . . 1.36 110.002 -179.773 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 346' ' ' GLU . . . . . . . . . . . . . 45.8 tt0 -60.78 -33.1 72.47 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.103 -0.998 . . . . 1.65 109.837 -179.666 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 347' ' ' ALA . . . . . . . . . . . . . . . -59.7 -55.4 34.81 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.058 -1.026 . . . . 1.03 110.013 -179.618 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 348' ' ' LEU . . . . . 0.451 ' N ' ' CD2' ' A' ' 348' ' ' LEU . 3.9 mm? -62.7 -40.22 96.46 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.167 -0.958 . . . . 1.04 109.909 -179.455 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 349' ' ' GLU . . . . . 0.444 ' OE2' ' HD3' ' C' ' 333' ' ' ARG . 7.3 mm-40 -57.65 -39.48 77.11 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.218 -0.926 . . . . 1.94 109.792 -179.431 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 350' ' ' LEU . . . . . 0.519 HD21 ' CD1' ' B' ' 350' ' ' LEU . 7.6 tt -61.86 -44.59 96.52 Favored 'General case' 0 N--CA 1.488 1.463 0 O-C-N 121.321 -0.862 . . . . 1.17 109.334 -179.972 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 351' ' ' LYS . . . . . . . . . . . . . 42.0 tttt -58.85 -43.5 90.81 Favored 'General case' 0 N--CA 1.488 1.468 0 O-C-N 121.326 -0.859 . . . . 1.97 109.235 179.98 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 352' ' ' ASP . . . . . . . . . . . . . 7.3 m-20 -56.65 -55.37 34.93 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.346 -0.846 . . . . 1.16 109.676 -179.976 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 353' ' ' ALA . . . . . . . . . . . . . . . -69.02 -11.45 60.8 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.23 -0.919 . . . . 1.22 109.386 179.937 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 354' ' ' GLN . . . . . . . . . . . . . 2.9 tt0 -84.51 -14.62 48.51 Favored 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.181 -0.95 . . . . 1.71 109.488 -179.699 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 355' ' ' ALA . . . . . . . . . . . . . . . -73.08 -9.68 58.99 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.265 -0.897 . . . . 1.3 109.528 179.905 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 356' ' ' GLY . . . . . . . . . . . . . . . -79.94 -3.54 89.38 Favored Glycine 0 N--CA 1.491 2.357 0 N-CA-C 109.684 -1.366 . . . . 1.3 109.684 -179.932 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 357' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -87.09 101.11 13.16 Favored 'General case' 0 N--CA 1.489 1.492 0 O-C-N 121.241 -1.153 . . . . 4.46 109.541 179.971 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 358' ' ' GLU . . . . . 0.457 ' HB2' ' HD2' ' A' ' 359' ' ' PRO . 26.4 pt-20 -51.05 157.6 1.41 Allowed Pre-proline 0 N--CA 1.491 1.595 0 O-C-N 121.114 -0.991 . . . . 5.75 109.313 179.933 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 359' ' ' PRO . . . . . 0.457 ' HD2' ' HB2' ' A' ' 358' ' ' GLU . 2.4 Cg_endo -60.95 86.32 0.08 OUTLIER 'Trans proline' 0 C--N 1.307 -1.608 0 C-N-CA 121.972 1.781 . . . . 5.63 110.225 179.736 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 360' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.493 2.462 0 CA-C-O 117.981 -1.455 . . . . 6.97 109.719 -179.921 . . . . . . . . 0 0 . 1 . 028 nuclear orig full ' B' B ' 319' ' ' LYS . . . . . 0.452 ' O ' ' O ' ' B' ' 320' ' ' LYS . 3.2 mmtt . . . . . 0 N--CA 1.488 1.434 0 N-CA-C 109.195 -0.668 . . . . 7.95 109.195 . . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' B' B ' 320' ' ' LYS . . . . . 0.452 ' O ' ' O ' ' B' ' 319' ' ' LYS . 1.5 tptt 61.62 132.94 0.01 OUTLIER 'General case' 0 C--N 1.302 -1.496 0 O-C-N 121.294 -0.879 . . . . 6.73 109.737 179.977 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' B' B ' 321' ' ' LYS . . . . . . . . . . . . . 8.4 mttt -158.2 140.67 10.43 Favored Pre-proline 0 N--CA 1.489 1.505 0 O-C-N 121.322 -0.861 . . . . 6.5 109.63 -179.884 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' B' B ' 322' ' ' PRO . . . . . . . . . . . . . 1.5 Cg_endo -63.2 -81.03 0.01 OUTLIER 'Trans proline' 0 C--N 1.31 -1.49 0 C-N-CA 122.301 2.001 . . . . 3.29 109.54 179.471 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' B' B ' 323' ' ' LEU . . . . . . . . . . . . . 22.1 mt -79.68 114.16 18.39 Favored 'General case' 0 N--CA 1.489 1.484 0 O-C-N 121.161 -0.962 . . . . 3.18 109.28 179.814 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' B' B ' 324' ' ' ASP . . . . . . . . . . . . . 40.0 m-20 -79.66 145.34 33.06 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.294 -0.879 . . . . 1.53 109.657 179.938 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' B' B ' 325' ' ' GLY . . . . . . . . . . . . . . . -65.26 167.35 32.05 Favored Glycine 0 N--CA 1.491 2.344 0 N-CA-C 109.602 -1.399 . . . . 0.65 109.602 179.901 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' B' B ' 326' ' ' GLU . . . . . . . . . . . . . 30.9 mm-40 -57.16 174.07 0.2 Allowed 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.103 -1.233 . . . . 2.13 109.522 -179.895 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' B' B ' 327' ' ' TYR . . . . . . . . . . . . . 38.0 m-85 -148.62 110.51 4.55 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.324 -0.86 . . . . 0.99 109.764 -179.695 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' B' B ' 328' ' ' PHE . . . . . 0.481 ' O ' HG21 ' B' ' 329' ' ' THR . 30.7 m-85 -114.3 -172.9 2.19 Favored 'General case' 0 N--CA 1.489 1.491 0 O-C-N 121.53 -0.731 . . . . 0.36 109.626 179.862 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' B' B ' 329' ' ' THR . . . . . 0.481 HG21 ' O ' ' B' ' 328' ' ' PHE . 3.2 p -148.36 167.19 25.89 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.096 -1.002 . . . . 1.05 109.143 -179.905 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' B' B ' 330' ' ' LEU . . . . . . . . . . . . . 62.0 tp -150.17 129.6 12.97 Favored 'General case' 0 C--N 1.303 -1.438 0 O-C-N 121.238 -0.914 . . . . 1.07 109.617 -179.501 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' B' B ' 331' ' ' GLN . . . . . . . . . . . . . 1.1 tp60 -87.47 114.17 23.84 Favored 'General case' 0 C--N 1.304 -1.412 0 O-C-N 121.3 -0.875 . . . . 0.91 109.007 179.608 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' B' B ' 332' ' ' ILE . . . . . . . . . . . . . 70.1 mt -102.87 106.75 20.59 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.465 0 O-C-N 121.227 -0.921 . . . . 1.08 109.256 -179.749 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' B' B ' 333' ' ' ARG . . . . . . . . . . . . . 74.9 mtt180 -71.78 144.42 49.2 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.157 -0.964 . . . . 3.42 109.458 -179.871 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' B' B ' 334' ' ' GLY . . . . . . . . . . . . . . . 84.75 128.39 1.79 Allowed Glycine 0 N--CA 1.489 2.229 0 N-CA-C 109.741 -1.344 . . . . 0.4 109.741 179.886 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' B' B ' 335' ' ' ARG . . . . . . . . . . . . . 8.5 ttp180 -77.42 -32.96 55.02 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.321 -1.106 . . . . 3.55 109.449 179.866 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' B' B ' 336' ' ' GLU . . . . . . . . . . . . . 14.1 mt-10 -59.77 -62.8 1.61 Allowed 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.242 -0.911 . . . . 2.28 109.843 -179.69 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' B' B ' 337' ' ' ARG . . . . . 0.472 ' CG ' ' NH1' ' B' ' 337' ' ' ARG . 0.0 OUTLIER -59.96 -30.04 68.83 Favored 'General case' 0 N--CA 1.488 1.472 0 O-C-N 121.166 -0.959 . . . . 3.64 109.354 -179.794 . . . . . . . . 3 3 . 1 . 028 nuclear orig full ' B' B ' 338' ' ' PHE . . . . . . . . . . . . . 66.8 t80 -55.39 -53.75 52.31 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.146 -0.971 . . . . 0.39 109.629 179.9 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' B' B ' 339' ' ' GLU . . . . . . . . . . . . . 49.3 mt-10 -53.84 -35.83 61.91 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.134 -0.979 . . . . 1.98 109.976 179.827 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' B' B ' 340' ' ' MET . . . . . . . . . . . . . 6.2 ttp -63.12 -52.21 63.48 Favored 'General case' 0 N--CA 1.495 1.785 0 O-C-N 121.196 -0.94 . . . . 1.14 110.649 -179.141 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' B' B ' 341' ' ' PHE . . . . . . . . . . . . . 49.5 m-85 -60.93 -43.49 98.57 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.13 -0.981 . . . . 0.22 109.59 -179.494 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' B' B ' 342' ' ' ARG . . . . . . . . . . . . . 61.7 ttt180 -49.99 -43.38 50.45 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.433 -0.792 . . . . 3.15 109.993 -179.841 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' B' B ' 343' ' ' GLU . . . . . . . . . . . . . 3.7 tt0 -59.88 -45.86 91.16 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.232 -0.918 . . . . 2.35 110.14 -179.536 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' B' B ' 344' ' ' LEU . . . . . . . . . . . . . 43.5 mt -61.84 -37.95 86.36 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.189 -0.945 . . . . 1.05 110.024 -179.621 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' B' B ' 345' ' ' ASN . . . . . . . . . . . . . 64.8 t-20 -58.23 -49.05 78.45 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.291 -0.88 . . . . 1.35 109.879 -179.708 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' B' B ' 346' ' ' GLU . . . . . . . . . . . . . 46.8 tt0 -60.98 -32.95 72.5 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.209 -0.932 . . . . 1.66 109.819 -179.669 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' B' B ' 347' ' ' ALA . . . . . . . . . . . . . . . -60.03 -56.18 24.87 Favored 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.101 -1.0 . . . . 1.02 110.009 -179.598 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' B' B ' 348' ' ' LEU . . . . . 0.49 ' N ' HD23 ' B' ' 348' ' ' LEU . 3.9 mm? -62.25 -40.36 95.94 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.284 -0.885 . . . . 1.05 109.866 -179.567 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' B' B ' 349' ' ' GLU . . . . . . . . . . . . . 7.2 mm-40 -57.43 -39.17 75.65 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 121.211 -0.93 . . . . 1.95 109.913 -179.648 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' B' B ' 350' ' ' LEU . . . . . 0.519 ' CD1' HD21 ' A' ' 350' ' ' LEU . 7.7 tt -62.35 -45.29 93.84 Favored 'General case' 0 N--CA 1.488 1.456 0 O-C-N 121.201 -0.937 . . . . 1.18 109.242 -179.786 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' B' B ' 351' ' ' LYS . . . . . . . . . . . . . 39.2 tttt -58.16 -43.94 87.69 Favored 'General case' 0 C--N 1.302 -1.457 0 O-C-N 121.297 -0.877 . . . . 1.96 109.286 179.975 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' B' B ' 352' ' ' ASP . . . . . . . . . . . . . 7.4 m-20 -56.13 -55.72 29.56 Favored 'General case' 0 N--CA 1.488 1.439 0 O-C-N 121.279 -0.888 . . . . 1.16 109.526 -179.953 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' B' B ' 353' ' ' ALA . . . . . . . . . . . . . . . -68.38 -12.35 60.98 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.153 -0.967 . . . . 1.21 109.777 179.977 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' B' B ' 354' ' ' GLN . . . . . 0.437 ' NE2' ' CD1' ' A' ' 350' ' ' LEU . 3.2 tt0 -84.08 -13.58 52.68 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.326 -0.859 . . . . 1.69 109.683 -179.772 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' B' B ' 355' ' ' ALA . . . . . . . . . . . . . . . -73.41 -10.27 59.56 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.181 -0.949 . . . . 1.3 109.67 179.783 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' B' B ' 356' ' ' GLY . . . . . . . . . . . . . . . -80.15 -3.31 89.59 Favored Glycine 0 N--CA 1.49 2.275 0 N-CA-C 109.498 -1.441 . . . . 1.29 109.498 -179.995 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' B' B ' 357' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -87.0 100.47 12.64 Favored 'General case' 0 N--CA 1.487 1.425 0 O-C-N 121.322 -1.105 . . . . 4.45 109.399 179.828 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' B' B ' 358' ' ' GLU . . . . . 0.451 ' HB2' ' HD2' ' B' ' 359' ' ' PRO . 27.1 pt-20 -50.84 157.57 1.33 Allowed Pre-proline 0 C--N 1.302 -1.475 0 O-C-N 121.177 -0.952 . . . . 5.72 109.347 179.872 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' B' B ' 359' ' ' PRO . . . . . 0.451 ' HD2' ' HB2' ' B' ' 358' ' ' GLU . 3.3 Cg_exo -60.55 85.04 0.08 OUTLIER 'Trans proline' 0 C--N 1.309 -1.546 0 C-N-CA 122.202 1.934 . . . . 5.6 110.171 179.82 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' B' B ' 360' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.487 2.055 0 CA-C-O 117.934 -1.481 . . . . 6.98 109.622 -179.946 . . . . . . . . 0 0 . 1 . 028 nuclear orig full ' C' C ' 319' ' ' LYS . . . . . 0.44 ' O ' ' O ' ' C' ' 320' ' ' LYS . 0.0 OUTLIER . . . . . 0 N--CA 1.489 1.487 0 N-CA-C 109.391 -0.596 . . . . 7.03 109.391 . . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' C' C ' 320' ' ' LYS . . . . . 0.44 ' O ' ' O ' ' C' ' 319' ' ' LYS . 0.6 OUTLIER 61.93 126.16 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.267 -0.895 . . . . 6.84 109.125 -179.825 . . . . . . . . 3 3 . 1 . 028 nuclear orig full ' C' C ' 321' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -157.24 154.31 25.59 Favored Pre-proline 0 N--CA 1.489 1.507 0 O-C-N 121.205 -0.934 . . . . 6.78 109.702 -179.713 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' C' C ' 322' ' ' PRO . . . . . . . . . . . . . 1.6 Cg_endo -63.17 -81.77 0.01 OUTLIER 'Trans proline' 0 C--N 1.311 -1.438 0 C-N-CA 122.346 2.031 . . . . 3.98 110.388 179.834 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' C' C ' 323' ' ' LEU . . . . . . . . . . . . . 21.2 mt -82.69 104.14 12.72 Favored 'General case' 0 N--CA 1.495 1.779 0 O-C-N 121.234 -0.916 . . . . 4.31 109.698 -179.964 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' C' C ' 324' ' ' ASP . . . . . . . . . . . . . 4.8 m-20 -79.82 139.22 37.29 Favored 'General case' 0 C--N 1.303 -1.449 0 O-C-N 121.275 -0.891 . . . . 1.63 109.575 179.855 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' C' C ' 325' ' ' GLY . . . . . 0.466 ' O ' ' CD2' ' C' ' 327' ' ' TYR . . . -67.8 171.06 35.25 Favored Glycine 0 N--CA 1.491 2.335 0 N-CA-C 109.502 -1.439 . . . . 0.82 109.502 -179.897 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' C' C ' 326' ' ' GLU . . . . . 0.492 ' HB3' ' CE2' ' C' ' 328' ' ' PHE . 13.5 mm-40 -58.11 166.78 1.46 Allowed 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.124 -1.221 . . . . 2.17 109.398 -179.905 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' C' C ' 327' ' ' TYR . . . . . 0.471 ' CE1' ' HG2' ' A' ' 333' ' ' ARG . 38.4 m-85 -147.22 99.09 3.11 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.184 -0.948 . . . . 1.03 109.475 179.965 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' C' C ' 328' ' ' PHE . . . . . 0.492 ' CE2' ' HB3' ' C' ' 326' ' ' GLU . 95.0 m-85 -106.85 -167.03 1.23 Allowed 'General case' 0 N--CA 1.487 1.406 0 O-C-N 121.485 -0.759 . . . . 0.37 109.055 179.914 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' C' C ' 329' ' ' THR . . . . . 0.406 ' HA ' ' O ' ' A' ' 330' ' ' LEU . 41.5 p -150.98 169.0 22.86 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.31 -0.869 . . . . 1.04 109.353 179.967 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' C' C ' 330' ' ' LEU . . . . . . . . . . . . . 29.0 tp -148.72 127.52 12.58 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.214 -0.929 . . . . 1.09 109.622 -179.853 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' C' C ' 331' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -87.62 111.64 21.47 Favored 'General case' 0 N--CA 1.489 1.479 0 O-C-N 121.308 -0.87 . . . . 1.48 109.367 179.806 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' C' C ' 332' ' ' ILE . . . . . . . . . . . . . 7.3 mt -103.9 108.04 23.67 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.448 0 O-C-N 121.183 -0.948 . . . . 1.08 109.436 179.748 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' C' C ' 333' ' ' ARG . . . . . 0.485 ' NH1' ' HG2' ' C' ' 333' ' ' ARG . 0.0 OUTLIER -73.47 158.39 35.02 Favored 'General case' 0 C--N 1.303 -1.424 0 O-C-N 121.293 -0.879 . . . . 3.36 108.871 179.516 . . . . . . . . 3 3 . 1 . 028 nuclear orig full ' C' C ' 334' ' ' GLY . . . . . . . . . . . . . . . 74.04 125.94 0.13 Allowed Glycine 0 N--CA 1.491 2.303 0 N-CA-C 109.452 -1.459 . . . . 0.35 109.452 -179.929 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' C' C ' 335' ' ' ARG . . . . . 0.515 ' HG3' ' NH1' ' C' ' 335' ' ' ARG . 0.0 OUTLIER -74.75 -33.32 62.31 Favored 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.117 -1.226 . . . . 3.23 109.775 -179.861 . . . . . . . . 3 3 . 1 . 028 nuclear orig full ' C' C ' 336' ' ' GLU . . . . . . . . . . . . . 1.3 mt-10 -57.49 -59.84 4.55 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.115 -0.991 . . . . 2.62 109.678 -179.88 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' C' C ' 337' ' ' ARG . . . . . . . . . . . . . 1.7 mpt_? -61.16 -32.97 72.69 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.252 -0.905 . . . . 3.61 109.982 -179.688 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' C' C ' 338' ' ' PHE . . . . . . . . . . . . . 63.7 t80 -55.49 -61.62 2.22 Favored 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.041 -1.037 . . . . 0.43 109.615 -179.797 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' C' C ' 339' ' ' GLU . . . . . . . . . . . . . 1.1 mm-40 -49.38 -36.64 22.39 Favored 'General case' 0 C--N 1.3 -1.547 0 O-C-N 121.407 -0.808 . . . . 2.05 110.358 -179.114 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' C' C ' 340' ' ' MET . . . . . . . . . . . . . 37.9 ttp -63.9 -48.5 76.37 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.036 -1.04 . . . . 1.1 110.051 -179.212 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' C' C ' 341' ' ' PHE . . . . . . . . . . . . . 38.8 m-85 -61.37 -45.92 92.35 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 120.951 -1.093 . . . . 0.21 109.539 -179.763 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' C' C ' 342' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -47.63 -38.42 14.67 Favored 'General case' 0 N--CA 1.489 1.491 0 O-C-N 121.252 -0.905 . . . . 3.42 109.959 -179.804 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' C' C ' 343' ' ' GLU . . . . . . . . . . . . . 29.0 tp10 -59.04 -50.96 72.09 Favored 'General case' 0 N--CA 1.488 1.47 0 O-C-N 121.182 -0.949 . . . . 2.14 109.598 -179.906 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' C' C ' 344' ' ' LEU . . . . . . . . . . . . . 70.8 mt -62.37 -31.55 72.22 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.364 -0.835 . . . . 1.09 109.56 179.931 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' C' C ' 345' ' ' ASN . . . . . . . . . . . . . 18.7 t-20 -57.07 -58.36 8.52 Favored 'General case' 0 N--CA 1.487 1.412 0 O-C-N 121.254 -0.904 . . . . 1.38 109.564 179.928 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' C' C ' 346' ' ' GLU . . . . . . . . . . . . . 8.4 tm-20 -61.44 -27.87 68.87 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.46 -0.775 . . . . 2.21 110.028 -179.731 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' C' C ' 347' ' ' ALA . . . . . . . . . . . . . . . -62.93 -61.79 2.16 Favored 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.024 -1.048 . . . . 1.03 110.16 -179.651 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' C' C ' 348' ' ' LEU . . . . . 0.405 ' N ' ' CD2' ' C' ' 348' ' ' LEU . 4.2 mm? -60.59 -42.87 97.62 Favored 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.209 -0.932 . . . . 1.06 109.707 -179.72 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' C' C ' 349' ' ' GLU . . . . . . . . . . . . . 3.7 mm-40 -58.49 -35.98 73.06 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.11 -0.994 . . . . 2.19 109.834 -179.729 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' C' C ' 350' ' ' LEU . . . . . 0.555 HD23 ' CD2' ' D' ' 350' ' ' LEU . 4.1 tt -65.16 -39.59 93.18 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.048 -1.033 . . . . 1.2 109.043 179.766 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' C' C ' 351' ' ' LYS . . . . . . . . . . . . . 4.1 tttm -59.25 -40.82 87.19 Favored 'General case' 0 N--CA 1.488 1.452 0 O-C-N 121.394 -0.816 . . . . 1.92 109.108 179.914 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' C' C ' 352' ' ' ASP . . . . . . . . . . . . . 41.8 m-20 -57.73 -48.91 78.25 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.41 -0.806 . . . . 1.19 109.519 -179.996 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' C' C ' 353' ' ' ALA . . . . . . . . . . . . . . . -67.61 -16.01 63.95 Favored 'General case' 0 N--CA 1.487 1.42 0 O-C-N 121.42 -0.8 . . . . 1.15 109.537 -179.873 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' C' C ' 354' ' ' GLN . . . . . . . . . . . . . 6.5 tt0 -84.78 -13.72 50.32 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 120.945 -1.097 . . . . 1.7 109.664 179.938 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' C' C ' 355' ' ' ALA . . . . . . . . . . . . . . . -73.33 -11.21 60.41 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.284 -0.885 . . . . 1.3 109.672 -179.871 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' C' C ' 356' ' ' GLY . . . . . . . . . . . . . . . -77.95 0.73 71.35 Favored Glycine 0 N--CA 1.491 2.32 0 N-CA-C 109.561 -1.415 . . . . 1.33 109.561 -179.882 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' C' C ' 357' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -87.21 116.66 25.44 Favored 'General case' 0 N--CA 1.488 1.452 0 O-C-N 121.418 -1.048 . . . . 4.39 109.34 -179.899 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' C' C ' 358' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -49.91 164.95 0.33 Allowed Pre-proline 0 C--N 1.302 -1.482 0 O-C-N 121.345 -0.847 . . . . 5.75 109.319 -179.996 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' C' C ' 359' ' ' PRO . . . . . . . . . . . . . 2.2 Cg_endo -62.08 -165.58 0.05 OUTLIER 'Trans proline' 0 C--N 1.307 -1.655 0 C-N-CA 122.098 1.865 . . . . 5.54 109.959 179.808 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' C' C ' 360' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.24 0 CA-C-O 117.961 -1.466 . . . . 6.5 109.717 -179.905 . . . . . . . . 0 0 . 1 . 028 nuclear orig full ' D' D ' 319' ' ' LYS . . . . . 0.428 ' O ' ' O ' ' D' ' 320' ' ' LYS . 2.9 mmtt . . . . . 0 N--CA 1.488 1.445 0 CA-C-O 121.275 0.559 . . . . 7.93 109.533 . . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' D' D ' 320' ' ' LYS . . . . . 0.428 ' O ' ' O ' ' D' ' 319' ' ' LYS . 1.8 tptt 62.67 132.44 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.194 -0.942 . . . . 6.7 109.465 179.956 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' D' D ' 321' ' ' LYS . . . . . . . . . . . . . 11.2 mttt -157.88 141.5 11.22 Favored Pre-proline 0 N--CA 1.492 1.637 0 O-C-N 121.319 -0.863 . . . . 6.49 109.585 179.96 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' D' D ' 322' ' ' PRO . . . . . . . . . . . . . 1.8 Cg_endo -63.82 -80.34 0.01 OUTLIER 'Trans proline' 0 C--N 1.313 -1.296 0 C-N-CA 122.254 1.969 . . . . 3.29 109.5 179.698 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' D' D ' 323' ' ' LEU . . . . . . . . . . . . . 24.1 mt -80.06 115.02 19.39 Favored 'General case' 0 N--CA 1.489 1.494 0 O-C-N 121.263 -0.898 . . . . 3.16 109.001 179.797 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' D' D ' 324' ' ' ASP . . . . . . . . . . . . . 36.4 m-20 -80.05 146.77 31.78 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.167 -0.958 . . . . 1.54 109.418 179.97 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' D' D ' 325' ' ' GLY . . . . . . . . . . . . . . . -66.61 167.91 36.5 Favored Glycine 0 N--CA 1.489 2.212 0 N-CA-C 109.441 -1.464 . . . . 0.65 109.441 179.89 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' D' D ' 326' ' ' GLU . . . . . . . . . . . . . 32.9 mm-40 -57.2 173.92 0.21 Allowed 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.21 -1.171 . . . . 2.13 109.464 -179.813 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' D' D ' 327' ' ' TYR . . . . . . . . . . . . . 39.1 m-85 -148.45 110.67 4.63 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.187 -0.945 . . . . 1.0 109.574 179.916 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' D' D ' 328' ' ' PHE . . . . . 0.492 ' O ' HG21 ' D' ' 329' ' ' THR . 32.9 m-85 -114.06 -171.66 1.95 Allowed 'General case' 0 N--CA 1.488 1.437 0 O-C-N 121.297 -0.877 . . . . 0.34 109.402 179.925 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' D' D ' 329' ' ' THR . . . . . 0.492 HG21 ' O ' ' D' ' 328' ' ' PHE . 3.2 p -149.73 165.95 30.87 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.457 -0.777 . . . . 1.05 109.058 179.944 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' D' D ' 330' ' ' LEU . . . . . 0.409 ' O ' ' HA ' ' B' ' 329' ' ' THR . 63.0 tp -149.46 130.17 14.11 Favored 'General case' 0 C--N 1.303 -1.414 0 O-C-N 121.14 -0.975 . . . . 1.07 109.783 -179.534 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' D' D ' 331' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -87.27 113.12 22.72 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.396 -0.815 . . . . 0.93 109.302 179.838 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' D' D ' 332' ' ' ILE . . . . . . . . . . . . . 64.5 mt -101.89 106.09 19.11 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.41 0 O-C-N 121.15 -0.969 . . . . 1.07 109.467 -179.877 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' D' D ' 333' ' ' ARG . . . . . . . . . . . . . 72.6 mtt180 -71.74 142.54 49.77 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.476 -0.765 . . . . 3.42 109.552 179.952 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' D' D ' 334' ' ' GLY . . . . . . . . . . . . . . . 86.76 127.71 2.3 Favored Glycine 0 N--CA 1.489 2.209 0 N-CA-C 109.56 -1.416 . . . . 0.41 109.56 179.732 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' D' D ' 335' ' ' ARG . . . . . 0.458 ' HB2' ' CZ ' ' B' ' 328' ' ' PHE . 7.8 ttp180 -76.96 -33.66 57.65 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.129 -1.218 . . . . 3.58 109.31 -179.938 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' D' D ' 336' ' ' GLU . . . . . . . . . . . . . 12.3 mt-10 -58.6 -63.06 1.42 Allowed 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.414 -0.804 . . . . 2.26 110.093 -179.854 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' D' D ' 337' ' ' ARG . . . . . 0.456 ' NH1' ' CG ' ' D' ' 337' ' ' ARG . 0.0 OUTLIER -60.42 -29.25 68.87 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.085 -1.009 . . . . 3.64 109.307 -179.868 . . . . . . . . 3 3 . 1 . 028 nuclear orig full ' D' D ' 338' ' ' PHE . . . . . . . . . . . . . 66.6 t80 -55.83 -53.98 50.13 Favored 'General case' 0 N--CA 1.489 1.492 0 O-C-N 121.247 -0.908 . . . . 0.4 109.288 179.98 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' D' D ' 339' ' ' GLU . . . . . . . . . . . . . 53.4 mt-10 -53.94 -34.97 61.18 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.199 -0.938 . . . . 1.99 110.081 179.94 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' D' D ' 340' ' ' MET . . . . . . . . . . . . . 5.3 ttp -63.68 -52.75 59.26 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.258 -0.901 . . . . 1.13 110.263 -179.112 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' D' D ' 341' ' ' PHE . . . . . . . . . . . . . 50.5 m-85 -60.35 -42.86 96.6 Favored 'General case' 0 N--CA 1.496 1.827 0 O-C-N 121.087 -1.008 . . . . 0.21 109.807 -179.656 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' D' D ' 342' ' ' ARG . . . . . . . . . . . . . 62.2 ttt180 -50.66 -43.27 57.32 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.369 -0.832 . . . . 3.15 110.123 -179.844 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' D' D ' 343' ' ' GLU . . . . . . . . . . . . . 3.3 tt0 -59.68 -46.66 88.39 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.272 -0.893 . . . . 2.35 109.851 -179.712 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' D' D ' 344' ' ' LEU . . . . . . . . . . . . . 43.4 mt -61.07 -39.24 89.12 Favored 'General case' 0 N--CA 1.489 1.525 0 O-C-N 121.207 -0.933 . . . . 1.06 110.004 -179.465 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' D' D ' 345' ' ' ASN . . . . . . . . . . . . . 61.8 t-20 -56.99 -48.95 77.22 Favored 'General case' 0 N--CA 1.488 1.438 0 O-C-N 121.177 -0.952 . . . . 1.35 109.943 -179.768 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' D' D ' 346' ' ' GLU . . . . . . . . . . . . . 46.4 tt0 -61.15 -32.69 72.4 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 120.918 -1.114 . . . . 1.69 110.037 -179.52 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' D' D ' 347' ' ' ALA . . . . . . . . . . . . . . . -60.12 -56.5 20.86 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.073 -1.017 . . . . 1.03 110.104 -179.752 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' D' D ' 348' ' ' LEU . . . . . 0.496 ' N ' HD23 ' D' ' 348' ' ' LEU . 3.9 mm? -62.43 -40.35 96.28 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.141 -0.974 . . . . 1.04 109.881 -179.509 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' D' D ' 349' ' ' GLU . . . . . . . . . . . . . 10.3 mm-40 -57.3 -39.74 76.39 Favored 'General case' 0 N--CA 1.495 1.777 0 O-C-N 121.304 -0.872 . . . . 1.95 109.858 -179.568 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' D' D ' 350' ' ' LEU . . . . . 0.555 ' CD2' HD23 ' C' ' 350' ' ' LEU . 7.9 tt -61.89 -45.71 92.56 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.285 -0.885 . . . . 1.16 109.317 179.936 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' D' D ' 351' ' ' LYS . . . . . . . . . . . . . 34.4 tttt -58.05 -42.95 86.5 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.418 -0.802 . . . . 1.97 109.453 179.851 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' D' D ' 352' ' ' ASP . . . . . . . . . . . . . 8.0 m-20 -57.01 -54.88 41.69 Favored 'General case' 0 N--CA 1.488 1.448 0 O-C-N 121.262 -0.899 . . . . 1.17 109.473 -179.993 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' D' D ' 353' ' ' ALA . . . . . . . . . . . . . . . -69.2 -12.36 61.61 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.326 -0.859 . . . . 1.21 109.705 179.923 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' D' D ' 354' ' ' GLN . . . . . . . . . . . . . 3.2 tt0 -83.85 -13.42 53.7 Favored 'General case' 0 N--CA 1.488 1.472 0 O-C-N 121.161 -0.962 . . . . 1.68 109.802 -179.918 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' D' D ' 355' ' ' ALA . . . . . . . . . . . . . . . -73.8 -10.05 59.28 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.125 -0.984 . . . . 1.29 109.62 179.842 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' D' D ' 356' ' ' GLY . . . . . . . . . . . . . . . -80.49 -3.36 90.04 Favored Glycine 0 N--CA 1.49 2.234 0 N-CA-C 109.428 -1.469 . . . . 1.28 109.428 -179.778 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' D' D ' 357' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -87.0 100.14 12.4 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.368 -1.077 . . . . 4.45 109.37 179.984 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' D' D ' 358' ' ' GLU . . . . . 0.448 ' HB2' ' HD2' ' D' ' 359' ' ' PRO . 27.3 pt-20 -50.5 157.32 1.28 Allowed Pre-proline 0 N--CA 1.49 1.566 0 O-C-N 121.162 -0.961 . . . . 5.71 109.465 -179.997 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' D' D ' 359' ' ' PRO . . . . . 0.448 ' HD2' ' HB2' ' D' ' 358' ' ' GLU . 3.1 Cg_exo -60.74 85.52 0.08 OUTLIER 'Trans proline' 0 C--N 1.31 -1.498 0 C-N-CA 122.122 1.882 . . . . 5.6 110.102 179.802 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' D' D ' 360' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.488 2.155 0 N-CA-C 109.249 -1.541 . . . . 6.97 109.249 179.959 . . . . . . . . 0 0 . 1 . 029 nuclear orig full ' A' A ' 319' ' ' LYS . . . . . . . . . . . . . 7.9 tttt . . . . . 0 N--CA 1.492 1.647 0 N-CA-C 109.446 -0.576 . . . . 7.95 109.446 . . . . . . . . . 0 0 . 1 . 029 nuclear orig full ' A' A ' 320' ' ' LYS . . . . . . . . . . . . . 11.1 mttt 58.51 -159.69 0.28 Allowed 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.205 -0.934 . . . . 6.71 109.599 -179.916 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 321' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -158.63 110.77 1.64 Allowed Pre-proline 0 N--CA 1.49 1.566 0 O-C-N 121.293 -0.88 . . . . 6.5 109.391 -179.891 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 322' ' ' PRO . . . . . . . . . . . . . 6.1 Cg_exo -57.85 179.38 0.15 Allowed 'Trans proline' 0 C--N 1.311 -1.43 0 C-N-CA 121.778 1.652 . . . . 3.3 109.991 179.68 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 323' ' ' LEU . . . . . . . . . . . . . 21.0 mt -80.17 118.96 22.32 Favored 'General case' 0 N--CA 1.489 1.488 0 O-C-N 121.209 -0.932 . . . . 3.16 109.624 -179.78 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 324' ' ' ASP . . . . . . . . . . . . . 31.2 m-20 -78.8 -168.36 1.4 Allowed 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.272 -0.892 . . . . 1.53 109.081 179.814 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 325' ' ' GLY . . . . . . . . . . . . . . . -68.73 175.68 30.15 Favored Glycine 0 N--CA 1.49 2.245 0 N-CA-C 109.494 -1.442 . . . . 0.67 109.494 -179.931 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 326' ' ' GLU . . . . . . . . . . . . . 2.4 mt-10 -56.89 -174.54 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.216 -1.167 . . . . 2.13 109.151 179.93 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 327' ' ' TYR . . . . . 0.53 ' CE1' ' HG2' ' C' ' 333' ' ' ARG . 46.3 m-85 -150.29 108.56 3.77 Favored 'General case' 0 N--CA 1.488 1.463 0 O-C-N 121.152 -0.967 . . . . 1.0 109.788 -179.888 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 328' ' ' PHE . . . . . 0.452 ' CZ ' ' HG3' ' C' ' 335' ' ' ARG . 86.6 m-85 -108.45 -161.86 0.79 Allowed 'General case' 0 N--CA 1.488 1.47 0 O-C-N 121.308 -0.87 . . . . 0.34 109.377 179.936 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 329' ' ' THR . . . . . . . . . . . . . 24.2 p -155.27 167.69 29.53 Favored 'General case' 0 N--CA 1.488 1.469 0 O-C-N 121.272 -0.892 . . . . 1.05 109.193 179.913 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 330' ' ' LEU . . . . . 0.418 ' O ' ' HA ' ' C' ' 329' ' ' THR . 24.4 tp -150.06 125.4 10.15 Favored 'General case' 0 N--CA 1.489 1.486 0 O-C-N 121.212 -0.93 . . . . 1.07 109.594 -179.924 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 331' ' ' GLN . . . . . . . . . . . . . 1.3 tt0 -87.01 115.69 24.56 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.316 -0.865 . . . . 0.91 109.209 179.857 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 332' ' ' ILE . . . . . 0.465 HD12 ' HB2' ' A' ' 341' ' ' PHE . 68.6 mt -103.61 113.98 41.96 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.511 0 O-C-N 121.217 -0.927 . . . . 1.09 109.588 -179.871 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 333' ' ' ARG . . . . . 0.417 ' HG2' ' CE1' ' C' ' 327' ' ' TYR . 31.6 mtt180 -72.74 151.84 41.94 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.313 -0.867 . . . . 3.41 109.404 179.9 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 334' ' ' GLY . . . . . . . . . . . . . . . 73.92 131.47 0.21 Allowed Glycine 0 N--CA 1.492 2.374 0 N-CA-C 109.589 -1.404 . . . . 0.4 109.589 -179.967 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 335' ' ' ARG . . . . . 0.428 ' HA ' ' CE1' ' C' ' 328' ' ' PHE . 0.1 OUTLIER -77.59 -35.29 53.06 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.283 -1.128 . . . . 3.55 109.463 -179.994 . . . . . . . . 3 3 . 1 . 029 nuclear orig full ' A' A ' 336' ' ' GLU . . . . . . . . . . . . . 45.3 mt-10 -57.59 -61.5 2.46 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.259 -0.901 . . . . 2.29 109.723 -179.843 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 337' ' ' ARG . . . . . . . . . . . . . 1.9 mtp180 -60.07 -31.35 69.91 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.273 -0.892 . . . . 3.64 109.571 -179.877 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 338' ' ' PHE . . . . . . . . . . . . . 44.5 t80 -54.89 -61.1 2.53 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.297 -0.877 . . . . 0.41 109.284 179.835 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 339' ' ' GLU . . . . . . . . . . . . . 93.4 mt-10 -51.43 -27.8 11.23 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.273 -0.892 . . . . 1.97 109.586 -179.941 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 340' ' ' MET . . . . . . . . . . . . . 26.9 ttp -64.74 -54.26 34.29 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.241 -0.912 . . . . 1.14 109.716 -179.903 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 341' ' ' PHE . . . . . 0.465 ' HB2' HD12 ' A' ' 332' ' ' ILE . 47.5 m-85 -61.79 -41.77 98.15 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.24 -0.912 . . . . 0.21 109.656 -179.746 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 342' ' ' ARG . . . . . . . . . . . . . 4.4 ttt180 -49.2 -42.2 39.44 Favored 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.3 -0.875 . . . . 3.15 109.524 179.988 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 343' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -59.2 -46.66 87.85 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.175 -0.953 . . . . 2.35 109.735 -179.835 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 344' ' ' LEU . . . . . 0.436 ' O ' HD21 ' A' ' 348' ' ' LEU . 36.6 mt -61.85 -31.82 72.11 Favored 'General case' 0 N--CA 1.489 1.486 0 O-C-N 121.144 -0.972 . . . . 1.06 109.559 -179.91 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 345' ' ' ASN . . . . . . . . . . . . . 26.5 t-20 -57.95 -57.31 13.37 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.231 -0.918 . . . . 1.36 109.683 -179.867 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 346' ' ' GLU . . . . . . . . . . . . . 20.3 tt0 -60.66 -28.32 68.5 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.306 -0.871 . . . . 1.65 109.912 -179.571 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 347' ' ' ALA . . . . . . . . . . . . . . . -60.47 -58.95 6.32 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.225 -0.922 . . . . 1.03 109.933 -179.805 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 348' ' ' LEU . . . . . 0.455 ' N ' ' CD2' ' A' ' 348' ' ' LEU . 4.0 mm? -62.23 -46.83 87.12 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.196 -0.94 . . . . 1.04 110.007 -179.482 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 349' ' ' GLU . . . . . . . . . . . . . 2.3 mt-10 -58.21 -29.05 65.37 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.22 -0.925 . . . . 1.94 109.965 -179.459 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 350' ' ' LEU . . . . . 0.474 ' CD2' ' C ' ' A' ' 350' ' ' LEU . 3.4 tt -64.17 -50.93 66.2 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.118 -0.989 . . . . 1.17 109.22 179.957 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 351' ' ' LYS . . . . . . . . . . . . . 24.7 tttt -60.03 -38.54 83.03 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.372 -0.83 . . . . 1.97 109.375 179.965 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 352' ' ' ASP . . . . . 0.43 ' OD1' ' NH2' ' C' ' 337' ' ' ARG . 16.9 m-20 -56.95 -44.78 82.91 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.206 -0.934 . . . . 1.16 109.756 179.997 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 353' ' ' ALA . . . . . . . . . . . . . . . -67.01 -20.1 65.81 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.29 -0.881 . . . . 1.22 109.798 -179.624 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 354' ' ' GLN . . . . . . . . . . . . . 1.5 mt-30 -84.02 -12.97 54.39 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.06 -1.025 . . . . 1.71 109.561 -179.999 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 355' ' ' ALA . . . . . . . . . . . . . . . -72.6 -7.65 51.28 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.213 -0.929 . . . . 1.3 109.591 179.951 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 356' ' ' GLY . . . . . . . . . . . . . . . -79.94 3.93 68.26 Favored Glycine 0 N--CA 1.49 2.266 0 N-CA-C 109.767 -1.333 . . . . 1.3 109.767 -179.86 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 357' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -86.94 105.58 17.2 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.12 -1.223 . . . . 4.46 109.536 -179.869 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 358' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -49.16 160.9 0.48 Allowed Pre-proline 0 N--CA 1.49 1.55 0 O-C-N 121.196 -0.94 . . . . 5.75 109.264 179.819 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 359' ' ' PRO . . . . . . . . . . . . . 3.7 Cg_exo -60.64 165.53 11.42 Favored 'Trans proline' 0 C--N 1.308 -1.581 0 C-N-CA 122.122 1.882 . . . . 5.63 109.963 179.782 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 360' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.264 0 CA-C-O 118.049 -1.417 . . . . 6.97 109.576 -179.908 . . . . . . . . 0 0 . 1 . 029 nuclear orig full ' B' B ' 319' ' ' LYS . . . . . . . . . . . . . 8.6 tttt . . . . . 0 N--CA 1.49 1.529 0 N-CA-C 109.455 -0.572 . . . . 7.95 109.455 . . . . . . . . . 0 0 . 1 . 029 nuclear orig full ' B' B ' 320' ' ' LYS . . . . . . . . . . . . . 11.2 mttt 58.49 -159.85 0.27 Allowed 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.185 -0.947 . . . . 6.73 109.469 179.982 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' B' B ' 321' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -158.38 111.1 1.69 Allowed Pre-proline 0 N--CA 1.489 1.488 0 O-C-N 121.201 -0.937 . . . . 6.5 109.537 -179.948 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' B' B ' 322' ' ' PRO . . . . . . . . . . . . . 6.2 Cg_exo -58.12 178.99 0.18 Allowed 'Trans proline' 0 C--N 1.31 -1.473 0 C-N-CA 121.849 1.699 . . . . 3.29 109.893 179.791 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' B' B ' 323' ' ' LEU . . . . . . . . . . . . . 21.1 mt -79.76 118.74 21.83 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.124 -0.985 . . . . 3.18 109.736 -179.802 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' B' B ' 324' ' ' ASP . . . . . . . . . . . . . 31.0 m-20 -78.61 -169.27 1.65 Allowed 'General case' 0 N--CA 1.488 1.474 0 O-C-N 121.272 -0.892 . . . . 1.53 109.172 179.782 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' B' B ' 325' ' ' GLY . . . . . . . . . . . . . . . -67.75 175.19 27.24 Favored Glycine 0 N--CA 1.489 2.206 0 N-CA-C 109.631 -1.388 . . . . 0.65 109.631 179.956 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' B' B ' 326' ' ' GLU . . . . . . . . . . . . . 2.4 mt-10 -56.63 -174.66 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.188 -1.184 . . . . 2.13 109.158 179.941 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' B' B ' 327' ' ' TYR . . . . . 0.448 ' CE1' ' HG2' ' D' ' 333' ' ' ARG . 46.9 m-85 -150.24 108.55 3.77 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.163 -0.96 . . . . 0.99 109.815 -179.902 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' B' B ' 328' ' ' PHE . . . . . . . . . . . . . 86.5 m-85 -108.45 -162.18 0.81 Allowed 'General case' 0 N--CA 1.489 1.48 0 O-C-N 121.267 -0.895 . . . . 0.36 109.404 179.817 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' B' B ' 329' ' ' THR . . . . . 0.43 ' HA ' ' O ' ' D' ' 330' ' ' LEU . 24.2 p -155.11 167.52 30.09 Favored 'General case' 0 N--CA 1.489 1.491 0 O-C-N 121.27 -0.893 . . . . 1.05 109.283 179.795 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' B' B ' 330' ' ' LEU . . . . . 0.46 ' O ' ' HA ' ' D' ' 329' ' ' THR . 24.3 tp -149.79 125.74 10.55 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.171 -0.955 . . . . 1.07 109.531 -179.846 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' B' B ' 331' ' ' GLN . . . . . . . . . . . . . 1.3 tt0 -87.28 115.6 24.79 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.256 -0.902 . . . . 0.91 109.289 179.832 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' B' B ' 332' ' ' ILE . . . . . 0.457 HD12 ' HB2' ' B' ' 341' ' ' PHE . 68.4 mt -103.47 114.47 43.17 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.521 0 O-C-N 121.136 -0.978 . . . . 1.08 109.644 -179.971 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' B' B ' 333' ' ' ARG . . . . . 0.477 ' HG2' ' CE1' ' D' ' 327' ' ' TYR . 32.6 mtt180 -73.15 151.86 41.38 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.253 -0.904 . . . . 3.42 109.429 179.887 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' B' B ' 334' ' ' GLY . . . . . . . . . . . . . . . 73.88 131.2 0.2 Allowed Glycine 0 N--CA 1.491 2.327 0 N-CA-C 109.523 -1.431 . . . . 0.4 109.523 179.959 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' B' B ' 335' ' ' ARG . . . . . 0.42 ' HA ' ' CE1' ' D' ' 328' ' ' PHE . 0.1 OUTLIER -77.36 -35.34 54.62 Favored 'General case' 0 N--CA 1.488 1.47 0 O-C-N 121.294 -1.121 . . . . 3.55 109.477 -179.979 . . . . . . . . 3 3 . 1 . 029 nuclear orig full ' B' B ' 336' ' ' GLU . . . . . . . . . . . . . 46.3 mt-10 -57.22 -61.79 2.22 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.295 -0.878 . . . . 2.28 109.656 -179.926 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' B' B ' 337' ' ' ARG . . . . . . . . . . . . . 1.9 mtp180 -60.14 -30.99 69.67 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.249 -0.907 . . . . 3.64 109.611 -179.698 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' B' B ' 338' ' ' PHE . . . . . . . . . . . . . 44.8 t80 -55.21 -60.94 2.7 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.235 -0.916 . . . . 0.39 109.293 179.872 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' B' B ' 339' ' ' GLU . . . . . . . . . . . . . 93.4 mt-10 -51.4 -27.81 11.06 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.271 -0.893 . . . . 1.98 109.483 179.952 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' B' B ' 340' ' ' MET . . . . . . . . . . . . . 27.4 ttp -64.75 -54.21 34.91 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.351 -0.843 . . . . 1.14 109.698 -179.852 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' B' B ' 341' ' ' PHE . . . . . 0.457 ' HB2' HD12 ' B' ' 332' ' ' ILE . 46.9 m-85 -61.79 -42.07 98.53 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.317 -0.865 . . . . 0.22 109.656 -179.69 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' B' B ' 342' ' ' ARG . . . . . . . . . . . . . 4.3 ttt180 -49.01 -42.12 36.91 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.219 -0.926 . . . . 3.15 109.552 -179.95 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' B' B ' 343' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -59.24 -46.63 87.96 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.278 -0.889 . . . . 2.35 109.681 -179.797 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' B' B ' 344' ' ' LEU . . . . . 0.443 ' O ' HD21 ' B' ' 348' ' ' LEU . 36.2 mt -61.87 -31.93 72.24 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.178 -0.951 . . . . 1.05 109.559 -179.928 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' B' B ' 345' ' ' ASN . . . . . . . . . . . . . 27.1 t-20 -57.69 -57.67 11.7 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.326 -0.858 . . . . 1.35 109.759 -179.909 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' B' B ' 346' ' ' GLU . . . . . . . . . . . . . 20.4 tt0 -60.36 -28.29 68.07 Favored 'General case' 0 N--CA 1.489 1.525 0 O-C-N 121.385 -0.822 . . . . 1.66 109.916 -179.589 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' B' B ' 347' ' ' ALA . . . . . . . . . . . . . . . -60.7 -58.71 7.31 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.12 -0.988 . . . . 1.02 109.894 -179.732 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' B' B ' 348' ' ' LEU . . . . . 0.464 ' CD2' ' N ' ' B' ' 348' ' ' LEU . 4.0 mm? -62.1 -47.2 85.67 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.23 -0.918 . . . . 1.05 109.955 -179.563 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' B' B ' 349' ' ' GLU . . . . . . . . . . . . . 2.3 mt-10 -57.95 -29.05 64.87 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.233 -0.917 . . . . 1.95 109.967 -179.458 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' B' B ' 350' ' ' LEU . . . . . 0.471 ' C ' ' CD2' ' B' ' 350' ' ' LEU . 3.5 tt -64.17 -51.11 65.38 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.15 -0.969 . . . . 1.18 109.207 179.871 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' B' B ' 351' ' ' LYS . . . . . . . . . . . . . 24.1 tttt -59.81 -38.43 81.95 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.403 -0.811 . . . . 1.96 109.41 -179.938 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' B' B ' 352' ' ' ASP . . . . . . . . . . . . . 18.1 m-20 -57.07 -44.88 83.51 Favored 'General case' 0 N--CA 1.491 1.625 0 O-C-N 121.334 -0.854 . . . . 1.16 109.773 -179.971 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' B' B ' 353' ' ' ALA . . . . . . . . . . . . . . . -66.88 -19.9 65.82 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.208 -0.933 . . . . 1.21 109.742 -179.572 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' B' B ' 354' ' ' GLN . . . . . . . . . . . . . 1.6 mt-30 -84.23 -13.11 53.53 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.215 -0.928 . . . . 1.69 109.527 -179.973 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' B' B ' 355' ' ' ALA . . . . . . . . . . . . . . . -72.76 -7.27 49.8 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.247 -0.908 . . . . 1.3 109.63 179.967 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' B' B ' 356' ' ' GLY . . . . . . . . . . . . . . . -80.14 3.86 69.61 Favored Glycine 0 N--CA 1.491 2.333 0 N-CA-C 109.795 -1.322 . . . . 1.29 109.795 -179.92 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' B' B ' 357' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -87.07 105.63 17.3 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.213 -1.169 . . . . 4.45 109.526 -179.869 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' B' B ' 358' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -49.33 161.03 0.49 Allowed Pre-proline 0 N--CA 1.489 1.489 0 O-C-N 121.203 -0.936 . . . . 5.72 109.273 179.863 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' B' B ' 359' ' ' PRO . . . . . . . . . . . . . 4.1 Cg_exo -60.53 166.16 10.17 Favored 'Trans proline' 0 C--N 1.31 -1.49 0 C-N-CA 122.101 1.868 . . . . 5.6 110.046 179.854 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' B' B ' 360' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.232 0 CA-C-O 118.005 -1.442 . . . . 6.98 109.607 -179.993 . . . . . . . . 0 0 . 1 . 029 nuclear orig full ' C' C ' 319' ' ' LYS . . . . . . . . . . . . . 63.0 mttt . . . . . 0 N--CA 1.49 1.566 0 N-CA-C 109.412 -0.588 . . . . 7.03 109.412 . . . . . . . . . 0 0 . 1 . 029 nuclear orig full ' C' C ' 320' ' ' LYS . . . . . 0.418 ' HB3' ' HD3' ' C' ' 322' ' ' PRO . 0.0 OUTLIER 57.35 -172.16 0.09 Allowed 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.161 -0.962 . . . . 6.84 108.996 -179.74 . . . . . . . . 3 3 . 1 . 029 nuclear orig full ' C' C ' 321' ' ' LYS . . . . . 0.472 ' N ' ' HD3' ' C' ' 322' ' ' PRO . 0.0 OUTLIER -158.62 62.3 2.2 Favored Pre-proline 0 N--CA 1.49 1.533 0 O-C-N 121.018 -1.051 . . . . 6.78 110.043 -179.9 . . . . . . . . 3 3 . 1 . 029 nuclear orig full ' C' C ' 322' ' ' PRO . . . . . 0.472 ' HD3' ' N ' ' C' ' 321' ' ' LYS . 1.7 Cg_endo -62.73 -82.08 0.01 OUTLIER 'Trans proline' 0 C--N 1.309 -1.511 0 C-N-CA 122.051 1.834 . . . . 3.98 110.029 179.745 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' C' C ' 323' ' ' LEU . . . . . . . . . . . . . 44.7 mt -83.99 98.12 9.64 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.095 -1.003 . . . . 4.31 109.485 179.762 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' C' C ' 324' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -82.09 149.63 27.92 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.185 -0.947 . . . . 1.63 109.677 -179.847 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' C' C ' 325' ' ' GLY . . . . . 0.534 ' O ' ' CE2' ' C' ' 327' ' ' TYR . . . -69.26 169.97 42.59 Favored Glycine 0 N--CA 1.49 2.285 0 N-CA-C 109.416 -1.474 . . . . 0.82 109.416 179.718 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' C' C ' 326' ' ' GLU . . . . . . . . . . . . . 80.2 mm-40 -56.49 178.31 0.05 Allowed 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.171 -1.193 . . . . 2.17 109.146 179.901 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' C' C ' 327' ' ' TYR . . . . . 0.534 ' CE2' ' O ' ' C' ' 325' ' ' GLY . 55.5 m-85 -149.57 107.14 3.65 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.058 -1.026 . . . . 1.03 109.816 -179.744 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' C' C ' 328' ' ' PHE . . . . . 0.428 ' CE1' ' HA ' ' A' ' 335' ' ' ARG . 80.8 m-85 -107.16 -162.86 0.87 Allowed 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.126 -0.984 . . . . 0.37 109.36 179.663 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' C' C ' 329' ' ' THR . . . . . 0.418 ' HA ' ' O ' ' A' ' 330' ' ' LEU . 34.0 p -155.23 163.31 40.35 Favored 'General case' 0 N--CA 1.489 1.497 0 O-C-N 121.272 -0.892 . . . . 1.04 109.259 179.915 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' C' C ' 330' ' ' LEU . . . . . . . . . . . . . 48.5 tp -149.55 128.56 12.67 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.235 -0.916 . . . . 1.09 109.555 -179.767 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' C' C ' 331' ' ' GLN . . . . . . . . . . . . . 1.1 tt0 -86.29 117.72 25.28 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.231 -0.918 . . . . 1.48 109.251 179.881 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' C' C ' 332' ' ' ILE . . . . . . . . . . . . . 40.6 mt -103.38 112.36 36.57 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.557 0 O-C-N 121.244 -0.91 . . . . 1.08 109.714 -179.805 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' C' C ' 333' ' ' ARG . . . . . 0.53 ' HG2' ' CE1' ' A' ' 327' ' ' TYR . 0.1 OUTLIER -74.25 136.34 42.69 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.303 -0.873 . . . . 3.36 109.546 179.847 . . . . . . . . 3 3 . 1 . 029 nuclear orig full ' C' C ' 334' ' ' GLY . . . . . . . . . . . . . . . 87.52 132.81 3.79 Favored Glycine 0 N--CA 1.492 2.388 0 N-CA-C 109.741 -1.344 . . . . 0.35 109.741 179.692 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' C' C ' 335' ' ' ARG . . . . . 0.452 ' HG3' ' CZ ' ' A' ' 328' ' ' PHE . 1.8 tmm_? -80.43 -38.06 30.84 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.292 -1.122 . . . . 3.23 109.724 -179.971 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' C' C ' 336' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -56.44 -58.22 8.95 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.13 -0.981 . . . . 2.62 109.67 -179.831 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' C' C ' 337' ' ' ARG . . . . . 0.43 ' NH2' ' OD1' ' A' ' 352' ' ' ASP . 0.4 OUTLIER -60.63 -30.14 69.68 Favored 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.28 -0.887 . . . . 3.61 109.657 -179.803 . . . . . . . . 3 3 . 1 . 029 nuclear orig full ' C' C ' 338' ' ' PHE . . . . . 0.403 ' HB3' ' O ' ' C' ' 335' ' ' ARG . 61.1 t80 -56.01 -55.91 27.06 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.152 -0.968 . . . . 0.43 109.87 -179.841 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' C' C ' 339' ' ' GLU . . . . . . . . . . . . . 5.1 mt-10 -50.16 -34.14 21.39 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.11 -0.994 . . . . 2.05 109.887 -179.735 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' C' C ' 340' ' ' MET . . . . . . . . . . . . . 3.5 ttt -62.98 -50.2 71.7 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.118 -0.989 . . . . 1.1 109.889 -179.702 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' C' C ' 341' ' ' PHE . . . . . . . . . . . . . 37.1 m-85 -62.14 -49.62 75.15 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.087 -1.008 . . . . 0.21 110.113 -179.664 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' C' C ' 342' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -47.86 -38.71 16.79 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.222 -0.924 . . . . 3.42 110.011 -179.655 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' C' C ' 343' ' ' GLU . . . . . . . . . . . . . 2.5 tt0 -58.27 -49.47 77.03 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.143 -0.973 . . . . 2.14 109.579 -179.823 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' C' C ' 344' ' ' LEU . . . . . 0.443 HD23 ' CD2' ' D' ' 344' ' ' LEU . 81.3 mt -63.52 -33.52 75.76 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.257 -0.902 . . . . 1.09 109.836 -179.971 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' C' C ' 345' ' ' ASN . . . . . 0.418 ' C ' ' OD1' ' C' ' 345' ' ' ASN . 16.6 t-20 -57.5 -58.76 6.86 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.192 -0.942 . . . . 1.38 109.732 -179.791 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' C' C ' 346' ' ' GLU . . . . . . . . . . . . . 1.3 tt0 -60.46 -26.61 66.89 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.192 -0.943 . . . . 2.21 109.57 -179.603 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' C' C ' 347' ' ' ALA . . . . . . . . . . . . . . . -62.9 -56.69 15.0 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.185 -0.947 . . . . 1.03 109.738 179.923 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' C' C ' 348' ' ' LEU . . . . . 0.5 HD23 ' N ' ' C' ' 348' ' ' LEU . 4.2 mm? -61.73 -47.97 82.82 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.245 -0.909 . . . . 1.06 110.061 -179.672 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' C' C ' 349' ' ' GLU . . . . . . . . . . . . . 47.9 mm-40 -57.78 -34.6 69.75 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.25 -0.906 . . . . 2.19 110.269 -179.229 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' C' C ' 350' ' ' LEU . . . . . 0.455 HD23 HD23 ' D' ' 350' ' ' LEU . 5.4 tt -63.98 -45.88 87.07 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.11 -0.994 . . . . 1.2 109.221 -179.887 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' C' C ' 351' ' ' LYS . . . . . . . . . . . . . 12.7 tttp -60.15 -46.45 89.62 Favored 'General case' 0 N--CA 1.488 1.426 0 O-C-N 121.455 -0.778 . . . . 1.92 109.381 179.892 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' C' C ' 352' ' ' ASP . . . . . . . . . . . . . 76.6 m-20 -57.7 -37.93 74.34 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.351 -0.843 . . . . 1.19 109.565 -179.967 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' C' C ' 353' ' ' ALA . . . . . . . . . . . . . . . -67.67 -24.68 65.45 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.287 -0.883 . . . . 1.15 109.767 -179.809 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' C' C ' 354' ' ' GLN . . . . . . . . . . . . . 15.1 mt-30 -80.43 -5.55 56.7 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.198 -0.939 . . . . 1.7 109.512 179.89 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' C' C ' 355' ' ' ALA . . . . . . . . . . . . . . . -71.06 -3.39 19.49 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.174 -0.954 . . . . 1.3 109.794 179.992 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' C' C ' 356' ' ' GLY . . . . . . . . . . . . . . . -74.44 -45.0 25.49 Favored Glycine 0 N--CA 1.49 2.271 0 N-CA-C 109.643 -1.383 . . . . 1.33 109.643 -179.821 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' C' C ' 357' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -86.95 119.96 27.71 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.25 -1.147 . . . . 4.39 109.397 -179.98 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' C' C ' 358' ' ' GLU . . . . . 0.564 ' N ' ' HD2' ' C' ' 359' ' ' PRO . 7.8 tt0 -48.87 -52.22 48.14 Favored Pre-proline 0 N--CA 1.488 1.435 0 O-C-N 121.169 -0.957 . . . . 5.75 109.688 -179.953 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' C' C ' 359' ' ' PRO . . . . . 0.564 ' HD2' ' N ' ' C' ' 358' ' ' GLU . 1.9 Cg_endo -62.81 170.03 7.86 Favored 'Trans proline' 0 C--N 1.313 -1.296 0 C-N-CA 121.72 1.613 . . . . 5.54 110.036 179.709 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' C' C ' 360' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.243 0 CA-C-O 117.916 -1.491 . . . . 6.5 109.621 179.983 . . . . . . . . 0 0 . 1 . 029 nuclear orig full ' D' D ' 319' ' ' LYS . . . . . . . . . . . . . 8.2 tttt . . . . . 0 N--CA 1.491 1.6 0 N-CA-C 109.487 -0.56 . . . . 7.93 109.487 . . . . . . . . . 0 0 . 1 . 029 nuclear orig full ' D' D ' 320' ' ' LYS . . . . . . . . . . . . . 11.1 mttt 58.3 -159.21 0.28 Allowed 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.281 -0.887 . . . . 6.7 109.398 -179.963 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' D' D ' 321' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -158.94 110.88 1.58 Allowed Pre-proline 0 N--CA 1.49 1.55 0 O-C-N 121.335 -0.853 . . . . 6.49 109.536 -179.878 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' D' D ' 322' ' ' PRO . . . . . . . . . . . . . 6.2 Cg_exo -57.85 179.8 0.14 Allowed 'Trans proline' 0 C--N 1.312 -1.361 0 C-N-CA 121.828 1.686 . . . . 3.29 110.049 179.759 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' D' D ' 323' ' ' LEU . . . . . . . . . . . . . 20.2 mt -80.3 118.77 22.25 Favored 'General case' 0 N--CA 1.489 1.499 0 O-C-N 121.125 -0.984 . . . . 3.16 109.722 -179.811 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' D' D ' 324' ' ' ASP . . . . . . . . . . . . . 29.0 m-20 -78.46 -168.79 1.46 Allowed 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.298 -0.876 . . . . 1.54 109.274 179.738 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' D' D ' 325' ' ' GLY . . . . . . . . . . . . . . . -68.25 175.1 29.35 Favored Glycine 0 N--CA 1.49 2.245 0 N-CA-C 109.471 -1.452 . . . . 0.65 109.471 179.969 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' D' D ' 326' ' ' GLU . . . . . . . . . . . . . 2.4 mt-10 -56.68 -174.79 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.181 -1.188 . . . . 2.13 109.287 179.954 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' D' D ' 327' ' ' TYR . . . . . 0.477 ' CE1' ' HG2' ' B' ' 333' ' ' ARG . 47.2 m-85 -150.12 108.42 3.77 Favored 'General case' 0 N--CA 1.489 1.485 0 O-C-N 121.162 -0.961 . . . . 1.0 109.818 -179.803 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' D' D ' 328' ' ' PHE . . . . . 0.42 ' CE1' ' HA ' ' B' ' 335' ' ' ARG . 87.4 m-85 -108.25 -161.96 0.8 Allowed 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.302 -0.874 . . . . 0.34 109.433 179.771 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' D' D ' 329' ' ' THR . . . . . 0.46 ' HA ' ' O ' ' B' ' 330' ' ' LEU . 23.6 p -155.24 167.64 29.71 Favored 'General case' 0 N--CA 1.489 1.49 0 O-C-N 121.253 -0.905 . . . . 1.05 109.244 179.864 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' D' D ' 330' ' ' LEU . . . . . 0.43 ' O ' ' HA ' ' B' ' 329' ' ' THR . 24.0 tp -149.98 125.51 10.27 Favored 'General case' 0 N--CA 1.489 1.478 0 O-C-N 121.195 -0.941 . . . . 1.07 109.605 -179.951 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' D' D ' 331' ' ' GLN . . . . . . . . . . . . . 1.3 tt0 -87.03 115.6 24.52 Favored 'General case' 0 N--CA 1.488 1.471 0 O-C-N 121.245 -0.909 . . . . 0.93 109.23 179.837 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' D' D ' 332' ' ' ILE . . . . . 0.466 HD12 ' HB2' ' D' ' 341' ' ' PHE . 69.9 mt -103.55 114.24 42.59 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.507 0 O-C-N 121.177 -0.952 . . . . 1.07 109.537 -179.898 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' D' D ' 333' ' ' ARG . . . . . 0.448 ' HG2' ' CE1' ' B' ' 327' ' ' TYR . 32.9 mtt180 -72.83 151.98 41.76 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.321 -0.862 . . . . 3.42 109.391 179.835 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' D' D ' 334' ' ' GLY . . . . . . . . . . . . . . . 73.64 131.38 0.19 Allowed Glycine 0 N--CA 1.491 2.33 0 N-CA-C 109.546 -1.422 . . . . 0.41 109.546 179.902 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' D' D ' 335' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -77.45 -35.36 53.99 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.269 -1.136 . . . . 3.58 109.453 -179.986 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' D' D ' 336' ' ' GLU . . . . . . . . . . . . . 47.8 mt-10 -57.33 -61.6 2.36 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.251 -0.906 . . . . 2.26 109.647 -179.909 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' D' D ' 337' ' ' ARG . . . . . . . . . . . . . 1.9 mtp180 -60.18 -31.03 69.73 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.304 -0.873 . . . . 3.64 109.64 -179.755 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' D' D ' 338' ' ' PHE . . . . . . . . . . . . . 45.2 t80 -55.18 -60.72 3.0 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.301 -0.874 . . . . 0.4 109.279 179.909 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' D' D ' 339' ' ' GLU . . . . . . . . . . . . . 92.9 mt-10 -51.62 -27.86 12.58 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.401 -0.812 . . . . 1.99 109.565 179.988 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' D' D ' 340' ' ' MET . . . . . . . . . . . . . 28.0 ttp -64.73 -54.2 35.26 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.204 -0.935 . . . . 1.13 109.748 -179.953 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' D' D ' 341' ' ' PHE . . . . . 0.466 ' HB2' HD12 ' D' ' 332' ' ' ILE . 47.3 m-85 -61.78 -41.92 98.34 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.222 -0.924 . . . . 0.21 109.713 -179.728 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' D' D ' 342' ' ' ARG . . . . . . . . . . . . . 4.5 ttt180 -49.25 -41.77 38.61 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.264 -0.898 . . . . 3.15 109.563 -179.972 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' D' D ' 343' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -59.59 -46.64 88.34 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.361 -0.837 . . . . 2.35 109.63 -179.839 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' D' D ' 344' ' ' LEU . . . . . 0.45 ' O ' HD21 ' D' ' 348' ' ' LEU . 36.7 mt -61.99 -31.63 72.01 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.132 -0.98 . . . . 1.06 109.515 -179.939 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' D' D ' 345' ' ' ASN . . . . . . . . . . . . . 26.7 t-20 -58.07 -57.15 14.09 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.174 -0.954 . . . . 1.35 109.736 -179.868 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' D' D ' 346' ' ' GLU . . . . . . . . . . . . . 19.3 tt0 -60.75 -28.28 68.58 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.358 -0.839 . . . . 1.69 109.916 -179.542 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' D' D ' 347' ' ' ALA . . . . . . . . . . . . . . . -60.89 -58.56 7.91 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.189 -0.944 . . . . 1.03 109.83 -179.71 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' D' D ' 348' ' ' LEU . . . . . 0.46 ' CD2' ' N ' ' D' ' 348' ' ' LEU . 4.0 mm? -62.22 -47.01 86.3 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.19 -0.944 . . . . 1.04 109.98 -179.514 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' D' D ' 349' ' ' GLU . . . . . . . . . . . . . 2.4 mt-10 -58.25 -29.03 65.44 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.168 -0.957 . . . . 1.95 110.04 -179.493 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' D' D ' 350' ' ' LEU . . . . . 0.485 ' C ' ' CD2' ' D' ' 350' ' ' LEU . 3.5 tt -63.98 -50.87 66.86 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.141 -0.974 . . . . 1.16 109.235 179.818 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' D' D ' 351' ' ' LYS . . . . . . . . . . . . . 24.2 tttt -59.94 -38.53 82.67 Favored 'General case' 0 N--CA 1.489 1.487 0 O-C-N 121.44 -0.787 . . . . 1.97 109.47 179.915 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' D' D ' 352' ' ' ASP . . . . . . . . . . . . . 19.9 m-20 -57.19 -44.34 83.5 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.202 -0.936 . . . . 1.17 109.797 -179.94 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' D' D ' 353' ' ' ALA . . . . . . . . . . . . . . . -67.26 -20.2 65.62 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.232 -0.917 . . . . 1.21 109.743 -179.652 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' D' D ' 354' ' ' GLN . . . . . 0.439 ' NE2' HD13 ' C' ' 350' ' ' LEU . 1.5 mt-30 -84.08 -12.97 54.22 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.115 -0.991 . . . . 1.68 109.554 -179.925 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' D' D ' 355' ' ' ALA . . . . . . . . . . . . . . . -72.99 -7.26 50.37 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.232 -0.917 . . . . 1.29 109.61 179.925 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' D' D ' 356' ' ' GLY . . . . . . . . . . . . . . . -80.23 3.78 70.38 Favored Glycine 0 N--CA 1.491 2.349 0 N-CA-C 109.712 -1.355 . . . . 1.28 109.712 -179.888 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' D' D ' 357' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -87.0 105.71 17.33 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.244 -1.15 . . . . 4.45 109.597 -179.884 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' D' D ' 358' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -49.2 161.12 0.47 Allowed Pre-proline 0 N--CA 1.49 1.555 0 O-C-N 121.265 -0.897 . . . . 5.71 109.273 179.949 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' D' D ' 359' ' ' PRO . . . . . . . . . . . . . 3.4 Cg_exo -60.61 166.19 10.26 Favored 'Trans proline' 0 C--N 1.31 -1.476 0 C-N-CA 122.15 1.9 . . . . 5.6 109.959 179.771 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' D' D ' 360' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.294 0 CA-C-O 118.045 -1.42 . . . . 6.97 109.557 179.956 . . . . . . . . 0 0 . 1 . 030 nuclear orig full ' A' A ' 319' ' ' LYS . . . . . 0.414 ' O ' ' O ' ' A' ' 320' ' ' LYS . 26.7 mttp . . . . . 0 N--CA 1.49 1.528 0 N-CA-C 109.443 -0.576 . . . . 7.95 109.443 . . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 320' ' ' LYS . . . . . 0.414 ' O ' ' O ' ' A' ' 319' ' ' LYS . 0.4 OUTLIER 62.63 121.85 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.241 -0.912 . . . . 6.71 109.583 179.891 . . . . . . . . 3 3 . 1 . 030 nuclear orig full ' A' A ' 321' ' ' LYS . . . . . 0.462 ' CG ' ' O ' ' A' ' 321' ' ' LYS . 0.0 OUTLIER -156.68 88.84 2.7 Favored Pre-proline 0 N--CA 1.49 1.535 0 N-CA-C 108.877 -0.786 . . . . 6.5 108.877 179.812 . . . . . . . . 3 3 . 1 . 030 nuclear orig full ' A' A ' 322' ' ' PRO . . . . . . . . . . . . . 3.5 Cg_exo -59.11 133.33 52.42 Favored 'Trans proline' 0 C--N 1.311 -1.412 0 C-N-CA 122.126 1.884 . . . . 3.3 110.202 -179.448 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 323' ' ' LEU . . . . . . . . . . . . . 17.9 mt -80.51 124.94 29.36 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.326 -0.859 . . . . 3.16 109.264 -179.859 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 324' ' ' ASP . . . . . . . . . . . . . 3.8 m-20 -80.19 104.46 10.76 Favored 'General case' 0 N--CA 1.488 1.446 0 C-N-CA 119.813 -0.755 . . . . 1.53 109.308 -179.931 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 325' ' ' GLY . . . . . 0.573 ' O ' ' CD2' ' A' ' 327' ' ' TYR . . . -68.84 -164.55 3.5 Favored Glycine 0 N--CA 1.49 2.239 0 N-CA-C 109.494 -1.443 . . . . 0.67 109.494 -179.837 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 326' ' ' GLU . . . . . . . . . . . . . 8.6 mt-10 -59.73 165.21 3.18 Favored 'General case' 0 C--N 1.303 -1.446 0 O-C-N 121.316 -1.108 . . . . 2.13 109.457 -179.744 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 327' ' ' TYR . . . . . 0.573 ' CD2' ' O ' ' A' ' 325' ' ' GLY . 44.9 m-85 -149.08 107.96 3.87 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.082 -1.011 . . . . 1.0 109.885 -179.529 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 328' ' ' PHE . . . . . 0.454 ' O ' HG21 ' A' ' 329' ' ' THR . 18.4 m-85 -112.88 -166.72 1.1 Allowed 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.341 -0.849 . . . . 0.34 109.389 179.912 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 329' ' ' THR . . . . . 0.454 HG21 ' O ' ' A' ' 328' ' ' PHE . 13.6 p -153.88 169.53 23.19 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.431 -0.793 . . . . 1.05 109.012 179.98 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 330' ' ' LEU . . . . . . . . . . . . . 18.2 tp -151.51 134.23 15.61 Favored 'General case' 0 C--N 1.302 -1.457 0 O-C-N 121.176 -0.952 . . . . 1.07 109.561 179.758 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 331' ' ' GLN . . . . . . . . . . . . . 2.1 tp60 -86.66 114.19 23.16 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.204 -0.935 . . . . 0.91 109.413 179.835 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 332' ' ' ILE . . . . . 0.502 ' CG2' ' HA ' ' A' ' 338' ' ' PHE . 64.0 mt -103.17 101.65 12.5 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.392 0 O-C-N 121.323 -0.861 . . . . 1.09 109.331 179.835 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 333' ' ' ARG . . . . . . . . . . . . . 57.3 mtt180 -71.86 152.72 42.4 Favored 'General case' 0 N--CA 1.487 1.409 0 O-C-N 121.403 -0.81 . . . . 3.41 109.829 -179.516 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 334' ' ' GLY . . . . . . . . . . . . . . . 76.27 131.36 0.39 Allowed Glycine 0 N--CA 1.489 2.224 0 N-CA-C 109.813 -1.315 . . . . 0.4 109.813 179.974 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 335' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -74.61 -34.85 62.91 Favored 'General case' 0 N--CA 1.488 1.449 0 O-C-N 121.181 -1.188 . . . . 3.55 109.743 -179.867 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 336' ' ' GLU . . . . . . . . . . . . . 15.1 mt-10 -58.82 -58.35 9.0 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.195 -0.941 . . . . 2.29 109.777 -179.864 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 337' ' ' ARG . . . . . . . . . . . . . 5.8 mmt180 -60.73 -36.2 78.26 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.082 -1.011 . . . . 3.64 109.754 -179.783 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 338' ' ' PHE . . . . . 0.502 ' HA ' ' CG2' ' A' ' 332' ' ' ILE . 59.7 t80 -53.89 -60.89 2.74 Favored 'General case' 0 C--N 1.302 -1.486 0 O-C-N 120.95 -1.094 . . . . 0.41 109.419 179.978 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 339' ' ' GLU . . . . . . . . . . . . . 73.8 mt-10 -49.44 -36.31 22.05 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.384 -0.823 . . . . 1.97 110.64 -179.432 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 340' ' ' MET . . . . . . . . . . . . . 48.2 ttp -63.28 -49.65 73.21 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 120.979 -1.076 . . . . 1.14 110.145 -179.417 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 341' ' ' PHE . . . . . . . . . . . . . 52.7 m-85 -62.52 -46.17 89.62 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.308 -0.87 . . . . 0.21 109.636 -179.546 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 342' ' ' ARG . . . . . . . . . . . . . 12.6 ttp180 -47.43 -43.89 24.27 Favored 'General case' 0 N--CA 1.493 1.711 0 O-C-N 121.401 -0.812 . . . . 3.15 109.928 -179.579 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 343' ' ' GLU . . . . . . . . . . . . . 29.1 tt0 -58.6 -48.51 80.71 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.372 -0.83 . . . . 2.35 109.869 -179.517 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 344' ' ' LEU . . . . . . . . . . . . . 55.3 mt -60.97 -30.79 70.47 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.196 -0.94 . . . . 1.06 109.566 -179.671 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 345' ' ' ASN . . . . . . . . . . . . . 11.3 t-20 -57.8 -59.59 5.0 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.252 -0.905 . . . . 1.36 109.635 -179.943 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 346' ' ' GLU . . . . . . . . . . . . . 79.4 tt0 -60.01 -24.78 64.76 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.148 -0.97 . . . . 1.65 109.652 -179.767 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 347' ' ' ALA . . . . . . . . . . . . . . . -61.84 -61.61 2.38 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.376 -0.827 . . . . 1.03 109.75 179.809 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 348' ' ' LEU . . . . . 0.456 ' N ' HD23 ' A' ' 348' ' ' LEU . 3.8 mm? -61.39 -46.67 89.19 Favored 'General case' 0 N--CA 1.495 1.812 0 O-C-N 121.31 -0.869 . . . . 1.04 109.868 -179.604 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 349' ' ' GLU . . . . . . . . . . . . . 25.8 mm-40 -56.44 -34.0 66.4 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.235 -0.916 . . . . 1.94 109.736 -179.456 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 350' ' ' LEU . . . . . 0.491 HD23 HD23 ' B' ' 350' ' ' LEU . 5.8 tt -62.5 -47.03 85.76 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.197 -0.939 . . . . 1.17 109.02 -179.936 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 351' ' ' LYS . . . . . . . . . . . . . 6.3 tttt -57.44 -43.36 83.83 Favored 'General case' 0 C--N 1.302 -1.489 0 O-C-N 121.329 -0.857 . . . . 1.97 109.385 179.621 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 352' ' ' ASP . . . . . 0.434 ' O ' ' HB1' ' A' ' 355' ' ' ALA . 23.1 m-20 -55.87 -40.1 72.46 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.275 -0.891 . . . . 1.16 109.397 179.857 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 353' ' ' ALA . . . . . . . . . . . . . . . -69.01 -26.65 65.11 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.37 -0.831 . . . . 1.22 109.736 -179.901 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 354' ' ' GLN . . . . . . . . . . . . . 5.1 tt0 -80.57 -4.62 54.74 Favored 'General case' 0 N--CA 1.495 1.782 0 O-C-N 121.116 -0.99 . . . . 1.71 109.877 -179.893 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 355' ' ' ALA . . . . . 0.434 ' HB1' ' O ' ' A' ' 352' ' ' ASP . . . -69.77 -89.42 0.02 OUTLIER 'General case' 0 N--CA 1.494 1.753 0 O-C-N 121.304 -0.873 . . . . 1.3 109.214 179.875 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 356' ' ' GLY . . . . . . . . . . . . . . . -67.47 103.72 1.01 Allowed Glycine 0 N--CA 1.488 2.121 0 N-CA-C 109.418 -1.473 . . . . 1.3 109.418 179.74 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 357' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -85.99 122.08 29.53 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.277 -1.131 . . . . 4.46 109.536 -179.967 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 358' ' ' GLU . . . . . . . . . . . . . 6.5 mm-40 -49.15 118.03 7.23 Favored Pre-proline 0 N--CA 1.494 1.772 0 O-C-N 121.438 -0.789 . . . . 5.75 109.577 -179.83 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 359' ' ' PRO . . . . . . . . . . . . . 2.8 Cg_endo -61.85 145.28 97.16 Favored 'Trans proline' 0 C--N 1.313 -1.318 0 C-N-CA 121.98 1.787 . . . . 5.63 109.982 179.935 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 360' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.252 0 N-CA-C 109.532 -1.427 . . . . 6.97 109.532 179.815 . . . . . . . . 0 0 . 1 . 030 nuclear orig full ' B' B ' 319' ' ' LYS . . . . . . . . . . . . . 25.4 mttp . . . . . 0 N--CA 1.495 1.809 0 N-CA-C 109.149 -0.685 . . . . 7.95 109.149 . . . . . . . . . 0 0 . 1 . 030 nuclear orig full ' B' B ' 320' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER 63.74 119.22 0.02 OUTLIER 'General case' 0 C--N 1.3 -1.551 0 O-C-N 121.24 -0.912 . . . . 6.73 109.734 179.783 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' B' B ' 321' ' ' LYS . . . . . 0.496 ' CD ' ' O ' ' B' ' 321' ' ' LYS . 0.0 OUTLIER -156.44 87.73 2.87 Favored Pre-proline 0 N--CA 1.489 1.5 0 O-C-N 121.355 -0.841 . . . . 6.5 108.992 179.884 . . . . . . . . 3 3 . 1 . 030 nuclear orig full ' B' B ' 322' ' ' PRO . . . . . . . . . . . . . 4.2 Cg_exo -58.83 134.22 58.96 Favored 'Trans proline' 0 C--N 1.31 -1.461 0 C-N-CA 122.151 1.901 . . . . 3.29 110.335 -179.705 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' B' B ' 323' ' ' LEU . . . . . . . . . . . . . 17.2 mt -81.33 124.59 29.49 Favored 'General case' 0 C--N 1.301 -1.526 0 O-C-N 121.349 -0.844 . . . . 3.18 109.332 -179.687 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' B' B ' 324' ' ' ASP . . . . . . . . . . . . . 2.9 m-20 -79.67 104.48 10.29 Favored 'General case' 0 N--CA 1.487 1.385 0 O-C-N 121.374 -0.829 . . . . 1.53 109.444 179.981 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' B' B ' 325' ' ' GLY . . . . . 0.567 ' O ' ' CD2' ' B' ' 327' ' ' TYR . . . -67.88 -165.24 2.97 Favored Glycine 0 N--CA 1.489 2.176 0 N-CA-C 109.404 -1.478 . . . . 0.65 109.404 179.942 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' B' B ' 326' ' ' GLU . . . . . . . . . . . . . 6.2 mt-10 -59.23 165.84 2.46 Favored 'General case' 0 N--CA 1.489 1.48 0 O-C-N 121.218 -1.166 . . . . 2.13 109.282 179.795 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' B' B ' 327' ' ' TYR . . . . . 0.567 ' CD2' ' O ' ' B' ' 325' ' ' GLY . 41.3 m-85 -149.37 108.94 3.99 Favored 'General case' 0 C--N 1.303 -1.429 0 O-C-N 121.324 -0.86 . . . . 0.99 109.684 -179.843 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' B' B ' 328' ' ' PHE . . . . . 0.449 ' O ' HG21 ' B' ' 329' ' ' THR . 18.9 m-85 -113.0 -166.96 1.13 Allowed 'General case' 0 C--N 1.302 -1.476 0 O-C-N 121.273 -0.892 . . . . 0.36 109.366 179.964 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' B' B ' 329' ' ' THR . . . . . 0.449 HG21 ' O ' ' B' ' 328' ' ' PHE . 16.5 p -153.9 169.2 24.01 Favored 'General case' 0 N--CA 1.488 1.463 0 O-C-N 121.351 -0.843 . . . . 1.05 108.994 179.611 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' B' B ' 330' ' ' LEU . . . . . . . . . . . . . 18.1 tp -151.53 134.42 15.73 Favored 'General case' 0 N--CA 1.491 1.625 0 O-C-N 121.334 -0.854 . . . . 1.07 109.673 179.796 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' B' B ' 331' ' ' GLN . . . . . . . . . . . . . 2.1 tp60 -86.94 114.58 23.69 Favored 'General case' 0 C--N 1.302 -1.47 0 O-C-N 121.416 -0.803 . . . . 0.91 109.66 179.672 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' B' B ' 332' ' ' ILE . . . . . 0.467 ' CG2' ' HA ' ' B' ' 338' ' ' PHE . 58.0 mt -103.03 101.93 12.89 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.458 0 O-C-N 121.245 -0.909 . . . . 1.08 109.181 179.751 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' B' B ' 333' ' ' ARG . . . . . . . . . . . . . 54.7 mtt180 -72.1 152.14 42.56 Favored 'General case' 0 N--CA 1.488 1.456 0 O-C-N 121.259 -0.901 . . . . 3.42 109.613 -179.71 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' B' B ' 334' ' ' GLY . . . . . . . . . . . . . . . 77.51 130.42 0.49 Allowed Glycine 0 N--CA 1.491 2.33 0 N-CA-C 109.795 -1.322 . . . . 0.4 109.795 179.735 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' B' B ' 335' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -74.22 -34.56 63.73 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.165 -1.197 . . . . 3.55 109.759 179.9 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' B' B ' 336' ' ' GLU . . . . . . . . . . . . . 11.4 mt-10 -59.22 -58.28 9.34 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.199 -0.938 . . . . 2.28 109.688 -179.697 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' B' B ' 337' ' ' ARG . . . . . . . . . . . . . 5.1 mmt180 -60.81 -36.13 78.28 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.441 -0.787 . . . . 3.64 109.655 -179.674 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' B' B ' 338' ' ' PHE . . . . . 0.467 ' HA ' ' CG2' ' B' ' 332' ' ' ILE . 62.7 t80 -54.23 -60.07 3.83 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.233 -0.917 . . . . 0.39 109.435 179.884 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' B' B ' 339' ' ' GLU . . . . . . . . . . . . . 80.8 mt-10 -49.9 -36.56 27.91 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.262 -0.899 . . . . 1.98 110.379 -179.64 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' B' B ' 340' ' ' MET . . . . . . . . . . . . . 47.9 ttp -63.38 -50.32 70.35 Favored 'General case' 0 N--CA 1.494 1.76 0 O-C-N 121.088 -1.008 . . . . 1.14 110.278 -179.387 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' B' B ' 341' ' ' PHE . . . . . . . . . . . . . 54.5 m-85 -62.24 -45.72 92.05 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.128 -0.983 . . . . 0.22 109.998 -179.707 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' B' B ' 342' ' ' ARG . . . . . . . . . . . . . 13.0 ttp180 -47.59 -43.75 25.81 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.329 -0.857 . . . . 3.15 109.849 -179.931 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' B' B ' 343' ' ' GLU . . . . . . . . . . . . . 30.6 tt0 -58.84 -48.91 79.67 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.417 -0.802 . . . . 2.35 109.68 -179.578 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' B' B ' 344' ' ' LEU . . . . . . . . . . . . . 52.9 mt -60.97 -29.96 69.97 Favored 'General case' 0 N--CA 1.489 1.486 0 O-C-N 121.021 -1.049 . . . . 1.05 109.576 -179.538 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' B' B ' 345' ' ' ASN . . . . . . . . . . . . . 11.2 t-20 -58.13 -59.99 4.44 Favored 'General case' 0 N--CA 1.489 1.493 0 O-C-N 121.248 -0.908 . . . . 1.35 109.702 179.875 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' B' B ' 346' ' ' GLU . . . . . . . . . . . . . 86.1 tt0 -60.16 -24.14 64.5 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.253 -0.904 . . . . 1.66 109.382 -179.724 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' B' B ' 347' ' ' ALA . . . . . . . . . . . . . . . -62.18 -61.8 2.21 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.147 -0.97 . . . . 1.02 109.967 -179.829 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' B' B ' 348' ' ' LEU . . . . . 0.475 ' N ' HD23 ' B' ' 348' ' ' LEU . 3.8 mm? -61.26 -45.77 93.14 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.325 -0.86 . . . . 1.05 109.824 -179.722 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' B' B ' 349' ' ' GLU . . . . . . . . . . . . . 27.6 mm-40 -56.68 -33.49 66.47 Favored 'General case' 0 N--CA 1.494 1.762 0 O-C-N 121.399 -0.813 . . . . 1.95 109.832 -179.399 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' B' B ' 350' ' ' LEU . . . . . 0.493 HD22 ' O ' ' B' ' 350' ' ' LEU . 5.7 tt -63.53 -46.75 84.59 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.381 -0.824 . . . . 1.18 108.847 -179.943 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' B' B ' 351' ' ' LYS . . . . . . . . . . . . . 5.7 tttt -57.62 -44.04 85.25 Favored 'General case' 0 C--N 1.302 -1.481 0 O-C-N 121.449 -0.782 . . . . 1.96 109.022 179.584 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' B' B ' 352' ' ' ASP . . . . . 0.414 ' O ' ' HB1' ' B' ' 355' ' ' ALA . 25.2 m-20 -55.3 -39.55 70.05 Favored 'General case' 0 N--CA 1.488 1.456 0 O-C-N 121.389 -0.82 . . . . 1.16 109.502 179.82 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' B' B ' 353' ' ' ALA . . . . . . . . . . . . . . . -69.53 -26.45 64.53 Favored 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.454 -0.779 . . . . 1.21 109.889 -179.898 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' B' B ' 354' ' ' GLN . . . . . . . . . . . . . 4.6 tt0 -81.25 -3.94 53.96 Favored 'General case' 0 C--N 1.302 -1.479 0 O-C-N 120.954 -1.091 . . . . 1.69 109.798 -179.91 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' B' B ' 355' ' ' ALA . . . . . 0.414 ' HB1' ' O ' ' B' ' 352' ' ' ASP . . . -68.95 -89.53 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.158 -0.963 . . . . 1.3 109.533 179.965 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' B' B ' 356' ' ' GLY . . . . . . . . . . . . . . . -68.26 105.15 1.35 Allowed Glycine 0 N--CA 1.488 2.101 0 N-CA-C 109.394 -1.482 . . . . 1.29 109.394 179.997 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' B' B ' 357' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -86.5 122.93 31.12 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.19 -1.182 . . . . 4.45 109.682 -179.896 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' B' B ' 358' ' ' GLU . . . . . . . . . . . . . 6.0 mm-40 -49.52 117.94 7.61 Favored Pre-proline 0 N--CA 1.491 1.607 0 O-C-N 121.336 -0.852 . . . . 5.72 109.676 179.955 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' B' B ' 359' ' ' PRO . . . . . . . . . . . . . 2.6 Cg_endo -61.66 149.18 90.96 Favored 'Trans proline' 0 C--N 1.314 -1.277 0 C-N-CA 122.063 1.842 . . . . 5.6 109.979 179.824 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' B' B ' 360' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.493 2.461 0 CA-C-O 117.945 -1.475 . . . . 6.98 109.586 -179.986 . . . . . . . . 0 0 . 1 . 030 nuclear orig full ' C' C ' 319' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.494 1.733 0 N-CA-C 109.185 -0.672 . . . . 7.03 109.185 . . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' C' C ' 320' ' ' LYS . . . . . . . . . . . . . 6.7 tttt 62.41 81.34 0.2 Allowed 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.24 -0.913 . . . . 6.84 109.105 -179.657 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' C' C ' 321' ' ' LYS . . . . . . . . . . . . . 2.6 mttt -156.71 69.16 4.63 Favored Pre-proline 0 N--CA 1.493 1.686 0 O-C-N 121.075 -1.016 . . . . 6.78 109.704 -179.762 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' C' C ' 322' ' ' PRO . . . . . . . . . . . . . 6.0 Cg_exo -58.51 97.76 0.09 OUTLIER 'Trans proline' 0 C--N 1.31 -1.467 0 C-N-CA 122.277 1.984 . . . . 3.98 109.759 179.926 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' C' C ' 323' ' ' LEU . . . . . . . . . . . . . 26.8 mt -81.09 129.03 34.37 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.326 -0.859 . . . . 4.31 109.871 -179.511 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' C' C ' 324' ' ' ASP . . . . . . . . . . . . . 94.7 m-20 -80.32 103.45 10.2 Favored 'General case' 0 N--CA 1.489 1.5 0 O-C-N 121.337 -0.852 . . . . 1.63 109.652 179.767 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' C' C ' 325' ' ' GLY . . . . . 0.578 ' O ' ' CD2' ' C' ' 327' ' ' TYR . . . -70.44 -161.17 3.53 Favored Glycine 0 N--CA 1.493 2.481 0 N-CA-C 109.52 -1.432 . . . . 0.82 109.52 179.792 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' C' C ' 326' ' ' GLU . . . . . . . . . . . . . 2.9 mp0 -60.2 163.51 4.89 Favored 'General case' 0 C--N 1.303 -1.422 0 O-C-N 121.239 -1.154 . . . . 2.17 109.433 179.838 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' C' C ' 327' ' ' TYR . . . . . 0.578 ' CD2' ' O ' ' C' ' 325' ' ' GLY . 49.5 m-85 -150.75 114.19 4.89 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.062 -1.024 . . . . 1.03 109.835 179.752 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' C' C ' 328' ' ' PHE . . . . . . . . . . . . . 79.5 m-85 -113.38 -167.81 1.25 Allowed 'General case' 0 N--CA 1.488 1.466 0 O-C-N 121.217 -0.927 . . . . 0.37 109.491 179.542 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' C' C ' 329' ' ' THR . . . . . . . . . . . . . 4.4 p -153.91 161.84 41.69 Favored 'General case' 0 C--N 1.301 -1.508 0 O-C-N 121.068 -1.02 . . . . 1.04 109.536 -179.881 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' C' C ' 330' ' ' LEU . . . . . . . . . . . . . 15.0 tp -149.24 129.43 13.65 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.291 -0.881 . . . . 1.09 109.671 -179.703 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' C' C ' 331' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -87.15 119.88 27.85 Favored 'General case' 0 N--CA 1.487 1.4 0 O-C-N 121.334 -0.854 . . . . 1.48 109.229 179.632 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' C' C ' 332' ' ' ILE . . . . . 0.541 HD12 ' CD2' ' C' ' 341' ' ' PHE . 14.1 mt -103.23 105.89 19.12 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.574 0 O-C-N 121.18 -0.95 . . . . 1.08 109.299 179.915 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' C' C ' 333' ' ' ARG . . . . . 0.564 ' HG2' ' CE1' ' A' ' 327' ' ' TYR . 8.3 mtt180 -72.65 134.9 45.32 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.228 -0.92 . . . . 3.36 109.155 179.624 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' C' C ' 334' ' ' GLY . . . . . . . . . . . . . . . 92.78 134.79 6.94 Favored Glycine 0 N--CA 1.489 2.176 0 N-CA-C 109.714 -1.354 . . . . 0.35 109.714 179.959 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' C' C ' 335' ' ' ARG . . . . . . . . . . . . . 6.7 tpt180 -80.33 -34.25 36.83 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.502 -0.999 . . . . 3.23 109.319 179.922 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' C' C ' 336' ' ' GLU . . . . . . . . . . . . . 1.3 tt0 -57.96 -61.45 2.53 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.189 -0.945 . . . . 2.62 109.69 -179.974 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' C' C ' 337' ' ' ARG . . . . . . . . . . . . . 3.0 mtt180 -59.19 -28.57 66.76 Favored 'General case' 0 N--CA 1.487 1.384 0 O-C-N 121.065 -1.022 . . . . 3.61 109.553 -179.91 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' C' C ' 338' ' ' PHE . . . . . 0.471 ' HA ' HD11 ' C' ' 332' ' ' ILE . 48.4 t80 -55.21 -62.4 1.69 Allowed 'General case' 0 N--CA 1.487 1.389 0 O-C-N 121.275 -0.891 . . . . 0.43 109.61 179.887 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' C' C ' 339' ' ' GLU . . . . . . . . . . . . . 1.3 mm-40 -49.79 -31.44 11.63 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 120.994 -1.066 . . . . 2.05 109.662 -179.819 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' C' C ' 340' ' ' MET . . . . . . . . . . . . . 24.2 ttp -63.27 -57.38 10.62 Favored 'General case' 0 N--CA 1.488 1.462 0 O-C-N 121.271 -0.893 . . . . 1.1 110.35 -179.429 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' C' C ' 341' ' ' PHE . . . . . 0.541 ' CD2' HD12 ' C' ' 332' ' ' ILE . 51.7 m-85 -61.57 -47.87 83.54 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.004 -1.06 . . . . 0.21 109.715 -179.575 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' C' C ' 342' ' ' ARG . . . . . 0.431 ' NH1' ' CG ' ' C' ' 342' ' ' ARG . 0.0 OUTLIER -47.15 -40.93 16.76 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.556 -0.715 . . . . 3.42 109.947 -179.983 . . . . . . . . 3 3 . 1 . 030 nuclear orig full ' C' C ' 343' ' ' GLU . . . . . 0.441 ' HA ' ' OE1' ' C' ' 343' ' ' GLU . 4.6 tp10 -60.1 -48.73 80.51 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.236 -0.915 . . . . 2.14 109.611 -179.951 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' C' C ' 344' ' ' LEU . . . . . 0.461 ' O ' HD21 ' C' ' 348' ' ' LEU . 28.7 mt -62.18 -31.1 71.57 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.324 -0.86 . . . . 1.09 109.47 -179.899 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' C' C ' 345' ' ' ASN . . . . . . . . . . . . . 8.8 t-20 -57.57 -50.53 72.79 Favored 'General case' 0 C--N 1.301 -1.529 0 O-C-N 121.16 -0.962 . . . . 1.38 109.258 -179.928 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' C' C ' 346' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -63.9 -33.43 75.69 Favored 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.247 -0.908 . . . . 2.21 109.85 -179.849 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' C' C ' 347' ' ' ALA . . . . . . . . . . . . . . . -61.26 -60.1 4.27 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.225 -0.922 . . . . 1.03 110.285 -179.459 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' C' C ' 348' ' ' LEU . . . . . 0.461 HD21 ' O ' ' C' ' 344' ' ' LEU . 3.8 mm? -59.0 -44.45 91.67 Favored 'General case' 0 N--CA 1.488 1.472 0 O-C-N 121.154 -0.966 . . . . 1.06 109.814 -179.025 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' C' C ' 349' ' ' GLU . . . . . . . . . . . . . 20.2 mt-10 -58.61 -34.4 71.1 Favored 'General case' 0 N--CA 1.489 1.525 0 O-C-N 121.094 -1.004 . . . . 2.19 109.735 -179.751 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' C' C ' 350' ' ' LEU . . . . . 0.539 HD23 ' CD1' ' D' ' 350' ' ' LEU . 4.9 tt -64.07 -46.78 82.79 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.304 -0.872 . . . . 1.2 109.459 -179.713 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' C' C ' 351' ' ' LYS . . . . . 0.515 ' N ' HD21 ' C' ' 350' ' ' LEU . 3.5 tttt -61.16 -44.02 97.97 Favored 'General case' 0 C--N 1.301 -1.531 0 O-C-N 121.408 -0.807 . . . . 1.92 109.587 -179.79 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' C' C ' 352' ' ' ASP . . . . . . . . . . . . . 56.2 m-20 -55.76 -47.0 77.75 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.353 -0.842 . . . . 1.19 109.951 -179.696 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' C' C ' 353' ' ' ALA . . . . . . . . . . . . . . . -68.31 -19.26 64.66 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.309 -0.869 . . . . 1.15 109.709 -179.578 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' C' C ' 354' ' ' GLN . . . . . . . . . . . . . 3.2 mt-30 -80.45 -3.42 49.79 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.07 -1.019 . . . . 1.7 109.449 179.659 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' C' C ' 355' ' ' ALA . . . . . . . . . . . . . . . -68.02 -87.98 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.353 -0.842 . . . . 1.3 109.878 -179.664 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' C' C ' 356' ' ' GLY . . . . . . . . . . . . . . . -77.83 89.98 1.07 Allowed Glycine 0 N--CA 1.492 2.425 0 N-CA-C 109.669 -1.372 . . . . 1.33 109.669 -179.926 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' C' C ' 357' ' ' LYS . . . . . . . . . . . . . 8.8 tptp -88.09 133.57 33.96 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.41 -1.053 . . . . 4.39 109.26 179.816 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' C' C ' 358' ' ' GLU . . . . . 0.442 ' HG2' ' HD2' ' C' ' 359' ' ' PRO . 0.1 OUTLIER -50.11 134.12 22.91 Favored Pre-proline 0 C--N 1.304 -1.385 0 O-C-N 121.402 -0.811 . . . . 5.75 109.303 179.864 . . . . . . . . 3 3 . 1 . 030 nuclear orig full ' C' C ' 359' ' ' PRO . . . . . 0.442 ' HD2' ' HG2' ' C' ' 358' ' ' GLU . 2.8 Cg_endo -63.07 112.38 1.67 Allowed 'Trans proline' 0 C--N 1.312 -1.383 0 C-N-CA 122.029 1.819 . . . . 5.54 110.015 179.96 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' C' C ' 360' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.364 0 N-CA-C 109.213 -1.555 . . . . 6.5 109.213 179.837 . . . . . . . . 0 0 . 1 . 030 nuclear orig full ' D' D ' 319' ' ' LYS . . . . . . . . . . . . . 20.9 mttp . . . . . 0 N--CA 1.491 1.596 0 CA-C-O 121.227 0.537 . . . . 7.93 109.681 . . . . . . . . . 0 0 . 1 . 030 nuclear orig full ' D' D ' 320' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER 64.32 120.83 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.424 -0.797 . . . . 6.7 109.218 179.828 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' D' D ' 321' ' ' LYS . . . . . 0.488 ' O ' ' CG ' ' D' ' 321' ' ' LYS . 0.0 OUTLIER -157.21 87.69 2.65 Favored Pre-proline 0 N--CA 1.492 1.64 0 O-C-N 121.168 -0.957 . . . . 6.49 109.268 179.989 . . . . . . . . 3 3 . 1 . 030 nuclear orig full ' D' D ' 322' ' ' PRO . . . . . . . . . . . . . 4.2 Cg_exo -58.45 135.77 69.96 Favored 'Trans proline' 0 C--N 1.307 -1.644 0 C-N-CA 122.16 1.906 . . . . 3.29 110.426 -179.407 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' D' D ' 323' ' ' LEU . . . . . . . . . . . . . 19.1 mt -82.32 125.37 30.91 Favored 'General case' 0 C--N 1.303 -1.454 0 O-C-N 121.336 -0.852 . . . . 3.16 109.499 -179.805 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' D' D ' 324' ' ' ASP . . . . . . . . . . . . . 2.5 m-20 -80.35 103.82 10.48 Favored 'General case' 0 C--N 1.304 -1.409 0 C-N-CA 119.726 -0.79 . . . . 1.54 109.026 -179.999 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' D' D ' 325' ' ' GLY . . . . . 0.561 ' O ' ' CD2' ' D' ' 327' ' ' TYR . . . -68.51 -163.86 2.97 Favored Glycine 0 N--CA 1.493 2.49 0 N-CA-C 109.582 -1.407 . . . . 0.65 109.582 -179.955 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' D' D ' 326' ' ' GLU . . . . . . . . . . . . . 5.7 mt-10 -59.28 164.78 3.01 Favored 'General case' 0 N--CA 1.489 1.501 0 O-C-N 121.283 -1.128 . . . . 2.13 109.496 -179.864 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' D' D ' 327' ' ' TYR . . . . . 0.561 ' CD2' ' O ' ' D' ' 325' ' ' GLY . 41.3 m-85 -148.35 109.13 4.22 Favored 'General case' 0 C--N 1.302 -1.484 0 O-C-N 121.072 -1.018 . . . . 1.0 109.407 179.949 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' D' D ' 328' ' ' PHE . . . . . 0.419 ' O ' HG21 ' D' ' 329' ' ' THR . 18.6 m-85 -113.9 -167.88 1.27 Allowed 'General case' 0 N--CA 1.489 1.49 0 O-C-N 121.158 -0.964 . . . . 0.34 109.125 -179.802 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' D' D ' 329' ' ' THR . . . . . 0.419 HG21 ' O ' ' D' ' 328' ' ' PHE . 15.2 p -153.58 169.35 23.44 Favored 'General case' 0 C--N 1.302 -1.49 0 O-C-N 121.373 -0.829 . . . . 1.05 108.855 -179.902 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' D' D ' 330' ' ' LEU . . . . . . . . . . . . . 20.7 tp -151.78 134.48 15.54 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.44 -0.788 . . . . 1.07 109.686 -179.909 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' D' D ' 331' ' ' GLN . . . . . . . . . . . . . 3.3 tp60 -87.19 114.54 23.89 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.526 -0.733 . . . . 0.93 109.583 179.714 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' D' D ' 332' ' ' ILE . . . . . 0.454 HG23 ' HA ' ' D' ' 338' ' ' PHE . 57.8 mt -103.25 101.68 12.54 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.475 0 O-C-N 121.348 -0.845 . . . . 1.07 109.079 179.85 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' D' D ' 333' ' ' ARG . . . . . 0.404 ' HD3' ' CE1' ' B' ' 327' ' ' TYR . 47.0 mtt180 -72.17 153.42 41.64 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.322 -0.861 . . . . 3.42 109.733 -179.72 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' D' D ' 334' ' ' GLY . . . . . . . . . . . . . . . 76.38 131.33 0.4 Allowed Glycine 0 N--CA 1.492 2.378 0 N-CA-C 109.588 -1.405 . . . . 0.41 109.588 179.672 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' D' D ' 335' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -75.31 -35.15 61.29 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.222 -1.164 . . . . 3.58 109.762 179.994 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' D' D ' 336' ' ' GLU . . . . . . . . . . . . . 9.7 mt-10 -58.46 -58.01 10.42 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.131 -0.981 . . . . 2.26 109.716 -179.937 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' D' D ' 337' ' ' ARG . . . . . . . . . . . . . 5.9 mmt180 -60.81 -35.46 76.57 Favored 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.099 -1.001 . . . . 3.64 109.865 179.927 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' D' D ' 338' ' ' PHE . . . . . 0.454 ' HA ' HG23 ' D' ' 332' ' ' ILE . 65.6 t80 -54.99 -59.47 4.7 Favored 'General case' 0 N--CA 1.487 1.376 0 O-C-N 121.082 -1.011 . . . . 0.4 109.364 179.998 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' D' D ' 339' ' ' GLU . . . . . . . . . . . . . 78.1 mt-10 -50.09 -36.5 29.7 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.592 -0.693 . . . . 1.99 110.485 -179.43 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' D' D ' 340' ' ' MET . . . . . . . . . . . . . 43.5 ttp -64.39 -50.49 67.45 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.078 -1.014 . . . . 1.13 110.278 -179.266 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' D' D ' 341' ' ' PHE . . . . . . . . . . . . . 53.9 m-85 -61.81 -45.53 93.43 Favored 'General case' 0 C--N 1.298 -1.631 0 O-C-N 120.925 -1.109 . . . . 0.21 110.249 -179.408 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' D' D ' 342' ' ' ARG . . . . . . . . . . . . . 11.6 ttp180 -48.12 -43.91 31.48 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.157 -0.964 . . . . 3.15 109.896 -179.656 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' D' D ' 343' ' ' GLU . . . . . . . . . . . . . 27.7 tt0 -58.24 -48.26 80.95 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.246 -0.909 . . . . 2.35 109.7 -179.539 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' D' D ' 344' ' ' LEU . . . . . . . . . . . . . 46.4 mt -61.47 -30.31 70.52 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.074 -1.016 . . . . 1.06 109.551 -179.872 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' D' D ' 345' ' ' ASN . . . . . . . . . . . . . 12.6 t-20 -57.82 -59.11 5.73 Favored 'General case' 0 C--N 1.305 -1.367 0 O-C-N 121.148 -0.97 . . . . 1.35 109.587 -179.931 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' D' D ' 346' ' ' GLU . . . . . . . . . . . . . 83.4 tt0 -60.52 -25.22 65.95 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.327 -0.858 . . . . 1.69 109.692 -179.755 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' D' D ' 347' ' ' ALA . . . . . . . . . . . . . . . -61.71 -60.89 2.99 Favored 'General case' 0 C--N 1.301 -1.515 0 O-C-N 121.171 -0.956 . . . . 1.03 109.773 -179.77 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' D' D ' 348' ' ' LEU . . . . . 0.462 ' N ' HD23 ' D' ' 348' ' ' LEU . 3.8 mm? -61.84 -46.33 89.92 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.35 -0.843 . . . . 1.04 109.716 -179.239 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' D' D ' 349' ' ' GLU . . . . . . . . . . . . . 21.1 mm-40 -56.85 -31.67 65.03 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.374 -0.829 . . . . 1.95 109.904 -179.516 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' D' D ' 350' ' ' LEU . . . . . 0.539 ' CD1' HD23 ' C' ' 350' ' ' LEU . 5.8 tt -64.75 -47.12 79.37 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.466 -0.771 . . . . 1.16 108.957 179.787 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' D' D ' 351' ' ' LYS . . . . . . . . . . . . . 6.1 tttt -57.71 -43.67 85.36 Favored 'General case' 0 N--CA 1.489 1.513 0 N-CA-C 109.047 -0.723 . . . . 1.97 109.047 179.755 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' D' D ' 352' ' ' ASP . . . . . 0.419 ' O ' ' HB1' ' D' ' 355' ' ' ALA . 15.7 m-20 -55.05 -39.87 69.66 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.362 -0.836 . . . . 1.17 109.603 179.904 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' D' D ' 353' ' ' ALA . . . . . . . . . . . . . . . -69.0 -27.12 65.41 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.465 -0.772 . . . . 1.21 109.848 -179.927 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' D' D ' 354' ' ' GLN . . . . . . . . . . . . . 4.4 tt0 -80.66 -4.46 54.34 Favored 'General case' 0 N--CA 1.488 1.468 0 O-C-N 120.946 -1.096 . . . . 1.68 109.997 -179.636 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' D' D ' 355' ' ' ALA . . . . . 0.419 ' HB1' ' O ' ' D' ' 352' ' ' ASP . . . -69.49 -88.06 0.02 OUTLIER 'General case' 0 N--CA 1.496 1.856 0 O-C-N 121.252 -0.905 . . . . 1.29 109.603 -179.998 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' D' D ' 356' ' ' GLY . . . . . . . . . . . . . . . -68.35 104.76 1.26 Allowed Glycine 0 N--CA 1.489 2.214 0 N-CA-C 109.208 -1.557 . . . . 1.28 109.208 179.84 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' D' D ' 357' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -86.68 124.36 32.86 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.108 -1.231 . . . . 4.45 109.606 -179.612 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' D' D ' 358' ' ' GLU . . . . . . . . . . . . . 5.3 mm-40 -50.09 118.5 9.08 Favored Pre-proline 0 N--CA 1.489 1.501 0 O-C-N 121.266 -0.897 . . . . 5.71 109.639 179.995 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' D' D ' 359' ' ' PRO . . . . . . . . . . . . . 2.5 Cg_endo -62.43 150.11 88.52 Favored 'Trans proline' 0 C--N 1.313 -1.338 0 C-N-CA 121.95 1.767 . . . . 5.6 109.919 179.559 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' D' D ' 360' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.488 2.149 0 CA-C-O 117.958 -1.468 . . . . 6.97 109.536 179.978 . . . . . . . . 0 0 . 1 . 031 nuclear orig full ' A' A ' 319' ' ' LYS . . . . . . . . . . . . . 5.8 mtpt . . . . . 0 N--CA 1.492 1.661 0 N-CA-C 109.474 -0.565 . . . . 7.95 109.474 . . . . . . . . . 0 0 . 1 . 031 nuclear orig full ' A' A ' 320' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER 64.28 137.14 0.02 OUTLIER 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.162 -0.961 . . . . 6.71 109.67 -179.978 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' A' A ' 321' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -159.24 71.61 3.45 Favored Pre-proline 0 N--CA 1.489 1.517 0 O-C-N 121.317 -0.864 . . . . 6.5 109.212 179.822 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' A' A ' 322' ' ' PRO . . . . . . . . . . . . . 3.5 Cg_exo -60.88 128.42 25.45 Favored 'Trans proline' 0 C--N 1.308 -1.572 0 C-N-CA 122.278 1.985 . . . . 3.3 109.795 -179.754 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 323' ' ' LEU . . . . . . . . . . . . . 15.2 mt -79.32 124.88 28.82 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.291 -0.88 . . . . 3.16 109.411 -179.676 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 324' ' ' ASP . . . . . 0.509 ' CB ' ' OH ' ' A' ' 327' ' ' TYR . 11.9 m-20 -80.21 155.29 27.45 Favored 'General case' 0 C--N 1.304 -1.405 0 O-C-N 121.281 -0.887 . . . . 1.53 108.995 179.894 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' A' A ' 325' ' ' GLY . . . . . . . . . . . . . . . -70.42 -161.2 3.53 Favored Glycine 0 N--CA 1.488 2.162 0 N-CA-C 109.137 -1.585 . . . . 0.67 109.137 179.887 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 326' ' ' GLU . . . . . . . . . . . . . 2.6 mt-10 -59.19 -166.56 0.01 OUTLIER 'General case' 0 N--CA 1.488 1.47 0 O-C-N 121.153 -1.204 . . . . 2.13 109.042 179.677 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 327' ' ' TYR . . . . . 0.509 ' OH ' ' CB ' ' A' ' 324' ' ' ASP . 33.6 m-85 -148.5 112.42 5.14 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.212 -0.93 . . . . 1.0 109.722 179.901 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' A' A ' 328' ' ' PHE . . . . . 0.401 ' CZ ' ' HG3' ' C' ' 335' ' ' ARG . 85.1 m-85 -114.78 -168.12 1.33 Allowed 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.452 -0.78 . . . . 0.34 109.45 179.972 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' A' A ' 329' ' ' THR . . . . . . . . . . . . . 37.0 p -154.18 157.93 39.56 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.206 -0.934 . . . . 1.05 109.315 -179.971 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 330' ' ' LEU . . . . . . . . . . . . . 21.9 tp -150.73 128.81 11.85 Favored 'General case' 0 N--CA 1.488 1.465 0 O-C-N 121.213 -0.929 . . . . 1.07 109.888 -179.546 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 331' ' ' GLN . . . . . . . . . . . . . 1.3 tt0 -86.92 117.06 25.4 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.242 -0.911 . . . . 0.91 109.095 179.673 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 332' ' ' ILE . . . . . . . . . . . . . 96.2 mt -103.43 106.49 20.24 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.565 0 O-C-N 121.114 -0.991 . . . . 1.09 109.96 -179.576 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 333' ' ' ARG . . . . . 0.578 ' HG2' ' CE1' ' C' ' 327' ' ' TYR . 1.6 mtp180 -73.15 154.21 40.42 Favored 'General case' 0 C--N 1.303 -1.439 0 O-C-N 121.466 -0.771 . . . . 3.41 109.429 179.781 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' A' A ' 334' ' ' GLY . . . . . . . . . . . . . . . 79.62 129.67 0.73 Allowed Glycine 0 N--CA 1.492 2.397 0 N-CA-C 109.882 -1.287 . . . . 0.4 109.882 179.621 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 335' ' ' ARG . . . . . 0.522 ' NH1' ' HG2' ' A' ' 335' ' ' ARG . 21.6 ttt-85 -79.8 -38.24 33.46 Favored 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.355 -1.085 . . . . 3.55 109.229 179.627 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' A' A ' 336' ' ' GLU . . . . . . . . . . . . . 21.4 mt-10 -58.69 -59.14 5.88 Favored 'General case' 0 N--CA 1.488 1.436 0 O-C-N 121.399 -0.813 . . . . 2.29 109.59 -179.996 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 337' ' ' ARG . . . . . . . . . . . . . 2.5 mmt180 -60.17 -30.62 69.46 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.292 -0.88 . . . . 3.64 109.3 -179.981 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 338' ' ' PHE . . . . . 0.416 ' HB3' ' O ' ' A' ' 335' ' ' ARG . 64.3 t80 -55.48 -58.1 9.14 Favored 'General case' 0 N--CA 1.488 1.474 0 O-C-N 121.171 -0.955 . . . . 0.41 109.278 179.826 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' A' A ' 339' ' ' GLU . . . . . . . . . . . . . 7.2 mt-10 -51.92 -30.95 26.58 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.139 -0.975 . . . . 1.97 109.99 -179.847 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 340' ' ' MET . . . . . . . . . . . . . 16.0 ttp -64.67 -54.4 32.34 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.166 -0.959 . . . . 1.14 109.885 -179.6 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 341' ' ' PHE . . . . . . . . . . . . . 35.7 m-85 -62.61 -52.77 62.08 Favored 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.3 -0.875 . . . . 0.21 110.024 -179.6 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 342' ' ' ARG . . . . . . . . . . . . . 12.9 ttp180 -47.93 -41.17 24.07 Favored 'General case' 0 N--CA 1.489 1.481 0 O-C-N 121.234 -0.916 . . . . 3.15 109.946 -179.576 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 343' ' ' GLU . . . . . . . . . . . . . 42.9 tt0 -59.17 -45.11 91.86 Favored 'General case' 0 N--CA 1.494 1.74 0 O-C-N 121.156 -0.965 . . . . 2.35 109.741 -179.859 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 344' ' ' LEU . . . . . . . . . . . . . 39.8 mt -62.81 -41.63 99.37 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.118 -0.989 . . . . 1.06 109.781 -179.864 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 345' ' ' ASN . . . . . . . . . . . . . 33.2 t-20 -56.16 -45.46 79.67 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.113 -0.992 . . . . 1.36 109.464 -179.826 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 346' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -60.88 -36.08 78.28 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.255 -0.903 . . . . 1.65 109.746 -179.949 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' A' A ' 347' ' ' ALA . . . . . 0.502 ' CB ' ' HB3' ' B' ' 347' ' ' ALA . . . -60.54 -52.32 65.7 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.164 -0.96 . . . . 1.03 110.27 -179.646 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' A' A ' 348' ' ' LEU . . . . . 0.41 ' N ' HD23 ' A' ' 348' ' ' LEU . 3.9 mm? -60.78 -49.74 76.28 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.196 -0.94 . . . . 1.04 109.888 -179.403 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' A' A ' 349' ' ' GLU . . . . . . . . . . . . . 53.3 mt-10 -57.49 -31.08 65.65 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.233 -0.917 . . . . 1.94 110.038 -179.332 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 350' ' ' LEU . . . . . 0.52 HD12 ' NE2' ' B' ' 354' ' ' GLN . 4.7 tt -63.81 -41.28 97.92 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.075 -1.016 . . . . 1.17 109.054 179.92 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' A' A ' 351' ' ' LYS . . . . . . . . . . . . . 6.3 tttt -59.65 -44.94 93.34 Favored 'General case' 0 C--N 1.302 -1.497 0 O-C-N 121.342 -0.849 . . . . 1.97 109.647 179.94 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 352' ' ' ASP . . . . . . . . . . . . . 63.8 m-20 -54.48 -43.33 71.65 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.162 -0.962 . . . . 1.16 109.623 -179.917 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 353' ' ' ALA . . . . . . . . . . . . . . . -67.61 -28.91 68.15 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.194 -0.941 . . . . 1.22 109.599 -179.687 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 354' ' ' GLN . . . . . 0.437 ' NE2' HD12 ' B' ' 350' ' ' LEU . 0.4 OUTLIER -81.39 5.7 16.71 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.211 -0.93 . . . . 1.71 109.378 179.853 . . . . . . . . 3 3 . 1 . 031 nuclear orig full ' A' A ' 355' ' ' ALA . . . . . . . . . . . . . . . -69.32 -83.77 0.03 OUTLIER 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.054 -1.029 . . . . 1.3 109.622 -179.845 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 356' ' ' GLY . . . . . . . . . . . . . . . -71.73 88.1 0.45 Allowed Glycine 0 N--CA 1.491 2.351 0 N-CA-C 109.928 -1.269 . . . . 1.3 109.928 -179.744 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 357' ' ' LYS . . . . . . . . . . . . . 24.3 ttmt -88.16 141.73 28.33 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.205 -1.174 . . . . 4.46 109.491 179.63 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 358' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -51.0 167.15 0.28 Allowed Pre-proline 0 N--CA 1.49 1.555 0 O-C-N 121.299 -0.876 . . . . 5.75 109.445 -179.981 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' A' A ' 359' ' ' PRO . . . . . . . . . . . . . 2.4 Cg_endo -61.87 -75.38 0.02 OUTLIER 'Trans proline' 0 C--N 1.309 -1.54 0 C-N-CA 122.306 2.004 . . . . 5.63 110.138 179.744 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 360' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.345 0 N-CA-C 109.297 -1.521 . . . . 6.97 109.297 179.832 . . . . . . . . 0 0 . 1 . 031 nuclear orig full ' B' B ' 319' ' ' LYS . . . . . . . . . . . . . 5.9 mtpt . . . . . 0 N--CA 1.492 1.668 0 N-CA-C 109.449 -0.575 . . . . 7.95 109.449 . . . . . . . . . 0 0 . 1 . 031 nuclear orig full ' B' B ' 320' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER 63.71 138.11 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.228 -0.92 . . . . 6.73 109.56 -179.949 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' B' B ' 321' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -159.75 71.58 3.23 Favored Pre-proline 0 C--N 1.301 -1.514 0 O-C-N 121.3 -0.875 . . . . 6.5 109.141 179.701 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' B' B ' 322' ' ' PRO . . . . . . . . . . . . . 3.4 Cg_exo -61.2 128.2 24.41 Favored 'Trans proline' 0 C--N 1.308 -1.6 0 C-N-CA 122.014 1.809 . . . . 3.29 109.797 -179.59 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' B' B ' 323' ' ' LEU . . . . . . . . . . . . . 14.8 mt -78.92 123.84 27.65 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.144 -0.973 . . . . 3.18 109.676 -179.749 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' B' B ' 324' ' ' ASP . . . . . 0.528 ' CB ' ' OH ' ' B' ' 327' ' ' TYR . 13.2 m-20 -79.19 155.35 28.68 Favored 'General case' 0 C--N 1.305 -1.368 0 O-C-N 121.186 -0.946 . . . . 1.53 109.003 179.804 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' B' B ' 325' ' ' GLY . . . . . . . . . . . . . . . -70.91 -162.22 4.46 Favored Glycine 0 N--CA 1.488 2.123 0 N-CA-C 109.147 -1.581 . . . . 0.65 109.147 179.778 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' B' B ' 326' ' ' GLU . . . . . . . . . . . . . 2.6 mt-10 -58.08 -166.42 0.0 OUTLIER 'General case' 0 N--CA 1.488 1.471 0 O-C-N 121.188 -1.183 . . . . 2.13 109.314 179.949 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' B' B ' 327' ' ' TYR . . . . . 0.604 ' CE1' ' HG2' ' D' ' 333' ' ' ARG . 35.9 m-85 -148.57 112.44 5.13 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.42 -0.8 . . . . 0.99 109.671 179.74 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' B' B ' 328' ' ' PHE . . . . . 0.478 ' CE2' ' HA ' ' D' ' 335' ' ' ARG . 85.4 m-85 -114.94 -168.88 1.45 Allowed 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.429 -0.794 . . . . 0.36 109.287 179.756 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' B' B ' 329' ' ' THR . . . . . . . . . . . . . 37.9 p -153.53 158.53 41.41 Favored 'General case' 0 N--CA 1.489 1.495 0 O-C-N 121.243 -0.911 . . . . 1.05 109.262 179.989 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' B' B ' 330' ' ' LEU . . . . . . . . . . . . . 20.5 tp -151.11 129.61 12.16 Favored 'General case' 0 C--N 1.303 -1.429 0 O-C-N 121.275 -0.891 . . . . 1.07 109.628 -179.758 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' B' B ' 331' ' ' GLN . . . . . . . . . . . . . 1.4 tt0 -87.42 117.73 26.39 Favored 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.289 -0.882 . . . . 0.91 108.863 179.475 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' B' B ' 332' ' ' ILE . . . . . . . . . . . . . 95.4 mt -103.97 106.71 20.77 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.597 0 O-C-N 121.178 -0.951 . . . . 1.08 110.048 -179.724 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' B' B ' 333' ' ' ARG . . . . . 0.524 ' HG2' ' CE1' ' D' ' 327' ' ' TYR . 1.7 mtp180 -73.38 154.84 39.88 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.268 -0.895 . . . . 3.42 109.536 179.751 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' B' B ' 334' ' ' GLY . . . . . . . . . . . . . . . 77.99 128.63 0.46 Allowed Glycine 0 N--CA 1.491 2.303 0 N-CA-C 109.987 -1.245 . . . . 0.4 109.987 179.82 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' B' B ' 335' ' ' ARG . . . . . 0.533 ' HG2' ' NH1' ' B' ' 335' ' ' ARG . 23.1 ttt-85 -78.77 -38.72 37.88 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.285 -1.127 . . . . 3.55 109.293 179.787 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' B' B ' 336' ' ' GLU . . . . . . . . . . . . . 22.1 mt-10 -57.73 -59.1 5.72 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.317 -0.864 . . . . 2.28 109.563 179.935 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' B' B ' 337' ' ' ARG . . . . . . . . . . . . . 2.5 mmt180 -60.54 -30.43 69.76 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.207 -0.933 . . . . 3.64 109.34 -179.886 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' B' B ' 338' ' ' PHE . . . . . 0.44 ' HB3' ' O ' ' B' ' 335' ' ' ARG . 65.8 t80 -55.52 -57.73 10.71 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.332 -0.855 . . . . 0.39 109.379 179.723 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' B' B ' 339' ' ' GLU . . . . . . . . . . . . . 7.9 mt-10 -52.38 -31.06 32.05 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.218 -0.926 . . . . 1.98 109.755 -179.848 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' B' B ' 340' ' ' MET . . . . . . . . . . . . . 17.5 ttp -64.3 -54.54 31.63 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.246 -0.909 . . . . 1.14 109.88 -179.5 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' B' B ' 341' ' ' PHE . . . . . . . . . . . . . 36.4 m-85 -62.73 -53.34 55.92 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.389 -0.819 . . . . 0.22 109.857 -179.579 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' B' B ' 342' ' ' ARG . . . . . . . . . . . . . 13.6 ttp180 -47.2 -41.37 18.04 Favored 'General case' 0 C--N 1.301 -1.511 0 O-C-N 121.274 -0.891 . . . . 3.15 109.99 -179.6 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' B' B ' 343' ' ' GLU . . . . . . . . . . . . . 41.0 tt0 -58.77 -45.61 89.37 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.013 -1.054 . . . . 2.35 109.704 -179.719 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' B' B ' 344' ' ' LEU . . . . . 0.443 ' O ' HD21 ' B' ' 348' ' ' LEU . 41.1 mt -62.8 -40.93 98.86 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.237 -0.914 . . . . 1.05 110.078 -179.586 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' B' B ' 345' ' ' ASN . . . . . . . . . . . . . 33.9 t-20 -56.84 -44.99 82.64 Favored 'General case' 0 C--N 1.301 -1.522 0 O-C-N 121.242 -0.911 . . . . 1.35 109.449 -179.877 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' B' B ' 346' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -61.36 -35.43 77.43 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.191 -0.943 . . . . 1.66 109.73 -179.924 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' B' B ' 347' ' ' ALA . . . . . 0.502 ' HB3' ' CB ' ' A' ' 347' ' ' ALA . . . -61.3 -51.98 66.6 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.24 -0.913 . . . . 1.02 110.078 -179.48 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' B' B ' 348' ' ' LEU . . . . . 0.443 HD21 ' O ' ' B' ' 344' ' ' LEU . 3.9 mm? -61.0 -49.62 76.69 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.085 -1.009 . . . . 1.05 109.933 -179.494 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' B' B ' 349' ' ' GLU . . . . . . . . . . . . . 53.7 mt-10 -57.7 -31.61 66.56 Favored 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.243 -0.91 . . . . 1.95 109.897 -179.335 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' B' B ' 350' ' ' LEU . . . . . 0.486 HD22 ' O ' ' B' ' 350' ' ' LEU . 4.7 tt -62.98 -41.88 99.68 Favored 'General case' 0 N--CA 1.488 1.474 0 O-C-N 120.981 -1.074 . . . . 1.18 109.108 179.857 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' B' B ' 351' ' ' LYS . . . . . . . . . . . . . 6.3 tttt -59.0 -44.67 91.7 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.311 -0.868 . . . . 1.96 109.715 179.908 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' B' B ' 352' ' ' ASP . . . . . . . . . . . . . 65.4 m-20 -54.74 -43.59 72.82 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.195 -0.941 . . . . 1.16 109.776 -179.695 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' B' B ' 353' ' ' ALA . . . . . . . . . . . . . . . -67.49 -28.86 68.19 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.216 -0.927 . . . . 1.21 109.366 -179.955 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' B' B ' 354' ' ' GLN . . . . . 0.52 ' NE2' HD12 ' A' ' 350' ' ' LEU . 0.4 OUTLIER -80.8 4.46 19.03 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.287 -0.883 . . . . 1.69 109.661 179.862 . . . . . . . . 3 3 . 1 . 031 nuclear orig full ' B' B ' 355' ' ' ALA . . . . . . . . . . . . . . . -68.59 -85.31 0.02 OUTLIER 'General case' 0 N--CA 1.487 1.416 0 O-C-N 121.177 -0.952 . . . . 1.3 109.44 -179.924 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' B' B ' 356' ' ' GLY . . . . . . . . . . . . . . . -70.06 87.9 0.31 Allowed Glycine 0 N--CA 1.492 2.427 0 N-CA-C 110.177 -1.169 . . . . 1.29 110.177 -179.668 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' B' B ' 357' ' ' LYS . . . . . . . . . . . . . 24.3 ttmt -88.3 140.72 29.19 Favored 'General case' 0 N--CA 1.493 1.692 0 O-C-N 121.169 -1.195 . . . . 4.45 109.625 179.627 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' B' B ' 358' ' ' GLU . . . . . 0.401 ' CB ' ' HD2' ' B' ' 359' ' ' PRO . 1.1 mt-10 -49.98 167.15 0.25 Allowed Pre-proline 0 N--CA 1.492 1.674 0 O-C-N 121.188 -0.945 . . . . 5.72 109.341 179.753 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' B' B ' 359' ' ' PRO . . . . . 0.401 ' HD2' ' CB ' ' B' ' 358' ' ' GLU . 2.5 Cg_endo -61.94 -73.33 0.02 OUTLIER 'Trans proline' 0 C--N 1.308 -1.572 0 C-N-CA 122.572 2.182 . . . . 5.6 110.25 179.919 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' B' B ' 360' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.233 0 CA-C-O 117.978 -1.456 . . . . 6.98 109.509 179.99 . . . . . . . . 0 0 . 1 . 031 nuclear orig full ' C' C ' 319' ' ' LYS . . . . . 0.413 ' O ' ' HB2' ' C' ' 320' ' ' LYS . 0.1 OUTLIER . . . . . 0 N--CA 1.491 1.581 0 CA-C-O 121.284 0.564 . . . . 7.03 109.552 . . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' C' C ' 320' ' ' LYS . . . . . 0.416 ' HD3' ' HA ' ' C' ' 320' ' ' LYS . 38.2 mmtt 59.91 54.01 4.46 Favored 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.376 -0.828 . . . . 6.84 109.404 179.816 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' C' C ' 321' ' ' LYS . . . . . 0.425 ' O ' ' OD1' ' C' ' 324' ' ' ASP . 17.0 mttt -82.15 116.63 64.65 Favored Pre-proline 0 N--CA 1.492 1.653 0 O-C-N 121.283 -0.886 . . . . 6.78 109.453 -179.944 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' C' C ' 322' ' ' PRO . . . . . . . . . . . . . 2.5 Cg_endo -68.38 -3.74 11.53 Favored 'Trans proline' 0 C--N 1.313 -1.323 0 C-N-CA 121.932 1.754 . . . . 3.98 110.586 -179.88 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' C' C ' 323' ' ' LEU . . . . . . . . . . . . . 33.3 mt -85.06 55.34 3.45 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.146 -0.971 . . . . 4.31 109.659 -179.991 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' C' C ' 324' ' ' ASP . . . . . 0.477 ' CB ' ' OH ' ' C' ' 327' ' ' TYR . 8.2 m-20 -82.05 139.09 34.67 Favored 'General case' 0 N--CA 1.489 1.479 0 O-C-N 121.117 -0.989 . . . . 1.63 109.492 -179.931 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' C' C ' 325' ' ' GLY . . . . . . . . . . . . . . . -68.59 -161.97 2.36 Favored Glycine 0 N--CA 1.489 2.18 0 N-CA-C 109.117 -1.593 . . . . 0.82 109.117 179.699 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' C' C ' 326' ' ' GLU . . . . . . . . . . . . . 1.9 mm-40 -58.21 -168.69 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.282 -1.128 . . . . 2.17 109.432 -179.962 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' C' C ' 327' ' ' TYR . . . . . 0.578 ' CE1' ' HG2' ' A' ' 333' ' ' ARG . 32.7 m-85 -148.2 101.34 3.26 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.193 -0.942 . . . . 1.03 109.629 179.864 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' C' C ' 328' ' ' PHE . . . . . . . . . . . . . 92.8 m-85 -108.17 -164.37 0.95 Allowed 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.258 -0.901 . . . . 0.37 109.414 179.878 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' C' C ' 329' ' ' THR . . . . . . . . . . . . . 3.0 p -154.19 157.5 38.92 Favored 'General case' 0 C--N 1.303 -1.426 0 O-C-N 121.405 -0.809 . . . . 1.04 109.039 -179.968 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' C' C ' 330' ' ' LEU . . . . . . . . . . . . . 19.8 tp -148.38 127.27 12.68 Favored 'General case' 0 N--CA 1.489 1.48 0 O-C-N 121.234 -0.916 . . . . 1.09 109.687 -179.735 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' C' C ' 331' ' ' GLN . . . . . . . . . . . . . 1.1 tt0 -86.82 120.06 27.7 Favored 'General case' 0 N--CA 1.487 1.41 0 N-CA-C 108.587 -0.894 . . . . 1.48 108.587 179.286 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' C' C ' 332' ' ' ILE . . . . . 0.445 HG23 ' HA ' ' C' ' 338' ' ' PHE . 15.0 mt -102.84 103.11 14.58 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.588 0 O-C-N 121.178 -0.951 . . . . 1.08 109.845 -179.405 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' C' C ' 333' ' ' ARG . . . . . 0.484 ' HG2' ' CE1' ' A' ' 327' ' ' TYR . 1.6 mtt-85 -73.49 126.25 29.79 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.44 -0.787 . . . . 3.36 109.47 179.812 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' C' C ' 334' ' ' GLY . . . . . . . . . . . . . . . 104.68 125.76 5.65 Favored Glycine 0 N--CA 1.49 2.243 0 N-CA-C 109.473 -1.451 . . . . 0.35 109.473 -179.889 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' C' C ' 335' ' ' ARG . . . . . 0.46 ' O ' ' HB3' ' C' ' 338' ' ' PHE . 2.6 ttm180 -78.65 -36.21 44.21 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.305 -1.115 . . . . 3.23 109.612 -179.69 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' C' C ' 336' ' ' GLU . . . . . . . . . . . . . 3.0 mm-40 -58.57 -63.31 1.33 Allowed 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.182 -0.949 . . . . 2.62 109.598 -179.802 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' C' C ' 337' ' ' ARG . . . . . . . . . . . . . 14.9 mmt180 -59.12 -27.79 65.93 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.265 -0.897 . . . . 3.61 109.615 -179.995 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' C' C ' 338' ' ' PHE . . . . . 0.46 ' HB3' ' O ' ' C' ' 335' ' ' ARG . 59.8 t80 -55.34 -58.28 8.39 Favored 'General case' 0 N--CA 1.489 1.489 0 O-C-N 121.25 -0.906 . . . . 0.43 109.731 179.969 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' C' C ' 339' ' ' GLU . . . . . . . . . . . . . 17.9 mt-10 -50.52 -32.95 19.76 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.097 -1.002 . . . . 2.05 110.087 -179.544 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' C' C ' 340' ' ' MET . . . . . . . . . . . . . 35.0 ttp -64.19 -55.27 22.89 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.13 -0.981 . . . . 1.1 110.116 -179.496 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' C' C ' 341' ' ' PHE . . . . . . . . . . . . . 49.6 m-85 -60.93 -53.64 54.79 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.126 -0.984 . . . . 0.21 109.999 -179.486 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' C' C ' 342' ' ' ARG . . . . . . . . . . . . . 16.6 ttt180 -46.98 -38.47 10.76 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.088 -1.008 . . . . 3.42 109.805 -179.581 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' C' C ' 343' ' ' GLU . . . . . . . . . . . . . 31.4 tt0 -60.18 -47.35 86.3 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.165 -0.96 . . . . 2.14 109.848 -179.858 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' C' C ' 344' ' ' LEU . . . . . 0.473 ' O ' HD21 ' C' ' 348' ' ' LEU . 36.0 mt -62.55 -35.48 79.6 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.146 -0.971 . . . . 1.09 109.925 -179.507 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' C' C ' 345' ' ' ASN . . . . . . . . . . . . . 54.8 t-20 -56.37 -48.83 76.03 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.062 -1.024 . . . . 1.38 109.371 -179.991 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' C' C ' 346' ' ' GLU . . . . . . . . . . . . . 2.1 tp10 -62.47 -32.76 73.7 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.253 -0.904 . . . . 2.21 109.734 179.945 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' C' C ' 347' ' ' ALA . . . . . 0.525 ' HB3' ' CB ' ' D' ' 347' ' ' ALA . . . -62.11 -55.96 23.62 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.205 -0.935 . . . . 1.03 110.083 -179.718 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' C' C ' 348' ' ' LEU . . . . . 0.473 HD21 ' O ' ' C' ' 344' ' ' LEU . 3.9 mm? -60.97 -49.56 76.94 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.218 -0.926 . . . . 1.06 109.832 -179.403 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' C' C ' 349' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -56.43 -33.47 65.87 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.127 -0.983 . . . . 2.19 109.373 -179.704 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' C' C ' 350' ' ' LEU . . . . . 0.491 HD23 HD23 ' D' ' 350' ' ' LEU . 6.4 tt -62.53 -43.35 99.03 Favored 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.337 -0.852 . . . . 1.2 109.092 179.759 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' C' C ' 351' ' ' LYS . . . . . . . . . . . . . 36.3 tttt -58.15 -41.84 84.64 Favored 'General case' 0 C--N 1.301 -1.514 0 O-C-N 121.377 -0.827 . . . . 1.92 109.045 179.742 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' C' C ' 352' ' ' ASP . . . . . 0.433 ' O ' ' HB1' ' C' ' 355' ' ' ALA . 50.5 m-20 -56.39 -49.2 75.16 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.241 -0.912 . . . . 1.19 109.455 179.668 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' C' C ' 353' ' ' ALA . . . . . . . . . . . . . . . -68.6 -19.1 64.43 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.434 -0.791 . . . . 1.15 109.303 179.943 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' C' C ' 354' ' ' GLN . . . . . 0.469 ' HG3' ' CE ' ' C' ' 357' ' ' LYS . 12.3 tt0 -82.58 -1.96 52.32 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.304 -0.873 . . . . 1.7 109.71 179.972 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' C' C ' 355' ' ' ALA . . . . . 0.433 ' HB1' ' O ' ' C' ' 352' ' ' ASP . . . -71.16 -80.67 0.06 Allowed 'General case' 0 N--CA 1.489 1.491 0 O-C-N 121.104 -0.997 . . . . 1.3 109.702 -179.962 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' C' C ' 356' ' ' GLY . . . . . . . . . . . . . . . -80.9 33.96 2.37 Favored Glycine 0 N--CA 1.493 2.458 0 C-N-CA 120.23 -0.986 . . . . 1.33 110.883 -179.516 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' C' C ' 357' ' ' LYS . . . . . 0.469 ' CE ' ' HG3' ' C' ' 354' ' ' GLN . 15.4 pttp -86.47 167.72 14.4 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 120.779 -1.424 . . . . 4.39 109.385 179.513 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' C' C ' 358' ' ' GLU . . . . . . . . . . . . . 7.8 pt-20 -51.14 146.1 11.71 Favored Pre-proline 0 N--CA 1.488 1.439 0 O-C-N 121.175 -0.953 . . . . 5.75 109.556 179.955 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' C' C ' 359' ' ' PRO . . . . . . . . . . . . . 1.6 Cg_endo -63.25 124.98 14.79 Favored 'Trans proline' 0 C--N 1.311 -1.414 0 C-N-CA 122.174 1.916 . . . . 5.54 110.179 179.965 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' C' C ' 360' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.349 0 CA-C-O 117.97 -1.461 . . . . 6.5 109.635 179.894 . . . . . . . . 0 0 . 1 . 031 nuclear orig full ' D' D ' 319' ' ' LYS . . . . . 0.406 ' O ' ' O ' ' D' ' 320' ' ' LYS . 5.8 mtpt . . . . . 0 N--CA 1.491 1.599 0 CA-C-O 121.303 0.573 . . . . 7.93 109.921 . . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' D' D ' 320' ' ' LYS . . . . . 0.406 ' O ' ' O ' ' D' ' 319' ' ' LYS . 0.2 OUTLIER 63.08 139.51 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.279 -0.888 . . . . 6.7 109.453 -179.828 . . . . . . . . 3 3 . 1 . 031 nuclear orig full ' D' D ' 321' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -160.32 71.32 2.99 Favored Pre-proline 0 C--N 1.302 -1.479 0 O-C-N 121.192 -0.942 . . . . 6.49 108.883 179.646 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' D' D ' 322' ' ' PRO . . . . . . . . . . . . . 3.5 Cg_exo -60.88 128.16 24.64 Favored 'Trans proline' 0 C--N 1.309 -1.515 0 C-N-CA 121.997 1.798 . . . . 3.29 110.036 -179.697 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' D' D ' 323' ' ' LEU . . . . . . . . . . . . . 14.1 mt -78.72 124.24 27.99 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.229 -0.919 . . . . 3.16 109.556 -179.519 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' D' D ' 324' ' ' ASP . . . . . 0.519 ' CB ' ' OH ' ' D' ' 327' ' ' TYR . 14.3 m-20 -79.43 155.22 28.43 Favored 'General case' 0 N--CA 1.488 1.473 0 O-C-N 121.195 -0.941 . . . . 1.54 109.028 179.667 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' D' D ' 325' ' ' GLY . . . . . . . . . . . . . . . -70.26 -162.07 3.8 Favored Glycine 0 N--CA 1.489 2.172 0 N-CA-C 109.095 -1.602 . . . . 0.65 109.095 179.705 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' D' D ' 326' ' ' GLU . . . . . . . . . . . . . 2.6 mt-10 -58.64 -166.57 0.01 OUTLIER 'General case' 0 N--CA 1.488 1.468 0 O-C-N 121.225 -1.162 . . . . 2.13 109.074 179.719 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' D' D ' 327' ' ' TYR . . . . . 0.524 ' CE1' ' HG2' ' B' ' 333' ' ' ARG . 34.8 m-85 -148.65 111.58 4.85 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.199 -0.938 . . . . 1.0 109.814 179.866 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' D' D ' 328' ' ' PHE . . . . . . . . . . . . . 85.6 m-85 -113.88 -168.4 1.34 Allowed 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.394 -0.816 . . . . 0.34 109.372 179.796 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' D' D ' 329' ' ' THR . . . . . . . . . . . . . 35.5 p -153.9 157.79 39.76 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.169 -0.957 . . . . 1.05 109.132 -179.771 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' D' D ' 330' ' ' LEU . . . . . . . . . . . . . 18.3 tp -150.81 129.44 12.27 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.216 -0.928 . . . . 1.07 109.864 -179.767 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' D' D ' 331' ' ' GLN . . . . . . . . . . . . . 1.7 tt0 -87.43 116.63 25.67 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.218 -0.926 . . . . 0.93 109.27 179.702 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' D' D ' 332' ' ' ILE . . . . . . . . . . . . . 95.0 mt -102.85 106.2 19.59 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.528 0 O-C-N 121.25 -0.906 . . . . 1.07 110.132 -179.572 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' D' D ' 333' ' ' ARG . . . . . 0.604 ' HG2' ' CE1' ' B' ' 327' ' ' TYR . 1.8 mtp180 -72.95 155.25 40.05 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.375 -0.828 . . . . 3.42 109.553 179.614 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' D' D ' 334' ' ' GLY . . . . . . . . . . . . . . . 78.09 128.91 0.48 Allowed Glycine 0 N--CA 1.491 2.337 0 N-CA-C 109.847 -1.301 . . . . 0.41 109.847 179.643 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' D' D ' 335' ' ' ARG . . . . . 0.517 ' HG2' ' NH1' ' D' ' 335' ' ' ARG . 22.0 ttt-85 -79.68 -37.72 35.17 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.246 -1.149 . . . . 3.58 109.235 179.734 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' D' D ' 336' ' ' GLU . . . . . . . . . . . . . 23.6 mt-10 -58.49 -59.54 5.21 Favored 'General case' 0 C--N 1.304 -1.383 0 O-C-N 121.261 -0.899 . . . . 2.26 109.483 179.922 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' D' D ' 337' ' ' ARG . . . . . . . . . . . . . 2.0 mmt180 -60.02 -30.18 68.99 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.313 -0.867 . . . . 3.64 109.438 -179.947 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' D' D ' 338' ' ' PHE . . . . . 0.426 ' HB3' ' O ' ' D' ' 335' ' ' ARG . 65.6 t80 -55.37 -58.37 8.01 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.278 -0.889 . . . . 0.4 109.376 179.855 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' D' D ' 339' ' ' GLU . . . . . . . . . . . . . 8.0 mt-10 -51.9 -31.2 27.32 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.27 -0.894 . . . . 1.99 109.7 -179.939 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' D' D ' 340' ' ' MET . . . . . . . . . . . . . 17.6 ttp -64.21 -54.27 36.12 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.019 -1.051 . . . . 1.13 109.915 -179.627 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' D' D ' 341' ' ' PHE . . . . . . . . . . . . . 36.3 m-85 -62.72 -53.19 58.16 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.222 -0.924 . . . . 0.21 109.984 -179.539 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' D' D ' 342' ' ' ARG . . . . . . . . . . . . . 13.6 ttp180 -47.86 -40.29 21.07 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.357 -0.84 . . . . 3.15 109.943 -179.593 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' D' D ' 343' ' ' GLU . . . . . . . . . . . . . 40.2 tt0 -59.67 -45.4 92.17 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.042 -1.037 . . . . 2.35 109.723 -179.699 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' D' D ' 344' ' ' LEU . . . . . 0.427 ' O ' HD21 ' D' ' 348' ' ' LEU . 41.9 mt -63.0 -40.76 98.74 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.27 -0.894 . . . . 1.06 109.998 -179.678 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' D' D ' 345' ' ' ASN . . . . . . . . . . . . . 33.5 t-20 -56.7 -44.93 82.03 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.34 -0.85 . . . . 1.35 109.454 -179.699 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' D' D ' 346' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -61.72 -35.86 79.26 Favored 'General case' 0 C--N 1.303 -1.447 0 O-C-N 121.476 -0.765 . . . . 1.69 109.746 -179.809 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' D' D ' 347' ' ' ALA . . . . . 0.525 ' CB ' ' HB3' ' C' ' 347' ' ' ALA . . . -60.58 -51.82 67.79 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.289 -0.882 . . . . 1.03 110.203 -179.614 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' D' D ' 348' ' ' LEU . . . . . 0.427 HD21 ' O ' ' D' ' 344' ' ' LEU . 3.9 mm? -61.16 -49.87 75.49 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.077 -1.014 . . . . 1.04 109.818 -179.315 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' D' D ' 349' ' ' GLU . . . . . . . . . . . . . 55.6 mt-10 -57.45 -31.29 65.77 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.168 -0.957 . . . . 1.95 110.062 -179.368 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' D' D ' 350' ' ' LEU . . . . . 0.491 HD23 HD23 ' C' ' 350' ' ' LEU . 4.7 tt -63.47 -41.47 98.6 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 120.972 -1.08 . . . . 1.16 109.11 179.83 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' D' D ' 351' ' ' LYS . . . . . . . . . . . . . 6.7 tttt -59.6 -44.29 93.43 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.377 -0.827 . . . . 1.97 109.517 -179.992 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' D' D ' 352' ' ' ASP . . . . . . . . . . . . . 66.6 m-20 -54.93 -43.5 73.4 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.201 -0.937 . . . . 1.17 109.747 -179.859 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' D' D ' 353' ' ' ALA . . . . . . . . . . . . . . . -67.87 -28.2 67.33 Favored 'General case' 0 N--CA 1.489 1.488 0 O-C-N 121.215 -0.928 . . . . 1.21 109.703 -179.739 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' D' D ' 354' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -81.32 4.69 19.73 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.41 -0.806 . . . . 1.68 109.515 179.883 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' D' D ' 355' ' ' ALA . . . . . . . . . . . . . . . -68.58 -84.1 0.03 OUTLIER 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.204 -0.935 . . . . 1.29 109.89 -179.813 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' D' D ' 356' ' ' GLY . . . . . . . . . . . . . . . -71.69 87.84 0.45 Allowed Glycine 0 N--CA 1.491 2.362 0 N-CA-C 109.637 -1.385 . . . . 1.28 109.637 -179.601 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' D' D ' 357' ' ' LYS . . . . . . . . . . . . . 24.7 ttmt -88.1 141.67 28.38 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.225 -1.162 . . . . 4.45 109.472 179.778 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' D' D ' 358' ' ' GLU . . . . . 0.407 ' CB ' ' HD2' ' D' ' 359' ' ' PRO . 1.1 mt-10 -50.74 167.57 0.26 Allowed Pre-proline 0 N--CA 1.493 1.677 0 O-C-N 121.099 -1.001 . . . . 5.71 109.199 179.87 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' D' D ' 359' ' ' PRO . . . . . 0.407 ' HD2' ' CB ' ' D' ' 358' ' ' GLU . 3.0 Cg_endo -62.24 -72.33 0.02 OUTLIER 'Trans proline' 0 C--N 1.311 -1.409 0 C-N-CA 122.62 2.213 . . . . 5.6 110.174 -179.944 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' D' D ' 360' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.488 2.144 0 N-CA-C 109.458 -1.457 . . . . 6.97 109.458 -179.837 . . . . . . . . 0 0 . 1 . 032 nuclear orig full ' A' A ' 319' ' ' LYS . . . . . 0.46 ' O ' ' O ' ' A' ' 320' ' ' LYS . 3.8 mtpt . . . . . 0 N--CA 1.49 1.536 0 N-CA-C 109.535 -0.543 . . . . 7.95 109.535 . . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 320' ' ' LYS . . . . . 0.46 ' O ' ' O ' ' A' ' 319' ' ' LYS . 2.2 mtmt 61.13 138.52 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.335 -0.853 . . . . 6.71 109.567 179.985 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' A' A ' 321' ' ' LYS . . . . . . . . . . . . . 19.4 mttt -159.08 110.96 1.56 Allowed Pre-proline 0 N--CA 1.49 1.55 0 O-C-N 121.262 -0.899 . . . . 6.5 109.459 -179.861 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 322' ' ' PRO . . . . . . . . . . . . . 3.7 Cg_exo -59.89 -158.92 0.02 OUTLIER 'Trans proline' 0 C--N 1.313 -1.335 0 C-N-CA 121.853 1.702 . . . . 3.3 110.072 179.799 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 323' ' ' LEU . . . . . . . . . . . . . 48.1 mt -80.38 127.28 32.21 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.251 -0.906 . . . . 3.16 109.331 179.958 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 324' ' ' ASP . . . . . . . . . . . . . 13.4 m-20 -78.61 164.45 24.63 Favored 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.228 -0.92 . . . . 1.53 109.395 -179.903 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 325' ' ' GLY . . . . . . . . . . . . . . . -67.53 178.8 17.76 Favored Glycine 0 N--CA 1.488 2.135 0 N-CA-C 109.278 -1.529 . . . . 0.67 109.278 179.97 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 326' ' ' GLU . . . . . 0.406 ' HB2' ' CE1' ' A' ' 328' ' ' PHE . 44.9 mt-10 -57.21 -168.08 0.0 OUTLIER 'General case' 0 N--CA 1.489 1.49 0 O-C-N 121.157 -1.202 . . . . 2.13 109.369 -179.838 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' A' A ' 327' ' ' TYR . . . . . . . . . . . . . 44.6 m-85 -149.49 109.27 4.05 Favored 'General case' 0 N--CA 1.488 1.452 0 O-C-N 121.337 -0.852 . . . . 1.0 109.267 179.993 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 328' ' ' PHE . . . . . 0.406 ' CE1' ' HB2' ' A' ' 326' ' ' GLU . 41.7 m-85 -113.58 -169.16 1.45 Allowed 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.288 -0.882 . . . . 0.34 109.473 -179.809 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' A' A ' 329' ' ' THR . . . . . . . . . . . . . 6.4 p -153.6 168.39 26.34 Favored 'General case' 0 N--CA 1.488 1.456 0 O-C-N 121.294 -0.879 . . . . 1.05 109.216 -179.948 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 330' ' ' LEU . . . . . . . . . . . . . 20.6 tp -150.19 129.03 12.47 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.171 -0.956 . . . . 1.07 109.704 -179.783 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 331' ' ' GLN . . . . . . . . . . . . . 1.2 tp60 -87.7 113.35 23.29 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.441 -0.787 . . . . 0.91 109.393 179.739 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 332' ' ' ILE . . . . . 0.43 ' CG2' ' HA ' ' A' ' 338' ' ' PHE . 76.2 mt -103.57 105.06 17.66 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.573 0 O-C-N 121.193 -0.942 . . . . 1.09 109.431 -179.975 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' A' A ' 333' ' ' ARG . . . . . 0.471 ' NH1' ' HG2' ' A' ' 333' ' ' ARG . 0.0 OUTLIER -71.75 150.71 44.2 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.264 -0.898 . . . . 3.41 109.284 179.822 . . . . . . . . 3 3 . 1 . 032 nuclear orig full ' A' A ' 334' ' ' GLY . . . . . . . . . . . . . . . 76.43 126.73 0.25 Allowed Glycine 0 N--CA 1.49 2.267 0 N-CA-C 109.473 -1.451 . . . . 0.4 109.473 -179.982 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 335' ' ' ARG . . . . . 0.447 ' HB2' ' OE1' ' C' ' 326' ' ' GLU . 0.4 OUTLIER -74.02 -32.84 63.54 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.264 -1.139 . . . . 3.55 109.681 -179.879 . . . . . . . . 3 3 . 1 . 032 nuclear orig full ' A' A ' 336' ' ' GLU . . . . . . . . . . . . . 3.1 mt-10 -58.05 -61.5 2.5 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.282 -0.886 . . . . 2.29 109.796 -179.763 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 337' ' ' ARG . . . . . . . . . . . . . 22.4 mmm180 -59.78 -33.69 72.02 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.194 -0.941 . . . . 3.64 109.633 -179.704 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 338' ' ' PHE . . . . . 0.43 ' HA ' ' CG2' ' A' ' 332' ' ' ILE . 59.5 t80 -55.89 -55.12 36.37 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.159 -0.963 . . . . 0.41 109.964 -179.75 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' A' A ' 339' ' ' GLU . . . . . . . . . . . . . 45.4 mt-10 -50.86 -33.92 25.88 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.237 -0.914 . . . . 1.97 110.369 -179.354 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 340' ' ' MET . . . . . . . . . . . . . 24.2 ttp -64.08 -51.7 62.8 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 120.976 -1.077 . . . . 1.14 110.081 -179.457 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 341' ' ' PHE . . . . . . . . . . . . . 45.2 m-85 -61.98 -45.18 94.76 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.137 -0.977 . . . . 0.21 110.017 -179.437 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 342' ' ' ARG . . . . . 0.408 ' O ' ' HB3' ' A' ' 345' ' ' ASN . 40.5 ttt180 -50.77 -40.39 54.84 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.144 -0.973 . . . . 3.15 109.817 -179.75 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' A' A ' 343' ' ' GLU . . . . . . . . . . . . . 35.5 tp10 -58.43 -51.53 69.46 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.095 -1.003 . . . . 2.35 109.766 -179.624 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 344' ' ' LEU . . . . . 0.41 ' O ' HD21 ' A' ' 348' ' ' LEU . 84.6 mt -61.08 -32.0 71.65 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.239 -0.913 . . . . 1.06 109.338 -179.895 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' A' A ' 345' ' ' ASN . . . . . 0.408 ' HB3' ' O ' ' A' ' 342' ' ' ARG . 8.7 t-20 -58.67 -55.0 40.7 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.254 -0.904 . . . . 1.36 109.325 179.861 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' A' A ' 346' ' ' GLU . . . . . . . . . . . . . 32.4 tp10 -61.62 -32.1 72.22 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.382 -0.824 . . . . 1.65 109.843 -179.736 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 347' ' ' ALA . . . . . . . . . . . . . . . -59.5 -57.04 14.69 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.187 -0.945 . . . . 1.03 109.787 -179.738 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 348' ' ' LEU . . . . . 0.516 ' N ' HD23 ' A' ' 348' ' ' LEU . 3.5 mm? -61.82 -38.73 89.25 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.171 -0.956 . . . . 1.04 109.645 -179.675 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' A' A ' 349' ' ' GLU . . . . . . . . . . . . . 1.8 mt-10 -58.86 -38.39 78.66 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.306 -0.871 . . . . 1.94 110.168 -179.443 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 350' ' ' LEU . . . . . 0.444 HD23 HD23 ' B' ' 350' ' ' LEU . 7.8 tt -63.76 -43.67 95.73 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.179 -0.951 . . . . 1.17 109.87 -179.576 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' A' A ' 351' ' ' LYS . . . . . . . . . . . . . 18.8 tttm -58.34 -42.02 85.94 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.311 -0.868 . . . . 1.97 109.549 -179.774 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 352' ' ' ASP . . . . . . . . . . . . . 48.0 m-20 -56.2 -41.52 75.72 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.252 -0.905 . . . . 1.16 109.522 -179.983 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 353' ' ' ALA . . . . . 0.401 ' O ' ' HB2' ' A' ' 357' ' ' LYS . . . -67.97 -25.54 65.48 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.229 -0.92 . . . . 1.22 109.434 -179.936 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' A' A ' 354' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -81.48 -1.19 45.06 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.261 -0.9 . . . . 1.71 109.508 179.968 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' A' A ' 355' ' ' ALA . . . . . . . . . . . . . . . -69.31 -87.77 0.02 OUTLIER 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.233 -0.917 . . . . 1.3 109.47 179.979 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 356' ' ' GLY . . . . . . . . . . . . . . . -81.67 41.17 2.67 Favored Glycine 0 N--CA 1.493 2.442 0 N-CA-C 110.358 -1.097 . . . . 1.3 110.358 -179.882 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 357' ' ' LYS . . . . . 0.401 ' HB2' ' O ' ' A' ' 353' ' ' ALA . 24.8 tttp -87.69 97.31 10.81 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 120.894 -1.356 . . . . 4.46 109.491 179.902 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' A' A ' 358' ' ' GLU . . . . . 0.563 ' N ' ' HD2' ' A' ' 359' ' ' PRO . 2.7 mt-10 -50.69 -53.52 45.7 Favored Pre-proline 0 N--CA 1.489 1.514 0 O-C-N 121.391 -0.818 . . . . 5.75 109.995 179.993 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' A' A ' 359' ' ' PRO . . . . . 0.563 ' HD2' ' N ' ' A' ' 358' ' ' GLU . 3.6 Cg_exo -61.6 131.69 36.92 Favored 'Trans proline' 0 C--N 1.311 -1.414 0 C-N-CA 121.974 1.783 . . . . 5.63 110.269 -179.656 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' A' A ' 360' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.312 0 CA-C-O 117.993 -1.448 . . . . 6.97 109.561 -179.992 . . . . . . . . 0 0 . 1 . 032 nuclear orig full ' B' B ' 319' ' ' LYS . . . . . 0.463 ' O ' ' O ' ' B' ' 320' ' ' LYS . 4.2 mtpt . . . . . 0 N--CA 1.491 1.593 0 CA-C-O 121.288 0.566 . . . . 7.95 109.489 . . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' B' B ' 320' ' ' LYS . . . . . 0.463 ' O ' ' O ' ' B' ' 319' ' ' LYS . 2.2 mtmt 61.14 138.52 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.238 -0.914 . . . . 6.73 109.51 179.96 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' B' B ' 321' ' ' LYS . . . . . . . . . . . . . 19.4 mttt -159.03 111.1 1.57 Allowed Pre-proline 0 N--CA 1.49 1.534 0 O-C-N 121.253 -0.905 . . . . 6.5 109.485 -179.918 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' B' B ' 322' ' ' PRO . . . . . . . . . . . . . 3.4 Cg_exo -59.94 -158.76 0.02 OUTLIER 'Trans proline' 0 C--N 1.312 -1.375 0 C-N-CA 121.881 1.72 . . . . 3.29 110.164 179.776 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' B' B ' 323' ' ' LEU . . . . . . . . . . . . . 48.4 mt -80.59 127.25 32.24 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.212 -0.93 . . . . 3.18 109.409 179.918 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' B' B ' 324' ' ' ASP . . . . . . . . . . . . . 13.4 m-20 -78.91 163.25 25.42 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.205 -0.934 . . . . 1.53 109.557 -179.882 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' B' B ' 325' ' ' GLY . . . . . . . . . . . . . . . -65.67 178.77 11.02 Favored Glycine 0 N--CA 1.489 2.216 0 N-CA-C 109.334 -1.507 . . . . 0.65 109.334 179.925 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' B' B ' 326' ' ' GLU . . . . . 0.417 ' HB2' ' CE1' ' B' ' 328' ' ' PHE . 45.0 mt-10 -57.52 -167.78 0.0 OUTLIER 'General case' 0 N--CA 1.488 1.462 0 O-C-N 121.204 -1.174 . . . . 2.13 109.348 179.933 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' B' B ' 327' ' ' TYR . . . . . . . . . . . . . 44.6 m-85 -149.6 109.22 4.02 Favored 'General case' 0 N--CA 1.488 1.447 0 O-C-N 121.259 -0.901 . . . . 0.99 109.291 179.914 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' B' B ' 328' ' ' PHE . . . . . 0.417 ' CE1' ' HB2' ' B' ' 326' ' ' GLU . 40.8 m-85 -113.63 -169.23 1.47 Allowed 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.255 -0.903 . . . . 0.36 109.496 -179.772 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' B' B ' 329' ' ' THR . . . . . . . . . . . . . 6.4 p -153.52 168.64 25.46 Favored 'General case' 0 N--CA 1.488 1.458 0 O-C-N 121.247 -0.908 . . . . 1.05 109.267 -179.989 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' B' B ' 330' ' ' LEU . . . . . 0.417 ' O ' ' HA ' ' D' ' 329' ' ' THR . 20.0 tp -150.26 129.15 12.51 Favored 'General case' 0 N--CA 1.489 1.487 0 O-C-N 121.18 -0.95 . . . . 1.07 109.759 -179.88 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' B' B ' 331' ' ' GLN . . . . . . . . . . . . . 1.2 tp60 -87.83 113.27 23.33 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.355 -0.841 . . . . 0.91 109.383 179.739 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' B' B ' 332' ' ' ILE . . . . . 0.431 ' CG2' ' HA ' ' B' ' 338' ' ' PHE . 76.0 mt -103.59 105.01 17.57 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.554 0 O-C-N 121.29 -0.881 . . . . 1.08 109.444 -179.948 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' B' B ' 333' ' ' ARG . . . . . 0.476 ' HG2' ' NH1' ' B' ' 333' ' ' ARG . 0.0 OUTLIER -71.51 150.71 44.56 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.178 -0.952 . . . . 3.42 109.359 179.802 . . . . . . . . 3 3 . 1 . 032 nuclear orig full ' B' B ' 334' ' ' GLY . . . . . . . . . . . . . . . 76.24 126.78 0.24 Allowed Glycine 0 N--CA 1.49 2.276 0 N-CA-C 109.553 -1.419 . . . . 0.4 109.553 -179.933 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' B' B ' 335' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -74.04 -32.9 63.53 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.25 -1.147 . . . . 3.55 109.654 -179.855 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' B' B ' 336' ' ' GLU . . . . . . . . . . . . . 3.1 mt-10 -57.96 -61.42 2.55 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.132 -0.98 . . . . 2.28 109.781 -179.723 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' B' B ' 337' ' ' ARG . . . . . . . . . . . . . 22.2 mmm180 -59.94 -33.78 72.36 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.225 -0.922 . . . . 3.64 109.674 -179.716 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' B' B ' 338' ' ' PHE . . . . . 0.431 ' HA ' ' CG2' ' B' ' 332' ' ' ILE . 59.0 t80 -55.89 -55.11 36.48 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.16 -0.963 . . . . 0.39 109.873 -179.715 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' B' B ' 339' ' ' GLU . . . . . . . . . . . . . 45.0 mt-10 -50.65 -34.22 25.47 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.21 -0.931 . . . . 1.98 110.399 -179.435 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' B' B ' 340' ' ' MET . . . . . . . . . . . . . 23.9 ttp -64.01 -51.57 63.63 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.049 -1.032 . . . . 1.14 110.115 -179.375 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' B' B ' 341' ' ' PHE . . . . . . . . . . . . . 44.8 m-85 -61.9 -45.46 93.65 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.167 -0.958 . . . . 0.22 109.96 -179.451 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' B' B ' 342' ' ' ARG . . . . . 0.414 ' O ' ' HB3' ' B' ' 345' ' ' ASN . 41.1 ttt180 -50.62 -40.36 52.67 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.187 -0.946 . . . . 3.15 109.933 -179.796 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' B' B ' 343' ' ' GLU . . . . . . . . . . . . . 35.4 tp10 -58.46 -51.51 69.53 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.192 -0.943 . . . . 2.35 109.825 -179.604 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' B' B ' 344' ' ' LEU . . . . . 0.408 ' O ' HD21 ' B' ' 348' ' ' LEU . 84.0 mt -61.01 -31.99 71.6 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.137 -0.977 . . . . 1.05 109.345 -179.949 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' B' B ' 345' ' ' ASN . . . . . 0.414 ' HB3' ' O ' ' B' ' 342' ' ' ARG . 9.0 t-20 -58.65 -55.06 39.98 Favored 'General case' 0 N--CA 1.488 1.451 0 O-C-N 121.325 -0.859 . . . . 1.35 109.372 179.83 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' B' B ' 346' ' ' GLU . . . . . . . . . . . . . 32.4 tp10 -61.52 -32.21 72.25 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.478 -0.764 . . . . 1.66 109.815 -179.867 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' B' B ' 347' ' ' ALA . . . . . . . . . . . . . . . -59.59 -56.95 15.51 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.166 -0.959 . . . . 1.02 109.912 -179.756 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' B' B ' 348' ' ' LEU . . . . . 0.516 ' N ' HD23 ' B' ' 348' ' ' LEU . 3.5 mm? -61.92 -38.83 89.89 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.168 -0.957 . . . . 1.05 109.71 -179.734 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' B' B ' 349' ' ' GLU . . . . . . . . . . . . . 1.8 mt-10 -58.67 -38.36 78.02 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.298 -0.876 . . . . 1.95 110.184 -179.583 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' B' B ' 350' ' ' LEU . . . . . 0.446 HD22 ' O ' ' B' ' 350' ' ' LEU . 7.8 tt -63.81 -43.58 95.84 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.089 -1.007 . . . . 1.18 109.827 -179.512 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' B' B ' 351' ' ' LYS . . . . . . . . . . . . . 18.7 tttm -58.39 -42.14 86.42 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.189 -0.944 . . . . 1.96 109.53 -179.744 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' B' B ' 352' ' ' ASP . . . . . . . . . . . . . 48.5 m-20 -55.91 -41.6 74.79 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.284 -0.885 . . . . 1.16 109.524 -179.996 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' B' B ' 353' ' ' ALA . . . . . 0.402 ' O ' ' HB2' ' B' ' 357' ' ' LYS . . . -68.03 -25.6 65.46 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.19 -0.944 . . . . 1.21 109.494 -179.871 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' B' B ' 354' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -81.22 -1.2 43.92 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.213 -0.929 . . . . 1.69 109.54 179.884 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' B' B ' 355' ' ' ALA . . . . . . . . . . . . . . . -69.25 -87.97 0.02 OUTLIER 'General case' 0 N--CA 1.489 1.495 0 O-C-N 121.217 -0.927 . . . . 1.3 109.454 -179.939 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' B' B ' 356' ' ' GLY . . . . . . . . . . . . . . . -81.76 41.27 2.7 Favored Glycine 0 N--CA 1.492 2.367 0 N-CA-C 110.358 -1.097 . . . . 1.29 110.358 -179.923 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' B' B ' 357' ' ' LYS . . . . . 0.402 ' HB2' ' O ' ' B' ' 353' ' ' ALA . 24.9 tttp -87.65 97.28 10.79 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 120.897 -1.355 . . . . 4.45 109.387 179.876 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' B' B ' 358' ' ' GLU . . . . . 0.568 ' N ' ' HD2' ' B' ' 359' ' ' PRO . 2.7 mt-10 -50.65 -53.31 47.78 Favored Pre-proline 0 N--CA 1.489 1.515 0 O-C-N 121.356 -0.84 . . . . 5.72 110.008 -179.999 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' B' B ' 359' ' ' PRO . . . . . 0.568 ' HD2' ' N ' ' B' ' 358' ' ' GLU . 3.4 Cg_exo -61.93 131.89 37.1 Favored 'Trans proline' 0 C--N 1.312 -1.37 0 C-N-CA 121.902 1.734 . . . . 5.6 110.358 -179.669 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' B' B ' 360' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.236 0 CA-C-O 118.053 -1.415 . . . . 6.98 109.601 -179.987 . . . . . . . . 0 0 . 1 . 032 nuclear orig full ' C' C ' 319' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.49 1.574 0 N-CA-C 109.442 -0.577 . . . . 7.03 109.442 . . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' C' C ' 320' ' ' LYS . . . . . . . . . . . . . 8.9 mttt 60.02 160.31 0.04 OUTLIER 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.233 -0.917 . . . . 6.84 109.567 -179.962 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' C' C ' 321' ' ' LYS . . . . . . . . . . . . . 1.2 ptmt -82.11 147.29 57.11 Favored Pre-proline 0 N--CA 1.49 1.548 0 O-C-N 121.244 -0.91 . . . . 6.78 109.625 -179.771 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' C' C ' 322' ' ' PRO . . . . . . . . . . . . . 1.8 Cg_endo -64.3 -58.82 0.21 Allowed 'Trans proline' 0 C--N 1.31 -1.452 0 C-N-CA 122.35 2.033 . . . . 3.98 110.608 -179.89 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' C' C ' 323' ' ' LEU . . . . . . . . . . . . . 12.8 mt -79.22 119.61 22.55 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.252 -0.905 . . . . 4.31 110.0 -179.535 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' C' C ' 324' ' ' ASP . . . . . 0.466 ' CB ' ' OH ' ' C' ' 327' ' ' TYR . 2.5 m-20 -79.97 172.85 13.23 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.366 -0.834 . . . . 1.63 109.378 179.637 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' C' C ' 325' ' ' GLY . . . . . 0.449 ' O ' ' CE2' ' C' ' 327' ' ' TYR . . . -68.44 178.92 22.09 Favored Glycine 0 N--CA 1.49 2.285 0 N-CA-C 109.501 -1.44 . . . . 0.82 109.501 179.946 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' C' C ' 326' ' ' GLU . . . . . 0.447 ' OE1' ' HB2' ' A' ' 335' ' ' ARG . 95.0 mt-10 -58.14 -177.57 0.03 OUTLIER 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.227 -1.161 . . . . 2.17 109.286 179.967 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' C' C ' 327' ' ' TYR . . . . . 0.466 ' OH ' ' CB ' ' C' ' 324' ' ' ASP . 59.0 m-85 -149.02 104.53 3.44 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.102 -0.999 . . . . 1.03 109.808 -179.744 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' C' C ' 328' ' ' PHE . . . . . . . . . . . . . 96.3 m-85 -106.03 -164.53 1.02 Allowed 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.297 -0.877 . . . . 0.37 109.303 179.654 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' C' C ' 329' ' ' THR . . . . . . . . . . . . . 4.2 p -155.75 167.01 31.77 Favored 'General case' 0 N--CA 1.489 1.491 0 O-C-N 121.214 -0.929 . . . . 1.04 109.751 -179.982 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' C' C ' 330' ' ' LEU . . . . . . . . . . . . . 40.3 tp -150.94 125.57 9.62 Favored 'General case' 0 N--CA 1.488 1.471 0 O-C-N 121.321 -0.862 . . . . 1.09 109.174 179.802 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' C' C ' 331' ' ' GLN . . . . . . . . . . . . . 3.5 tp60 -87.45 113.06 22.81 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.164 -0.96 . . . . 1.48 109.732 -179.857 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' C' C ' 332' ' ' ILE . . . . . . . . . . . . . 31.7 mt -103.77 109.5 27.32 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.643 0 O-C-N 121.25 -0.906 . . . . 1.08 109.537 179.871 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' C' C ' 333' ' ' ARG . . . . . 0.48 ' HG3' ' NH1' ' C' ' 333' ' ' ARG . 16.0 mtm-85 -73.86 149.7 41.39 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.227 -0.921 . . . . 3.36 109.428 179.786 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' C' C ' 334' ' ' GLY . . . . . . . . . . . . . . . 76.72 132.16 0.47 Allowed Glycine 0 N--CA 1.49 2.289 0 N-CA-C 109.6 -1.4 . . . . 0.35 109.6 179.903 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' C' C ' 335' ' ' ARG . . . . . 0.411 ' O ' ' HB3' ' C' ' 338' ' ' PHE . 2.6 tmt_? -76.45 -30.74 57.47 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.309 -1.112 . . . . 3.23 109.647 179.943 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' C' C ' 336' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -55.81 -57.11 13.39 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.322 -0.861 . . . . 2.62 109.959 -179.603 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' C' C ' 337' ' ' ARG . . . . . 0.541 ' HG3' ' NH1' ' C' ' 337' ' ' ARG . 1.4 mtm-85 -60.82 -30.56 70.16 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.098 -1.002 . . . . 3.61 109.718 -179.839 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' C' C ' 338' ' ' PHE . . . . . 0.411 ' HB3' ' O ' ' C' ' 335' ' ' ARG . 75.9 t80 -54.0 -59.84 4.11 Favored 'General case' 0 N--CA 1.489 1.49 0 O-C-N 121.306 -0.871 . . . . 0.43 110.265 -179.257 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' C' C ' 339' ' ' GLU . . . . . . . . . . . . . 1.1 mt-10 -50.0 -37.75 34.07 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.024 -1.048 . . . . 2.05 110.58 -179.283 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' C' C ' 340' ' ' MET . . . . . . . . . . . . . 25.9 ttp -63.62 -54.8 30.16 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.034 -1.041 . . . . 1.1 110.426 -179.097 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' C' C ' 341' ' ' PHE . . . . . . . . . . . . . 59.5 m-85 -61.8 -58.49 7.77 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.117 -0.989 . . . . 0.21 110.006 -179.298 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' C' C ' 342' ' ' ARG . . . . . 0.455 ' CG ' ' NH1' ' C' ' 342' ' ' ARG . 0.0 OUTLIER -48.21 -32.5 7.2 Favored 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.186 -0.946 . . . . 3.42 109.813 -179.723 . . . . . . . . 3 3 . 1 . 032 nuclear orig full ' C' C ' 343' ' ' GLU . . . . . . . . . . . . . 10.0 tp10 -58.72 -55.52 33.97 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.149 -0.97 . . . . 2.14 109.458 -179.895 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' C' C ' 344' ' ' LEU . . . . . 0.475 ' O ' HD21 ' C' ' 348' ' ' LEU . 43.3 mt -62.16 -28.7 69.84 Favored 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.241 -0.912 . . . . 1.09 109.361 179.833 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' C' C ' 345' ' ' ASN . . . . . . . . . . . . . 15.8 t-20 -56.33 -56.56 19.5 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.247 -0.908 . . . . 1.38 109.53 -179.996 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' C' C ' 346' ' ' GLU . . . . . . . . . . . . . 61.6 tt0 -61.17 -30.66 70.53 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.227 -0.92 . . . . 2.21 109.592 -179.831 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' C' C ' 347' ' ' ALA . . . . . 0.434 ' HB2' ' HB3' ' D' ' 347' ' ' ALA . . . -59.82 -54.73 42.79 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.284 -0.885 . . . . 1.03 109.94 -179.726 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' C' C ' 348' ' ' LEU . . . . . 0.488 HD23 ' N ' ' C' ' 348' ' ' LEU . 3.3 mm? -62.31 -43.58 98.5 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.257 -0.902 . . . . 1.06 109.768 -179.664 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' C' C ' 349' ' ' GLU . . . . . . . . . . . . . 67.6 mm-40 -59.26 -32.71 70.26 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.192 -0.943 . . . . 2.19 110.386 -179.242 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' C' C ' 350' ' ' LEU . . . . . 0.491 ' CD1' HD21 ' D' ' 350' ' ' LEU . 6.1 tt -62.67 -49.57 74.62 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 120.953 -1.092 . . . . 1.2 109.562 -179.702 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' C' C ' 351' ' ' LYS . . . . . . . . . . . . . 73.2 tttt -57.83 -44.03 86.17 Favored 'General case' 0 C--N 1.303 -1.437 0 O-C-N 121.176 -0.953 . . . . 1.92 109.393 -179.777 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' C' C ' 352' ' ' ASP . . . . . . . . . . . . . 42.4 m-20 -58.36 -39.79 80.5 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.333 -0.855 . . . . 1.19 110.015 179.918 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' C' C ' 353' ' ' ALA . . . . . . . . . . . . . . . -66.62 -21.42 66.12 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.177 -0.952 . . . . 1.15 110.27 -179.246 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' C' C ' 354' ' ' GLN . . . . . . . . . . . . . 29.8 mt-30 -82.94 -22.67 33.74 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 120.974 -1.079 . . . . 1.7 109.163 179.884 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' C' C ' 355' ' ' ALA . . . . . . . . . . . . . . . -74.09 -6.97 50.78 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.339 -0.851 . . . . 1.3 109.365 179.428 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' C' C ' 356' ' ' GLY . . . . . . . . . . . . . . . -80.25 -78.35 0.92 Allowed Glycine 0 N--CA 1.491 2.325 0 N-CA-C 109.801 -1.32 . . . . 1.33 109.801 -179.588 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' C' C ' 357' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -83.01 143.88 30.33 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.255 -1.144 . . . . 4.39 109.744 -179.469 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' C' C ' 358' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -49.64 130.88 19.94 Favored Pre-proline 0 N--CA 1.488 1.463 0 O-C-N 121.319 -0.863 . . . . 5.75 109.248 179.999 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' C' C ' 359' ' ' PRO . . . . . . . . . . . . . 5.1 Cg_exo -59.3 -153.65 0.01 OUTLIER 'Trans proline' 0 C--N 1.311 -1.436 0 C-N-CA 121.943 1.762 . . . . 5.54 110.267 -179.99 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' C' C ' 360' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.318 0 CA-C-O 118.078 -1.401 . . . . 6.5 109.601 -179.957 . . . . . . . . 0 0 . 1 . 032 nuclear orig full ' D' D ' 319' ' ' LYS . . . . . 0.446 ' O ' ' O ' ' D' ' 320' ' ' LYS . 4.5 mtpt . . . . . 0 N--CA 1.49 1.569 0 N-CA-C 109.504 -0.554 . . . . 7.93 109.504 . . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' D' D ' 320' ' ' LYS . . . . . 0.446 ' O ' ' O ' ' D' ' 319' ' ' LYS . 2.1 mtmt 61.76 138.43 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.364 -0.835 . . . . 6.7 109.513 179.972 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' D' D ' 321' ' ' LYS . . . . . . . . . . . . . 19.7 mttt -159.16 111.01 1.55 Allowed Pre-proline 0 N--CA 1.49 1.541 0 O-C-N 121.269 -0.895 . . . . 6.49 109.527 -179.914 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' D' D ' 322' ' ' PRO . . . . . . . . . . . . . 3.6 Cg_exo -59.94 -158.78 0.02 OUTLIER 'Trans proline' 0 C--N 1.312 -1.394 0 C-N-CA 121.755 1.636 . . . . 3.29 110.077 179.917 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' D' D ' 323' ' ' LEU . . . . . . . . . . . . . 46.2 mt -80.45 127.42 32.39 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.205 -0.935 . . . . 3.16 109.315 179.96 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' D' D ' 324' ' ' ASP . . . . . . . . . . . . . 13.2 m-20 -78.93 164.12 24.69 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.16 -0.962 . . . . 1.54 109.447 -179.897 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' D' D ' 325' ' ' GLY . . . . . . . . . . . . . . . -66.95 178.52 15.78 Favored Glycine 0 N--CA 1.489 2.169 0 N-CA-C 109.313 -1.515 . . . . 0.65 109.313 -179.995 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' D' D ' 326' ' ' GLU . . . . . 0.414 ' HB2' ' CE1' ' D' ' 328' ' ' PHE . 45.0 mt-10 -56.95 -168.42 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.169 -1.194 . . . . 2.13 109.356 -179.979 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' D' D ' 327' ' ' TYR . . . . . . . . . . . . . 44.7 m-85 -149.24 109.1 4.05 Favored 'General case' 0 N--CA 1.488 1.43 0 O-C-N 121.358 -0.839 . . . . 1.0 109.276 179.925 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' D' D ' 328' ' ' PHE . . . . . 0.414 ' CE1' ' HB2' ' D' ' 326' ' ' GLU . 40.4 m-85 -113.58 -169.36 1.49 Allowed 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.236 -0.915 . . . . 0.34 109.533 -179.775 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' D' D ' 329' ' ' THR . . . . . 0.417 ' HA ' ' O ' ' B' ' 330' ' ' LEU . 6.7 p -153.38 168.52 25.81 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.314 -0.866 . . . . 1.05 109.181 -179.979 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' D' D ' 330' ' ' LEU . . . . . . . . . . . . . 19.9 tp -150.02 129.13 12.71 Favored 'General case' 0 N--CA 1.489 1.491 0 O-C-N 121.14 -0.975 . . . . 1.07 109.686 -179.868 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' D' D ' 331' ' ' GLN . . . . . . . . . . . . . 1.2 tp60 -87.96 113.21 23.39 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.299 -0.875 . . . . 0.93 109.382 179.747 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' D' D ' 332' ' ' ILE . . . . . 0.435 ' CG2' ' HA ' ' D' ' 338' ' ' PHE . 74.7 mt -103.41 104.96 17.46 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.538 0 O-C-N 121.235 -0.915 . . . . 1.07 109.51 -179.985 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' D' D ' 333' ' ' ARG . . . . . 0.477 ' HG2' ' NH1' ' D' ' 333' ' ' ARG . 0.0 OUTLIER -71.47 150.78 44.55 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.246 -0.909 . . . . 3.42 109.246 179.84 . . . . . . . . 3 3 . 1 . 032 nuclear orig full ' D' D ' 334' ' ' GLY . . . . . . . . . . . . . . . 76.18 126.81 0.24 Allowed Glycine 0 N--CA 1.491 2.304 0 N-CA-C 109.475 -1.45 . . . . 0.41 109.475 -179.996 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' D' D ' 335' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -74.05 -32.78 63.46 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.31 -1.112 . . . . 3.58 109.63 -179.859 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' D' D ' 336' ' ' GLU . . . . . . . . . . . . . 3.2 mt-10 -58.06 -61.53 2.48 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.221 -0.925 . . . . 2.26 109.795 -179.762 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' D' D ' 337' ' ' ARG . . . . . . . . . . . . . 22.3 mmm180 -59.84 -33.61 71.99 Favored 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.319 -0.863 . . . . 3.64 109.651 -179.678 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' D' D ' 338' ' ' PHE . . . . . 0.435 ' HA ' ' CG2' ' D' ' 332' ' ' ILE . 58.6 t80 -55.99 -55.03 37.69 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.217 -0.927 . . . . 0.4 109.916 -179.697 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' D' D ' 339' ' ' GLU . . . . . . . . . . . . . 44.7 mt-10 -50.8 -34.12 26.25 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.262 -0.899 . . . . 1.99 110.41 -179.411 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' D' D ' 340' ' ' MET . . . . . . . . . . . . . 23.9 ttp -64.14 -51.41 64.03 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.045 -1.035 . . . . 1.13 110.132 -179.413 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' D' D ' 341' ' ' PHE . . . . . . . . . . . . . 44.7 m-85 -61.93 -45.5 93.42 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.179 -0.951 . . . . 0.21 109.972 -179.462 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' D' D ' 342' ' ' ARG . . . . . 0.414 ' O ' ' HB3' ' D' ' 345' ' ' ASN . 41.5 ttt180 -50.64 -40.31 52.79 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.141 -0.974 . . . . 3.15 109.876 -179.751 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' D' D ' 343' ' ' GLU . . . . . . . . . . . . . 36.0 tp10 -58.36 -51.67 68.82 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.183 -0.948 . . . . 2.35 109.77 -179.673 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' D' D ' 344' ' ' LEU . . . . . 0.454 HD23 HD23 ' C' ' 344' ' ' LEU . 84.7 mt -60.91 -32.0 71.5 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.221 -0.925 . . . . 1.06 109.425 -179.952 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' D' D ' 345' ' ' ASN . . . . . 0.414 ' HB3' ' O ' ' D' ' 342' ' ' ARG . 9.1 t-20 -58.69 -55.2 38.09 Favored 'General case' 0 N--CA 1.489 1.487 0 O-C-N 121.351 -0.843 . . . . 1.35 109.303 179.867 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' D' D ' 346' ' ' GLU . . . . . . . . . . . . . 31.5 tp10 -61.4 -32.2 72.13 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.35 -0.844 . . . . 1.69 109.839 -179.85 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' D' D ' 347' ' ' ALA . . . . . 0.434 ' HB3' ' HB2' ' C' ' 347' ' ' ALA . . . -59.61 -56.94 15.63 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.128 -0.983 . . . . 1.03 109.78 -179.669 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' D' D ' 348' ' ' LEU . . . . . 0.513 ' N ' HD23 ' D' ' 348' ' ' LEU . 3.5 mm? -61.96 -38.79 89.84 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.195 -0.941 . . . . 1.04 109.625 -179.662 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' D' D ' 349' ' ' GLU . . . . . . . . . . . . . 1.8 mt-10 -58.83 -38.17 78.07 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.293 -0.879 . . . . 1.95 110.183 -179.514 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' D' D ' 350' ' ' LEU . . . . . 0.491 HD21 ' CD1' ' C' ' 350' ' ' LEU . 7.8 tt -63.96 -43.61 95.3 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.091 -1.006 . . . . 1.16 109.852 -179.505 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' D' D ' 351' ' ' LYS . . . . . . . . . . . . . 18.7 tttm -58.32 -42.03 85.85 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.305 -0.872 . . . . 1.97 109.561 -179.758 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' D' D ' 352' ' ' ASP . . . . . . . . . . . . . 49.0 m-20 -56.04 -41.57 75.22 Favored 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.203 -0.936 . . . . 1.17 109.579 179.972 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' D' D ' 353' ' ' ALA . . . . . 0.402 ' O ' ' HB2' ' D' ' 357' ' ' LYS . . . -67.84 -25.72 65.69 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.204 -0.935 . . . . 1.21 109.513 -179.97 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' D' D ' 354' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -81.38 -1.24 44.76 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.26 -0.9 . . . . 1.68 109.474 -179.971 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' D' D ' 355' ' ' ALA . . . . . . . . . . . . . . . -69.06 -87.91 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.172 -0.955 . . . . 1.29 109.446 179.95 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' D' D ' 356' ' ' GLY . . . . . . . . . . . . . . . -81.77 41.15 2.69 Favored Glycine 0 N--CA 1.492 2.368 0 N-CA-C 110.356 -1.097 . . . . 1.28 110.356 -179.888 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' D' D ' 357' ' ' LYS . . . . . 0.402 ' HB2' ' O ' ' D' ' 353' ' ' ALA . 24.6 tttp -87.47 97.59 10.92 Favored 'General case' 0 N--CA 1.489 1.488 0 O-C-N 120.775 -1.426 . . . . 4.45 109.441 179.888 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' D' D ' 358' ' ' GLU . . . . . 0.553 ' N ' ' HD2' ' D' ' 359' ' ' PRO . 2.7 mt-10 -51.02 -53.45 48.13 Favored Pre-proline 0 N--CA 1.489 1.507 0 O-C-N 121.377 -0.827 . . . . 5.71 109.988 -179.97 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' D' D ' 359' ' ' PRO . . . . . 0.553 ' HD2' ' N ' ' D' ' 358' ' ' GLU . 3.4 Cg_exo -61.64 132.07 38.64 Favored 'Trans proline' 0 C--N 1.311 -1.425 0 C-N-CA 121.977 1.785 . . . . 5.6 110.285 -179.739 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' D' D ' 360' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.334 0 CA-C-O 117.996 -1.447 . . . . 6.97 109.522 -179.999 . . . . . . . . 0 0 . 1 . 033 nuclear orig full ' A' A ' 319' ' ' LYS . . . . . . . . . . . . . 60.7 mmtt . . . . . 0 N--CA 1.492 1.649 0 N-CA-C 109.628 -0.508 . . . . 7.95 109.628 . . . . . . . . . 0 0 . 1 . 033 nuclear orig full ' A' A ' 320' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER 59.34 -171.96 0.12 Allowed 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.194 -0.941 . . . . 6.71 109.291 -179.959 . . . . . . . . 2 2 . 1 . 033 nuclear orig full ' A' A ' 321' ' ' LYS . . . . . . . . . . . . . 2.5 ttmm -158.7 69.48 3.59 Favored Pre-proline 0 N--CA 1.493 1.683 0 O-C-N 121.161 -0.962 . . . . 6.5 109.961 -179.913 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 322' ' ' PRO . . . . . . . . . . . . . 1.9 Cg_endo -60.6 -155.97 0.02 OUTLIER 'Trans proline' 0 C--N 1.311 -1.411 0 C-N-CA 122.155 1.903 . . . . 3.3 110.164 179.526 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 323' ' ' LEU . . . . . . . . . . . . . 34.4 mt -81.12 126.49 31.53 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.221 -0.924 . . . . 3.16 109.317 179.789 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 324' ' ' ASP . . . . . 0.41 ' HB3' ' CE2' ' A' ' 327' ' ' TYR . 14.8 m-20 -80.27 143.58 33.56 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.185 -0.947 . . . . 1.53 109.609 -179.779 . . . . . . . . 2 2 . 1 . 033 nuclear orig full ' A' A ' 325' ' ' GLY . . . . . . . . . . . . . . . -68.16 -172.6 6.95 Favored Glycine 0 N--CA 1.488 2.167 0 N-CA-C 108.943 -1.663 . . . . 0.67 108.943 179.843 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 326' ' ' GLU . . . . . . . . . . . . . 33.9 mm-40 -58.94 -175.96 0.03 OUTLIER 'General case' 0 N--CA 1.489 1.489 0 O-C-N 121.395 -1.062 . . . . 2.13 109.603 179.925 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 327' ' ' TYR . . . . . 0.41 ' CE2' ' HB3' ' A' ' 324' ' ' ASP . 39.4 m-85 -149.83 105.81 3.45 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.256 -0.903 . . . . 1.0 109.638 179.928 . . . . . . . . 2 2 . 1 . 033 nuclear orig full ' A' A ' 328' ' ' PHE . . . . . 0.579 ' CZ ' ' HB2' ' C' ' 335' ' ' ARG . 24.7 m-85 -113.29 -166.51 1.09 Allowed 'General case' 0 N--CA 1.488 1.443 0 O-C-N 121.357 -0.84 . . . . 0.34 109.192 179.799 . . . . . . . . 2 2 . 1 . 033 nuclear orig full ' A' A ' 329' ' ' THR . . . . . 0.476 HG21 ' O ' ' A' ' 328' ' ' PHE . 71.2 p -153.94 173.99 15.23 Favored 'General case' 0 N--CA 1.495 1.814 0 O-C-N 121.395 -0.815 . . . . 1.05 109.18 179.559 . . . . . . . . 2 2 . 1 . 033 nuclear orig full ' A' A ' 330' ' ' LEU . . . . . . . . . . . . . 17.2 tp -150.41 131.0 13.93 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.314 -0.866 . . . . 1.07 109.394 179.845 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 331' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -87.48 112.26 22.02 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.362 -0.837 . . . . 0.91 109.124 179.793 . . . . . . . . 2 2 . 1 . 033 nuclear orig full ' A' A ' 332' ' ' ILE . . . . . 0.49 ' CG2' ' HA ' ' A' ' 338' ' ' PHE . 79.5 mt -103.47 105.79 18.98 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.477 0 O-C-N 121.075 -1.015 . . . . 1.09 109.736 -179.858 . . . . . . . . 2 2 . 1 . 033 nuclear orig full ' A' A ' 333' ' ' ARG . . . . . 0.621 ' HG2' ' CE2' ' C' ' 327' ' ' TYR . 25.9 mtt180 -72.38 148.26 45.42 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.44 -0.787 . . . . 3.41 109.871 179.914 . . . . . . . . 2 2 . 1 . 033 nuclear orig full ' A' A ' 334' ' ' GLY . . . . . . . . . . . . . . . 82.69 134.81 2.19 Favored Glycine 0 N--CA 1.491 2.322 0 N-CA-C 109.856 -1.297 . . . . 0.4 109.856 179.784 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 335' ' ' ARG . . . . . 0.46 ' HB2' ' CZ ' ' C' ' 328' ' ' PHE . 0.0 OUTLIER -80.37 -39.75 27.89 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.338 -1.095 . . . . 3.55 109.653 179.997 . . . . . . . . 3 3 . 1 . 033 nuclear orig full ' A' A ' 336' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -58.82 -61.48 2.59 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.14 -0.975 . . . . 2.29 109.891 -179.657 . . . . . . . . 2 2 . 1 . 033 nuclear orig full ' A' A ' 337' ' ' ARG . . . . . 0.448 ' NH1' ' CG ' ' A' ' 337' ' ' ARG . 0.0 OUTLIER -58.09 -30.92 66.62 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.19 -0.943 . . . . 3.64 109.529 -179.76 . . . . . . . . 3 3 . 1 . 033 nuclear orig full ' A' A ' 338' ' ' PHE . . . . . 0.49 ' HA ' ' CG2' ' A' ' 332' ' ' ILE . 50.4 t80 -55.78 -56.37 21.33 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.306 -0.871 . . . . 0.41 109.527 -179.872 . . . . . . . . 2 2 . 1 . 033 nuclear orig full ' A' A ' 339' ' ' GLU . . . . . . . . . . . . . 48.9 mt-10 -50.88 -33.27 23.32 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.231 -0.918 . . . . 1.97 109.875 -179.965 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 340' ' ' MET . . . . . . . . . . . . . 18.7 ttp -62.22 -53.3 57.14 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.29 -0.881 . . . . 1.14 110.008 -179.416 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 341' ' ' PHE . . . . . . . . . . . . . 36.9 m-85 -61.2 -49.32 77.62 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.206 -0.934 . . . . 0.21 110.202 -179.616 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 342' ' ' ARG . . . . . . . . . . . . . 4.2 ttt180 -47.43 -41.06 19.45 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.368 -0.832 . . . . 3.15 109.821 -179.972 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 343' ' ' GLU . . . . . . . . . . . . . 65.2 tt0 -59.26 -47.94 83.49 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.156 -0.965 . . . . 2.35 110.285 -179.586 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 344' ' ' LEU . . . . . . . . . . . . . 47.7 mt -63.16 -32.36 73.73 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.08 -1.013 . . . . 1.06 110.063 -179.431 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 345' ' ' ASN . . . . . . . . . . . . . 10.8 t-20 -57.96 -55.38 35.65 Favored 'General case' 0 N--CA 1.488 1.47 0 O-C-N 121.19 -0.944 . . . . 1.36 109.637 -179.756 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 346' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -61.55 -29.74 70.2 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.211 -0.93 . . . . 1.65 109.977 -179.844 . . . . . . . . 2 2 . 1 . 033 nuclear orig full ' A' A ' 347' ' ' ALA . . . . . . . . . . . . . . . -59.34 -58.93 6.47 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.278 -0.889 . . . . 1.03 110.237 -179.534 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 348' ' ' LEU . . . . . 0.469 ' N ' ' CD2' ' A' ' 348' ' ' LEU . 4.1 mm? -61.2 -42.7 99.05 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.162 -0.961 . . . . 1.04 110.005 -179.365 . . . . . . . . 2 2 . 1 . 033 nuclear orig full ' A' A ' 349' ' ' GLU . . . . . . . . . . . . . 16.2 mm-40 -57.87 -34.05 69.34 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.207 -0.933 . . . . 1.94 109.997 -179.493 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 350' ' ' LEU . . . . . 0.456 ' O ' HD22 ' A' ' 350' ' ' LEU . 6.2 tt -64.43 -44.3 91.64 Favored 'General case' 0 N--CA 1.495 1.783 0 O-C-N 121.194 -0.941 . . . . 1.17 109.651 -179.592 . . . . . . . . 2 2 . 1 . 033 nuclear orig full ' A' A ' 351' ' ' LYS . . . . . . . . . . . . . 43.8 tttt -60.46 -46.82 88.69 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.246 -0.909 . . . . 1.97 109.859 -179.694 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 352' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -54.86 -44.89 74.43 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.416 -0.803 . . . . 1.16 110.377 -179.288 . . . . . . . . 2 2 . 1 . 033 nuclear orig full ' A' A ' 353' ' ' ALA . . . . . . . . . . . . . . . -66.68 -26.98 67.29 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 120.95 -1.093 . . . . 1.22 109.608 -179.804 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 354' ' ' GLN . . . . . . . . . . . . . 8.8 tt0 -82.88 -3.52 57.01 Favored 'General case' 0 N--CA 1.488 1.475 0 O-C-N 121.001 -1.062 . . . . 1.71 109.825 -179.749 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 355' ' ' ALA . . . . . . . . . . . . . . . -69.97 -6.99 36.97 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.249 -0.907 . . . . 1.3 109.364 -179.938 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 356' ' ' GLY . . . . . . . . . . . . . . . -80.59 -8.08 87.89 Favored Glycine 0 N--CA 1.487 2.08 0 N-CA-C 109.886 -1.286 . . . . 1.3 109.886 -179.985 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 357' ' ' LYS . . . . . . . . . . . . . 6.1 mttm -91.56 115.0 27.68 Favored 'General case' 0 N--CA 1.488 1.433 0 O-C-N 121.315 -1.109 . . . . 4.46 109.608 179.875 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 358' ' ' GLU . . . . . . . . . . . . . 50.7 tt0 -43.93 135.43 3.86 Favored Pre-proline 0 N--CA 1.492 1.634 0 O-C-N 121.235 -0.916 . . . . 5.75 109.159 179.797 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 359' ' ' PRO . . . . . . . . . . . . . 2.8 Cg_endo -62.82 122.76 11.18 Favored 'Trans proline' 0 C--N 1.31 -1.496 0 C-N-CA 121.859 1.706 . . . . 5.63 109.945 -179.775 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 360' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.488 2.152 0 N-CA-C 109.318 -1.513 . . . . 6.97 109.318 179.83 . . . . . . . . 0 0 . 1 . 033 nuclear orig full ' B' B ' 319' ' ' LYS . . . . . . . . . . . . . 51.7 mmtt . . . . . 0 N--CA 1.49 1.562 0 CA-C-O 121.386 0.612 . . . . 7.95 109.588 . . . . . . . . . 0 0 . 1 . 033 nuclear orig full ' B' B ' 320' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER 56.75 -171.25 0.09 Allowed 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.066 -1.021 . . . . 6.73 109.271 -179.772 . . . . . . . . 2 2 . 1 . 033 nuclear orig full ' B' B ' 321' ' ' LYS . . . . . . . . . . . . . 4.2 ttmm -158.74 69.48 3.57 Favored Pre-proline 0 N--CA 1.491 1.611 0 O-C-N 121.288 -0.882 . . . . 6.5 109.755 -179.906 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' B' B ' 322' ' ' PRO . . . . . . . . . . . . . 2.1 Cg_endo -60.99 -156.83 0.02 OUTLIER 'Trans proline' 0 C--N 1.309 -1.526 0 C-N-CA 122.138 1.892 . . . . 3.29 109.959 179.884 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' B' B ' 323' ' ' LEU . . . . . . . . . . . . . 29.2 mt -80.23 126.05 30.63 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.125 -0.984 . . . . 3.18 109.493 -179.977 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' B' B ' 324' ' ' ASP . . . . . 0.421 ' HB3' ' OH ' ' B' ' 327' ' ' TYR . 17.8 m-20 -79.89 143.84 33.93 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.193 -0.942 . . . . 1.53 109.921 -179.855 . . . . . . . . 2 2 . 1 . 033 nuclear orig full ' B' B ' 325' ' ' GLY . . . . . . . . . . . . . . . -68.66 -172.64 7.64 Favored Glycine 0 N--CA 1.488 2.148 0 N-CA-C 109.528 -1.429 . . . . 0.65 109.528 179.806 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' B' B ' 326' ' ' GLU . . . . . . . . . . . . . 35.1 mm-40 -58.53 -177.04 0.03 OUTLIER 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.464 -1.021 . . . . 2.13 109.791 -179.97 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' B' B ' 327' ' ' TYR . . . . . 0.614 ' CE1' ' HG2' ' D' ' 333' ' ' ARG . 39.2 m-85 -150.02 104.38 3.28 Favored 'General case' 0 N--CA 1.489 1.487 0 O-C-N 121.325 -0.859 . . . . 0.99 109.678 -179.957 . . . . . . . . 2 2 . 1 . 033 nuclear orig full ' B' B ' 328' ' ' PHE . . . . . 0.462 ' O ' HG21 ' B' ' 329' ' ' THR . 18.4 m-85 -112.43 -163.86 0.88 Allowed 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.287 -0.883 . . . . 0.36 109.308 179.657 . . . . . . . . 2 2 . 1 . 033 nuclear orig full ' B' B ' 329' ' ' THR . . . . . 0.464 ' HA ' ' O ' ' D' ' 330' ' ' LEU . 67.1 p -154.76 176.3 12.63 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.28 -0.887 . . . . 1.05 109.36 179.452 . . . . . . . . 2 2 . 1 . 033 nuclear orig full ' B' B ' 330' ' ' LEU . . . . . 0.467 ' O ' ' HA ' ' D' ' 329' ' ' THR . 18.3 tp -151.9 130.32 12.13 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.183 -0.948 . . . . 1.07 109.138 179.653 . . . . . . . . 2 2 . 1 . 033 nuclear orig full ' B' B ' 331' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -87.38 111.95 21.62 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.221 -0.924 . . . . 0.91 109.144 179.72 . . . . . . . . 2 2 . 1 . 033 nuclear orig full ' B' B ' 332' ' ' ILE . . . . . 0.441 ' CG2' ' HA ' ' B' ' 338' ' ' PHE . 72.0 mt -103.52 107.32 21.93 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.531 0 O-C-N 120.886 -1.134 . . . . 1.08 109.659 -179.815 . . . . . . . . 2 2 . 1 . 033 nuclear orig full ' B' B ' 333' ' ' ARG . . . . . 0.615 ' HG2' ' CE1' ' D' ' 327' ' ' TYR . 27.2 mtt180 -73.9 147.96 42.69 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.356 -0.84 . . . . 3.42 109.824 -179.857 . . . . . . . . 2 2 . 1 . 033 nuclear orig full ' B' B ' 334' ' ' GLY . . . . . . . . . . . . . . . 82.47 135.97 2.35 Favored Glycine 0 N--CA 1.488 2.118 0 N-CA-C 109.643 -1.383 . . . . 0.4 109.643 179.799 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' B' B ' 335' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -80.68 -40.35 25.6 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.303 -1.116 . . . . 3.55 109.96 -179.964 . . . . . . . . 2 2 . 1 . 033 nuclear orig full ' B' B ' 336' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -58.61 -59.98 4.53 Favored 'General case' 0 N--CA 1.495 1.811 0 O-C-N 121.102 -0.999 . . . . 2.28 109.989 -179.638 . . . . . . . . 2 2 . 1 . 033 nuclear orig full ' B' B ' 337' ' ' ARG . . . . . 0.461 ' CG ' ' NH1' ' B' ' 337' ' ' ARG . 0.0 OUTLIER -59.23 -29.97 67.9 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.113 -0.992 . . . . 3.64 109.61 -179.674 . . . . . . . . 3 3 . 1 . 033 nuclear orig full ' B' B ' 338' ' ' PHE . . . . . 0.441 ' HA ' ' CG2' ' B' ' 332' ' ' ILE . 51.8 t80 -56.83 -57.06 14.14 Favored 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.509 -0.745 . . . . 0.39 109.402 179.837 . . . . . . . . 2 2 . 1 . 033 nuclear orig full ' B' B ' 339' ' ' GLU . . . . . . . . . . . . . 48.3 mt-10 -50.91 -31.72 18.46 Favored 'General case' 0 N--CA 1.493 1.722 0 O-C-N 121.293 -0.879 . . . . 1.98 109.875 -179.774 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' B' B ' 340' ' ' MET . . . . . . . . . . . . . 18.8 ttp -63.88 -53.55 48.74 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.286 -0.884 . . . . 1.14 110.04 -179.57 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' B' B ' 341' ' ' PHE . . . . . . . . . . . . . 37.5 m-85 -61.33 -49.0 78.76 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.232 -0.917 . . . . 0.22 109.866 -179.481 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' B' B ' 342' ' ' ARG . . . . . . . . . . . . . 4.6 ttt180 -47.45 -40.91 19.34 Favored 'General case' 0 N--CA 1.493 1.717 0 O-C-N 121.171 -0.955 . . . . 3.15 109.928 -179.756 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' B' B ' 343' ' ' GLU . . . . . . . . . . . . . 62.5 tt0 -59.42 -48.04 83.18 Favored 'General case' 0 N--CA 1.495 1.811 0 O-C-N 121.365 -0.835 . . . . 2.35 110.302 -179.316 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' B' B ' 344' ' ' LEU . . . . . . . . . . . . . 37.6 mt -62.44 -33.26 74.47 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.192 -0.942 . . . . 1.05 109.949 -179.485 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' B' B ' 345' ' ' ASN . . . . . 0.447 ' HB2' HD23 ' D' ' 330' ' ' LEU . 13.2 t-20 -56.92 -56.46 21.31 Favored 'General case' 0 C--N 1.299 -1.596 0 O-C-N 121.282 -0.886 . . . . 1.35 109.862 -179.773 . . . . . . . . 2 2 . 1 . 033 nuclear orig full ' B' B ' 346' ' ' GLU . . . . . . . . . . . . . 1.3 tt0 -61.0 -28.59 69.14 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.224 -0.923 . . . . 1.66 110.073 -179.627 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' B' B ' 347' ' ' ALA . . . . . . . . . . . . . . . -60.36 -57.69 11.68 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.118 -0.989 . . . . 1.02 110.111 -179.421 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' B' B ' 348' ' ' LEU . . . . . 0.436 ' CD2' ' N ' ' B' ' 348' ' ' LEU . 4.1 mm? -62.05 -42.88 99.65 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.149 -0.97 . . . . 1.05 110.159 -179.476 . . . . . . . . 2 2 . 1 . 033 nuclear orig full ' B' B ' 349' ' ' GLU . . . . . . . . . . . . . 13.7 mm-40 -57.91 -35.23 70.75 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.045 -1.034 . . . . 1.95 110.066 -179.488 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' B' B ' 350' ' ' LEU . . . . . 0.446 HD23 HD23 ' A' ' 350' ' ' LEU . 6.5 tt -62.74 -45.01 94.71 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.002 -1.061 . . . . 1.18 109.53 -179.652 . . . . . . . . 2 2 . 1 . 033 nuclear orig full ' B' B ' 351' ' ' LYS . . . . . . . . . . . . . 37.8 tttt -59.87 -47.17 86.82 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.37 -0.831 . . . . 1.96 109.764 -179.769 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' B' B ' 352' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -54.14 -44.86 71.74 Favored 'General case' 0 N--CA 1.488 1.449 0 O-C-N 121.341 -0.849 . . . . 1.16 110.252 -179.441 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' B' B ' 353' ' ' ALA . . . . . . . . . . . . . . . -66.61 -29.43 69.47 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.026 -1.046 . . . . 1.21 109.46 -179.848 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' B' B ' 354' ' ' GLN . . . . . . . . . . . . . 7.7 tt0 -81.06 -1.81 45.59 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.107 -0.996 . . . . 1.69 109.962 -179.622 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' B' B ' 355' ' ' ALA . . . . . . . . . . . . . . . -70.02 -7.27 39.6 Favored 'General case' 0 C--N 1.303 -1.434 0 O-C-N 121.025 -1.047 . . . . 1.3 109.33 -179.992 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' B' B ' 356' ' ' GLY . . . . . . . . . . . . . . . -80.82 -6.23 89.54 Favored Glycine 0 N--CA 1.49 2.274 0 N-CA-C 110.001 -1.24 . . . . 1.29 110.001 -179.86 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' B' B ' 357' ' ' LYS . . . . . 0.424 ' O ' ' C ' ' B' ' 358' ' ' GLU . 5.3 mttm -91.38 113.92 26.31 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.127 -1.22 . . . . 4.45 109.369 179.744 . . . . . . . . 2 2 . 1 . 033 nuclear orig full ' B' B ' 358' ' ' GLU . . . . . 0.424 ' C ' ' O ' ' B' ' 357' ' ' LYS . 69.9 tt0 -45.31 135.31 5.51 Favored Pre-proline 0 N--CA 1.489 1.493 0 O-C-N 121.305 -0.872 . . . . 5.72 108.742 179.973 . . . . . . . . 2 2 . 1 . 033 nuclear orig full ' B' B ' 359' ' ' PRO . . . . . . . . . . . . . 2.3 Cg_endo -61.18 122.23 10.83 Favored 'Trans proline' 0 C--N 1.309 -1.545 0 C-N-CA 121.908 1.739 . . . . 5.6 110.162 -179.551 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' B' B ' 360' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 2.405 0 N-CA-C 109.09 -1.604 . . . . 6.98 109.09 179.903 . . . . . . . . 0 0 . 1 . 033 nuclear orig full ' C' C ' 319' ' ' LYS . . . . . . . . . . . . . 2.9 tppt? . . . . . 0 N--CA 1.489 1.51 0 N-CA-C 109.418 -0.586 . . . . 7.03 109.418 . . . . . . . . . 0 0 . 1 . 033 nuclear orig full ' C' C ' 320' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 58.27 -176.77 0.08 Allowed 'General case' 0 C--N 1.304 -1.412 0 O-C-N 121.129 -0.982 . . . . 6.84 109.645 179.958 . . . . . . . . 2 2 . 1 . 033 nuclear orig full ' C' C ' 321' ' ' LYS . . . . . . . . . . . . . 13.9 mttt 56.22 77.26 0.43 Allowed Pre-proline 0 N--CA 1.49 1.535 0 O-C-N 121.293 -0.879 . . . . 6.78 109.407 179.926 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' C' C ' 322' ' ' PRO . . . . . . . . . . . . . 1.7 Cg_endo -64.04 -81.32 0.01 OUTLIER 'Trans proline' 0 C--N 1.31 -1.496 0 C-N-CA 122.284 1.989 . . . . 3.98 110.184 -179.843 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' C' C ' 323' ' ' LEU . . . . . . . . . . . . . 38.8 mt -81.53 121.31 26.14 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 120.988 -1.07 . . . . 4.31 109.884 -179.746 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' C' C ' 324' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -81.02 167.05 20.21 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.37 -0.831 . . . . 1.63 109.144 179.451 . . . . . . . . 2 2 . 1 . 033 nuclear orig full ' C' C ' 325' ' ' GLY . . . . . . . . . . . . . . . -66.96 165.28 42.29 Favored Glycine 0 N--CA 1.487 2.074 0 N-CA-C 109.086 -1.606 . . . . 0.82 109.086 179.782 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' C' C ' 326' ' ' GLU . . . . . . . . . . . . . 2.7 mp0 -57.07 -167.89 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.344 -1.091 . . . . 2.17 109.608 179.968 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' C' C ' 327' ' ' TYR . . . . . 0.621 ' CE2' ' HG2' ' A' ' 333' ' ' ARG . 46.3 m-85 -147.21 104.74 3.69 Favored 'General case' 0 N--CA 1.487 1.413 0 O-C-N 121.263 -0.898 . . . . 1.03 109.204 -179.959 . . . . . . . . 2 2 . 1 . 033 nuclear orig full ' C' C ' 328' ' ' PHE . . . . . 0.46 ' CZ ' ' HB2' ' A' ' 335' ' ' ARG . 67.7 m-85 -106.87 -168.8 1.46 Allowed 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.287 -0.883 . . . . 0.37 109.147 -179.915 . . . . . . . . 2 2 . 1 . 033 nuclear orig full ' C' C ' 329' ' ' THR . . . . . . . . . . . . . 18.0 p -150.97 167.03 28.85 Favored 'General case' 0 C--N 1.302 -1.498 0 O-C-N 121.472 -0.768 . . . . 1.04 108.978 -179.847 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' C' C ' 330' ' ' LEU . . . . . . . . . . . . . 47.0 tp -150.92 127.7 10.93 Favored 'General case' 0 C--N 1.302 -1.488 0 O-C-N 121.2 -0.937 . . . . 1.09 109.688 -179.491 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' C' C ' 331' ' ' GLN . . . . . . . . . . . . . 5.4 tp60 -86.71 113.41 22.54 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.375 -0.828 . . . . 1.48 109.488 179.903 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' C' C ' 332' ' ' ILE . . . . . 0.454 HD12 ' CD2' ' C' ' 341' ' ' PHE . 30.3 mt -105.2 109.49 27.88 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.51 0 O-C-N 121.547 -0.721 . . . . 1.08 109.883 -179.853 . . . . . . . . 2 2 . 1 . 033 nuclear orig full ' C' C ' 333' ' ' ARG . . . . . . . . . . . . . 79.3 mtt180 -74.23 147.65 42.27 Favored 'General case' 0 C--N 1.302 -1.472 0 O-C-N 121.306 -0.871 . . . . 3.36 109.635 179.781 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' C' C ' 334' ' ' GLY . . . . . . . . . . . . . . . 80.23 127.0 0.67 Allowed Glycine 0 N--CA 1.486 1.987 0 N-CA-C 109.361 -1.495 . . . . 0.35 109.361 -179.857 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' C' C ' 335' ' ' ARG . . . . . 0.579 ' HB2' ' CZ ' ' A' ' 328' ' ' PHE . 0.0 OUTLIER -78.35 -33.12 49.29 Favored 'General case' 0 N--CA 1.487 1.412 0 O-C-N 121.201 -1.176 . . . . 3.23 109.463 179.972 . . . . . . . . 3 3 . 1 . 033 nuclear orig full ' C' C ' 336' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -57.52 -62.56 1.7 Allowed 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.127 -0.983 . . . . 2.62 108.986 179.567 . . . . . . . . 2 2 . 1 . 033 nuclear orig full ' C' C ' 337' ' ' ARG . . . . . 0.545 ' HG2' ' NH1' ' C' ' 337' ' ' ARG . 0.2 OUTLIER -59.52 -31.61 69.55 Favored 'General case' 0 N--CA 1.489 1.483 0 O-C-N 121.745 -0.597 . . . . 3.61 109.656 -179.886 . . . . . . . . 3 3 . 1 . 033 nuclear orig full ' C' C ' 338' ' ' PHE . . . . . 0.427 ' HA ' HG23 ' C' ' 332' ' ' ILE . 46.3 t80 -54.52 -59.42 4.72 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.171 -0.956 . . . . 0.43 109.755 -179.466 . . . . . . . . 2 2 . 1 . 033 nuclear orig full ' C' C ' 339' ' ' GLU . . . . . . . . . . . . . 9.9 mm-40 -48.32 -32.65 7.71 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.434 -0.792 . . . . 2.05 110.247 -179.333 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' C' C ' 340' ' ' MET . . . . . . . . . . . . . 34.6 ttp -63.91 -50.88 66.96 Favored 'General case' 0 N--CA 1.494 1.742 0 O-C-N 121.251 -0.905 . . . . 1.1 109.818 -179.809 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' C' C ' 341' ' ' PHE . . . . . 0.454 ' CD2' HD12 ' C' ' 332' ' ' ILE . 49.7 m-85 -62.83 -52.91 61.3 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 120.959 -1.088 . . . . 0.21 109.762 -179.804 . . . . . . . . 2 2 . 1 . 033 nuclear orig full ' C' C ' 342' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -47.81 -39.96 19.76 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.442 -0.786 . . . . 3.42 110.005 -179.428 . . . . . . . . 2 2 . 1 . 033 nuclear orig full ' C' C ' 343' ' ' GLU . . . . . . . . . . . . . 4.5 tp10 -60.8 -44.88 96.27 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 120.974 -1.079 . . . . 2.14 109.461 -179.998 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' C' C ' 344' ' ' LEU . . . . . 0.471 HD23 ' CD2' ' D' ' 344' ' ' LEU . 27.0 mt -60.35 -41.02 92.8 Favored 'General case' 0 N--CA 1.487 1.395 0 O-C-N 121.294 -0.879 . . . . 1.09 109.593 -179.939 . . . . . . . . 2 2 . 1 . 033 nuclear orig full ' C' C ' 345' ' ' ASN . . . . . . . . . . . . . 48.9 t-20 -54.61 -53.7 51.24 Favored 'General case' 0 N--CA 1.489 1.488 0 O-C-N 121.313 -0.867 . . . . 1.38 109.818 -179.664 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' C' C ' 346' ' ' GLU . . . . . . . . . . . . . 2.9 tp10 -58.58 -29.84 66.72 Favored 'General case' 0 C--N 1.303 -1.449 0 O-C-N 121.108 -0.995 . . . . 2.21 109.362 -179.872 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' C' C ' 347' ' ' ALA . . . . . . . . . . . . . . . -63.12 -51.82 65.0 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.16 -0.962 . . . . 1.03 109.766 179.943 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' C' C ' 348' ' ' LEU . . . . . 0.462 HD21 ' O ' ' C' ' 344' ' ' LEU . 3.6 mm? -62.88 -43.6 98.35 Favored 'General case' 0 N--CA 1.494 1.743 0 O-C-N 121.04 -1.038 . . . . 1.06 109.773 -179.619 . . . . . . . . 2 2 . 1 . 033 nuclear orig full ' C' C ' 349' ' ' GLU . . . . . . . . . . . . . 3.1 mm-40 -59.25 -36.82 76.19 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.284 -0.885 . . . . 2.19 110.085 -179.376 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' C' C ' 350' ' ' LEU . . . . . 0.459 HD22 ' O ' ' C' ' 350' ' ' LEU . 5.5 tt -62.75 -48.91 77.13 Favored 'General case' 0 C--N 1.302 -1.466 0 O-C-N 121.12 -0.987 . . . . 1.2 109.29 -179.775 . . . . . . . . 2 2 . 1 . 033 nuclear orig full ' C' C ' 351' ' ' LYS . . . . . . . . . . . . . 27.4 tttm -58.23 -39.66 79.67 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.198 -0.939 . . . . 1.92 109.06 179.662 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' C' C ' 352' ' ' ASP . . . . . . . . . . . . . 96.2 m-20 -54.44 -31.7 55.96 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.334 -0.853 . . . . 1.19 109.579 179.888 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' C' C ' 353' ' ' ALA . . . . . . . . . . . . . . . -64.24 -37.02 85.99 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.42 -0.8 . . . . 1.15 109.631 -179.626 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' C' C ' 354' ' ' GLN . . . . . 0.403 ' OE1' HD22 ' C' ' 350' ' ' LEU . 0.0 OUTLIER -81.97 -2.28 50.94 Favored 'General case' 0 N--CA 1.489 1.489 0 O-C-N 121.215 -0.928 . . . . 1.7 110.329 -179.423 . . . . . . . . 3 3 . 1 . 033 nuclear orig full ' C' C ' 355' ' ' ALA . . . . . . . . . . . . . . . -73.42 -4.89 36.42 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 120.962 -1.086 . . . . 1.3 110.11 -179.907 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' C' C ' 356' ' ' GLY . . . . . . . . . . . . . . . -80.97 -12.77 82.24 Favored Glycine 0 N--CA 1.494 2.558 0 C-N-CA 119.569 -1.3 . . . . 1.33 110.021 -179.699 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' C' C ' 357' ' ' LYS . . . . . 0.435 ' O ' ' HD3' ' C' ' 359' ' ' PRO . 0.4 OUTLIER -91.89 99.77 12.56 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.199 -1.177 . . . . 4.39 110.181 -179.812 . . . . . . . . 3 3 . 1 . 033 nuclear orig full ' C' C ' 358' ' ' GLU . . . . . 0.509 ' CG ' ' O ' ' C' ' 358' ' ' GLU . 4.2 pt-20 -50.96 108.93 1.15 Allowed Pre-proline 0 N--CA 1.492 1.627 0 O-C-N 121.275 -0.89 . . . . 5.75 109.446 179.669 . . . . . . . . 2 2 . 1 . 033 nuclear orig full ' C' C ' 359' ' ' PRO . . . . . 0.435 ' HD3' ' O ' ' C' ' 357' ' ' LYS . 4.9 Cg_exo -58.9 113.45 1.58 Allowed 'Trans proline' 0 C--N 1.313 -1.34 0 C-N-CA 122.056 1.837 . . . . 5.54 110.143 179.984 . . . . . . . . 2 2 . 1 . 033 nuclear orig full ' C' C ' 360' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.493 2.457 0 CA-C-O 117.884 -1.509 . . . . 6.5 109.673 -179.949 . . . . . . . . 0 0 . 1 . 033 nuclear orig full ' D' D ' 319' ' ' LYS . . . . . . . . . . . . . 51.2 mmtt . . . . . 0 N--CA 1.49 1.569 0 CA-C-O 121.39 0.614 . . . . 7.93 109.53 . . . . . . . . . 0 0 . 1 . 033 nuclear orig full ' D' D ' 320' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER 56.42 -170.7 0.08 Allowed 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.181 -0.95 . . . . 6.7 109.557 -179.696 . . . . . . . . 2 2 . 1 . 033 nuclear orig full ' D' D ' 321' ' ' LYS . . . . . . . . . . . . . 3.2 ttmm -158.8 68.23 3.38 Favored Pre-proline 0 N--CA 1.487 1.42 0 O-C-N 121.433 -0.792 . . . . 6.49 109.622 -179.918 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' D' D ' 322' ' ' PRO . . . . . . . . . . . . . 1.6 Cg_endo -60.93 -157.87 0.02 OUTLIER 'Trans proline' 0 C--N 1.311 -1.441 0 C-N-CA 122.283 1.989 . . . . 3.29 110.232 179.783 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' D' D ' 323' ' ' LEU . . . . . . . . . . . . . 34.0 mt -79.58 125.73 29.98 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.176 -0.952 . . . . 3.16 109.211 -179.935 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' D' D ' 324' ' ' ASP . . . . . . . . . . . . . 22.9 m-20 -79.59 143.43 34.75 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.103 -0.998 . . . . 1.54 109.669 -179.731 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' D' D ' 325' ' ' GLY . . . . . . . . . . . . . . . -68.28 -173.53 7.83 Favored Glycine 0 N--CA 1.488 2.128 0 N-CA-C 109.194 -1.563 . . . . 0.65 109.194 179.562 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' D' D ' 326' ' ' GLU . . . . . . . . . . . . . 41.3 mm-40 -59.27 -177.37 0.04 OUTLIER 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.286 -1.126 . . . . 2.13 109.65 -179.948 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' D' D ' 327' ' ' TYR . . . . . 0.615 ' CE1' ' HG2' ' B' ' 333' ' ' ARG . 41.0 m-85 -148.78 105.49 3.56 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.281 -0.887 . . . . 1.0 109.7 179.989 . . . . . . . . 2 2 . 1 . 033 nuclear orig full ' D' D ' 328' ' ' PHE . . . . . 0.476 ' O ' HG21 ' D' ' 329' ' ' THR . 22.1 m-85 -112.95 -165.44 0.99 Allowed 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.371 -0.83 . . . . 0.34 109.176 179.582 . . . . . . . . 2 2 . 1 . 033 nuclear orig full ' D' D ' 329' ' ' THR . . . . . 0.476 HG21 ' O ' ' D' ' 328' ' ' PHE . 78.3 p -154.02 173.87 15.42 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.194 -0.941 . . . . 1.05 109.257 179.783 . . . . . . . . 2 2 . 1 . 033 nuclear orig full ' D' D ' 330' ' ' LEU . . . . . 0.464 ' O ' ' HA ' ' B' ' 329' ' ' THR . 21.5 tp -150.58 129.81 12.78 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.265 -0.897 . . . . 1.07 109.212 179.639 . . . . . . . . 2 2 . 1 . 033 nuclear orig full ' D' D ' 331' ' ' GLN . . . . . . . . . . . . . 1.1 tt0 -86.98 112.83 22.21 Favored 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.165 -0.959 . . . . 0.93 109.331 179.756 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' D' D ' 332' ' ' ILE . . . . . 0.44 ' CG2' ' HA ' ' D' ' 338' ' ' PHE . 73.5 mt -103.94 107.56 22.58 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.505 0 O-C-N 121.108 -0.995 . . . . 1.07 109.671 -179.784 . . . . . . . . 2 2 . 1 . 033 nuclear orig full ' D' D ' 333' ' ' ARG . . . . . 0.614 ' HG2' ' CE1' ' B' ' 327' ' ' TYR . 32.2 mtt180 -74.1 148.27 41.99 Favored 'General case' 0 C--N 1.304 -1.37 0 O-C-N 121.413 -0.804 . . . . 3.42 109.672 -179.886 . . . . . . . . 2 2 . 1 . 033 nuclear orig full ' D' D ' 334' ' ' GLY . . . . . . . . . . . . . . . 82.84 134.48 2.17 Favored Glycine 0 N--CA 1.486 1.978 0 N-CA-C 109.598 -1.401 . . . . 0.41 109.598 179.988 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' D' D ' 335' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -79.88 -40.8 27.54 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.4 -1.059 . . . . 3.58 109.69 -179.795 . . . . . . . . 2 2 . 1 . 033 nuclear orig full ' D' D ' 336' ' ' GLU . . . . . . . . . . . . . 1.7 mt-10 -58.66 -59.12 5.9 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.221 -0.924 . . . . 2.26 110.044 -179.717 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' D' D ' 337' ' ' ARG . . . . . 0.443 ' NH1' ' CG ' ' D' ' 337' ' ' ARG . 0.0 OUTLIER -59.53 -31.91 69.83 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.142 -0.974 . . . . 3.64 109.756 -179.657 . . . . . . . . 3 3 . 1 . 033 nuclear orig full ' D' D ' 338' ' ' PHE . . . . . 0.44 ' HA ' ' CG2' ' D' ' 332' ' ' ILE . 46.7 t80 -55.66 -56.7 17.27 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.259 -0.901 . . . . 0.4 109.783 -179.957 . . . . . . . . 2 2 . 1 . 033 nuclear orig full ' D' D ' 339' ' ' GLU . . . . . . . . . . . . . 44.1 mt-10 -50.72 -32.75 20.45 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.059 -1.026 . . . . 1.99 109.735 -179.87 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' D' D ' 340' ' ' MET . . . . . . . . . . . . . 17.3 ttp -62.49 -52.66 62.61 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.187 -0.945 . . . . 1.13 109.99 -179.535 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' D' D ' 341' ' ' PHE . . . . . . . . . . . . . 40.2 m-85 -62.32 -51.14 68.85 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.184 -0.948 . . . . 0.21 109.773 -179.814 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' D' D ' 342' ' ' ARG . . . . . . . . . . . . . 4.1 ttt180 -45.17 -39.51 6.22 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.284 -0.885 . . . . 3.15 109.92 -179.76 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' D' D ' 343' ' ' GLU . . . . . . . . . . . . . 60.1 tt0 -60.96 -48.48 81.64 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.136 -0.977 . . . . 2.35 110.213 -179.675 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' D' D ' 344' ' ' LEU . . . . . 0.471 ' CD2' HD23 ' C' ' 344' ' ' LEU . 49.7 mt -62.13 -33.06 73.77 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.052 -1.03 . . . . 1.06 109.878 -179.459 . . . . . . . . 2 2 . 1 . 033 nuclear orig full ' D' D ' 345' ' ' ASN . . . . . 0.434 ' HB2' HD23 ' B' ' 330' ' ' LEU . 14.3 t-20 -56.96 -56.51 20.74 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.299 -0.875 . . . . 1.35 109.558 -179.582 . . . . . . . . 2 2 . 1 . 033 nuclear orig full ' D' D ' 346' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -60.85 -29.1 69.32 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.192 -0.942 . . . . 1.69 110.133 -179.716 . . . . . . . . 2 2 . 1 . 033 nuclear orig full ' D' D ' 347' ' ' ALA . . . . . . . . . . . . . . . -59.7 -58.53 8.17 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.152 -0.968 . . . . 1.03 110.254 -179.502 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' D' D ' 348' ' ' LEU . . . . . 0.449 ' CD2' ' N ' ' D' ' 348' ' ' LEU . 4.1 mm? -62.02 -42.18 98.88 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.157 -0.964 . . . . 1.04 110.069 -179.256 . . . . . . . . 2 2 . 1 . 033 nuclear orig full ' D' D ' 349' ' ' GLU . . . . . . . . . . . . . 9.1 mm-40 -58.6 -34.26 70.92 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.033 -1.042 . . . . 1.95 110.132 -179.349 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' D' D ' 350' ' ' LEU . . . . . 0.464 ' O ' HD22 ' D' ' 350' ' ' LEU . 6.4 tt -64.0 -45.15 90.24 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.248 -0.907 . . . . 1.16 109.499 -179.633 . . . . . . . . 2 2 . 1 . 033 nuclear orig full ' D' D ' 351' ' ' LYS . . . . . . . . . . . . . 48.2 tttt -59.5 -46.08 89.85 Favored 'General case' 0 N--CA 1.488 1.448 0 O-C-N 121.292 -0.88 . . . . 1.97 109.676 -179.825 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' D' D ' 352' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -55.27 -45.01 76.14 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.338 -0.851 . . . . 1.17 110.119 -179.419 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' D' D ' 353' ' ' ALA . . . . . . . . . . . . . . . -66.71 -29.41 69.39 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 120.794 -1.192 . . . . 1.21 109.576 -179.678 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' D' D ' 354' ' ' GLN . . . . . . . . . . . . . 8.0 tt0 -80.98 -2.25 47.1 Favored 'General case' 0 N--CA 1.489 1.481 0 O-C-N 121.208 -0.933 . . . . 1.68 109.798 -179.769 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' D' D ' 355' ' ' ALA . . . . . . . . . . . . . . . -70.58 -6.2 34.82 Favored 'General case' 0 C--N 1.301 -1.522 0 O-C-N 121.094 -1.004 . . . . 1.29 109.156 179.691 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' D' D ' 356' ' ' GLY . . . . . . . . . . . . . . . -80.54 -7.98 88.0 Favored Glycine 0 N--CA 1.49 2.284 0 N-CA-C 109.994 -1.242 . . . . 1.28 109.994 179.955 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' D' D ' 357' ' ' LYS . . . . . 0.419 ' O ' ' C ' ' D' ' 358' ' ' GLU . 6.0 mttm -90.38 115.94 27.95 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.041 -1.27 . . . . 4.45 109.693 179.953 . . . . . . . . 2 2 . 1 . 033 nuclear orig full ' D' D ' 358' ' ' GLU . . . . . 0.423 ' CG ' ' HD2' ' D' ' 359' ' ' PRO . 53.8 tt0 -45.51 137.13 5.49 Favored Pre-proline 0 N--CA 1.487 1.425 0 O-C-N 121.277 -0.889 . . . . 5.71 108.875 179.855 . . . . . . . . 2 2 . 1 . 033 nuclear orig full ' D' D ' 359' ' ' PRO . . . . . 0.423 ' HD2' ' CG ' ' D' ' 358' ' ' GLU . 3.7 Cg_exo -61.39 119.85 7.21 Favored 'Trans proline' 0 C--N 1.311 -1.444 0 C-N-CA 121.794 1.663 . . . . 5.6 110.116 -179.768 . . . . . . . . 2 2 . 1 . 033 nuclear orig full ' D' D ' 360' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.215 0 N-CA-C 109.525 -1.43 . . . . 6.97 109.525 179.831 . . . . . . . . 0 0 . 1 . 034 nuclear orig full ' A' A ' 319' ' ' LYS . . . . . 0.45 ' O ' ' CB ' ' A' ' 320' ' ' LYS . 9.3 mmtt . . . . . 0 N--CA 1.49 1.547 0 CA-C-O 121.331 0.586 . . . . 7.95 109.571 . . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 320' ' ' LYS . . . . . 0.45 ' CB ' ' O ' ' A' ' 319' ' ' LYS . 0.1 OUTLIER 72.05 8.28 5.92 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.421 -0.799 . . . . 6.71 109.666 -179.858 . . . . . . . . 3 3 . 1 . 034 nuclear orig full ' A' A ' 321' ' ' LYS . . . . . 0.511 ' N ' ' HD3' ' A' ' 322' ' ' PRO . 0.3 OUTLIER -158.41 61.61 2.08 Favored Pre-proline 0 N--CA 1.491 1.597 0 O-C-N 121.215 -0.928 . . . . 6.5 109.446 179.651 . . . . . . . . 3 3 . 1 . 034 nuclear orig full ' A' A ' 322' ' ' PRO . . . . . 0.511 ' HD3' ' N ' ' A' ' 321' ' ' LYS . 2.1 Cg_endo -62.35 93.0 0.13 Allowed 'Trans proline' 0 C--N 1.31 -1.486 0 C-N-CA 122.333 2.022 . . . . 3.3 110.536 -179.964 . . . . . . . . 2 2 . 1 . 034 nuclear orig full ' A' A ' 323' ' ' LEU . . . . . . . . . . . . . 87.7 mt -82.42 72.59 9.48 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.107 -0.996 . . . . 3.16 109.611 179.859 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 324' ' ' ASP . . . . . 0.473 ' HB2' ' OH ' ' A' ' 327' ' ' TYR . 4.5 m-20 -80.57 177.94 8.67 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.119 -0.988 . . . . 1.53 109.421 179.809 . . . . . . . . 2 2 . 1 . 034 nuclear orig full ' A' A ' 325' ' ' GLY . . . . . . . . . . . . . . . -70.1 -154.02 1.04 Allowed Glycine 0 N--CA 1.49 2.279 0 N-CA-C 109.434 -1.466 . . . . 0.67 109.434 179.774 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 326' ' ' GLU . . . . . . . . . . . . . 4.2 mt-10 -58.86 -167.08 0.01 OUTLIER 'General case' 0 N--CA 1.487 1.409 0 O-C-N 121.291 -1.123 . . . . 2.13 109.404 179.922 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 327' ' ' TYR . . . . . 0.53 ' CE1' ' CG ' ' C' ' 333' ' ' ARG . 39.0 m-85 -148.96 109.81 4.29 Favored 'General case' 0 N--CA 1.489 1.478 0 O-C-N 121.35 -0.844 . . . . 1.0 109.463 179.9 . . . . . . . . 2 2 . 1 . 034 nuclear orig full ' A' A ' 328' ' ' PHE . . . . . 0.407 ' CE2' ' HA ' ' C' ' 335' ' ' ARG . 88.0 m-85 -113.64 -169.41 1.5 Allowed 'General case' 0 C--N 1.302 -1.464 0 O-C-N 121.353 -0.842 . . . . 0.34 108.934 179.772 . . . . . . . . 2 2 . 1 . 034 nuclear orig full ' A' A ' 329' ' ' THR . . . . . . . . . . . . . 23.5 p -153.15 169.77 22.16 Favored 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.013 -1.055 . . . . 1.05 109.517 -179.97 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 330' ' ' LEU . . . . . 0.422 ' O ' ' HA ' ' C' ' 329' ' ' THR . 17.4 tp -150.83 127.2 10.68 Favored 'General case' 0 N--CA 1.488 1.46 0 O-C-N 121.288 -0.882 . . . . 1.07 109.529 -179.809 . . . . . . . . 2 2 . 1 . 034 nuclear orig full ' A' A ' 331' ' ' GLN . . . . . 0.449 ' OE1' ' O ' ' C' ' 328' ' ' PHE . 3.7 tp-100 -87.77 119.91 28.57 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.19 -0.944 . . . . 0.91 109.401 179.846 . . . . . . . . 2 2 . 1 . 034 nuclear orig full ' A' A ' 332' ' ' ILE . . . . . 0.431 HD11 ' HA ' ' A' ' 338' ' ' PHE . 97.9 mt -103.38 107.99 23.41 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.596 0 O-C-N 121.299 -0.875 . . . . 1.09 109.519 179.898 . . . . . . . . 2 2 . 1 . 034 nuclear orig full ' A' A ' 333' ' ' ARG . . . . . 0.494 ' HG2' ' CE2' ' C' ' 327' ' ' TYR . 1.4 mtt-85 -72.18 131.54 42.91 Favored 'General case' 0 N--CA 1.488 1.463 0 O-C-N 121.206 -0.934 . . . . 3.41 109.569 -179.988 . . . . . . . . 2 2 . 1 . 034 nuclear orig full ' A' A ' 334' ' ' GLY . . . . . . . . . . . . . . . 87.71 138.88 6.02 Favored Glycine 0 N--CA 1.49 2.298 0 N-CA-C 109.809 -1.316 . . . . 0.4 109.809 179.817 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 335' ' ' ARG . . . . . 0.416 ' O ' ' HB3' ' A' ' 338' ' ' PHE . 37.5 ttt180 -79.78 -29.04 40.27 Favored 'General case' 0 N--CA 1.489 1.488 0 O-C-N 121.316 -1.108 . . . . 3.55 109.676 -179.978 . . . . . . . . 2 2 . 1 . 034 nuclear orig full ' A' A ' 336' ' ' GLU . . . . . . . . . . . . . 38.7 mt-10 -56.45 -61.95 2.06 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.211 -0.93 . . . . 2.29 109.843 -179.732 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 337' ' ' ARG . . . . . 0.488 ' NH1' ' HG2' ' A' ' 337' ' ' ARG . 0.0 OUTLIER -60.52 -26.67 67.02 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.151 -0.968 . . . . 3.64 109.686 -179.776 . . . . . . . . 3 3 . 1 . 034 nuclear orig full ' A' A ' 338' ' ' PHE . . . . . 0.431 ' HA ' HD11 ' A' ' 332' ' ' ILE . 91.5 t80 -56.31 -53.58 55.57 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.163 -0.961 . . . . 0.41 110.01 -179.694 . . . . . . . . 2 2 . 1 . 034 nuclear orig full ' A' A ' 339' ' ' GLU . . . . . . . . . . . . . 6.8 mt-10 -54.6 -39.52 67.95 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.019 -1.05 . . . . 1.97 110.533 -179.369 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 340' ' ' MET . . . . . . . . . . . . . 30.9 ttp -64.37 -53.4 49.15 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.044 -1.035 . . . . 1.14 110.877 -178.788 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 341' ' ' PHE . . . . . 0.539 ' CZ ' ' HA ' ' C' ' 345' ' ' ASN . 56.7 m-85 -60.57 -48.71 80.58 Favored 'General case' 0 N--CA 1.494 1.761 0 O-C-N 120.91 -1.119 . . . . 0.21 110.291 -179.018 . . . . . . . . 2 2 . 1 . 034 nuclear orig full ' A' A ' 342' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -48.9 -44.4 40.09 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.075 -1.016 . . . . 3.15 110.136 -179.6 . . . . . . . . 2 2 . 1 . 034 nuclear orig full ' A' A ' 343' ' ' GLU . . . . . . . . . . . . . 2.1 tp10 -57.81 -41.99 83.33 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.102 -0.999 . . . . 2.35 109.745 -179.585 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 344' ' ' LEU . . . . . 0.463 ' O ' HD21 ' A' ' 348' ' ' LEU . 45.8 mt -63.63 -47.16 82.48 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.173 -0.955 . . . . 1.06 109.92 -179.828 . . . . . . . . 2 2 . 1 . 034 nuclear orig full ' A' A ' 345' ' ' ASN . . . . . . . . . . . . . 39.3 t-20 -54.83 -48.3 73.01 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.16 -0.962 . . . . 1.36 109.737 -179.616 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 346' ' ' GLU . . . . . . . . . . . . . 56.5 tt0 -61.83 -35.88 79.53 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.194 -0.941 . . . . 1.65 109.749 -179.882 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 347' ' ' ALA . . . . . . . . . . . . . . . -59.94 -55.83 29.26 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.249 -0.907 . . . . 1.03 110.049 -179.623 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 348' ' ' LEU . . . . . 0.463 HD21 ' O ' ' A' ' 344' ' ' LEU . 3.8 mm? -60.02 -41.72 92.79 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.199 -0.938 . . . . 1.04 109.655 -179.653 . . . . . . . . 2 2 . 1 . 034 nuclear orig full ' A' A ' 349' ' ' GLU . . . . . . . . . . . . . 88.3 mt-10 -58.6 -33.48 70.04 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.254 -0.903 . . . . 1.94 109.785 -179.694 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 350' ' ' LEU . . . . . 0.454 ' O ' HD22 ' A' ' 350' ' ' LEU . 5.3 tt -63.16 -49.13 75.54 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.201 -0.937 . . . . 1.17 109.162 179.944 . . . . . . . . 2 2 . 1 . 034 nuclear orig full ' A' A ' 351' ' ' LYS . . . . . . . . . . . . . 6.5 ttmm -58.49 -44.79 89.51 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.259 -0.901 . . . . 1.97 109.303 -179.989 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 352' ' ' ASP . . . . . . . . . . . . . 14.5 m-20 -57.04 -42.95 81.45 Favored 'General case' 0 N--CA 1.489 1.484 0 O-C-N 121.319 -0.863 . . . . 1.16 109.676 179.922 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 353' ' ' ALA . . . . . . . . . . . . . . . -67.35 -22.08 65.6 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.277 -0.889 . . . . 1.22 109.691 -179.787 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 354' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -82.43 -11.23 58.66 Favored 'General case' 0 N--CA 1.488 1.475 0 O-C-N 121.237 -0.914 . . . . 1.71 109.274 179.944 . . . . . . . . 2 2 . 1 . 034 nuclear orig full ' A' A ' 355' ' ' ALA . . . . . . . . . . . . . . . -72.27 -9.83 58.98 Favored 'General case' 0 N--CA 1.489 1.499 0 O-C-N 121.184 -0.948 . . . . 1.3 109.473 179.711 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 356' ' ' GLY . . . . . . . . . . . . . . . -80.51 -29.13 45.23 Favored Glycine 0 N--CA 1.492 2.38 0 N-CA-C 109.329 -1.508 . . . . 1.3 109.329 -179.999 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 357' ' ' LYS . . . . . . . . . . . . . 36.2 mmtt -87.25 140.35 29.63 Favored 'General case' 0 N--CA 1.488 1.457 0 O-C-N 121.342 -1.093 . . . . 4.46 109.054 179.667 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 358' ' ' GLU . . . . . . . . . . . . . 1.8 mt-10 -47.6 150.25 1.82 Allowed Pre-proline 0 N--CA 1.488 1.473 0 O-C-N 121.212 -0.93 . . . . 5.75 109.364 -179.831 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 359' ' ' PRO . . . . . . . . . . . . . 2.0 Cg_endo -61.8 -159.63 0.03 OUTLIER 'Trans proline' 0 C--N 1.31 -1.463 0 C-N-CA 122.241 1.96 . . . . 5.63 110.373 -179.739 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 360' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.202 0 CA-C-O 118.0 -1.444 . . . . 6.97 109.503 179.963 . . . . . . . . 0 0 . 1 . 034 nuclear orig full ' B' B ' 319' ' ' LYS . . . . . 0.447 ' O ' ' CB ' ' B' ' 320' ' ' LYS . 9.4 mmtt . . . . . 0 N--CA 1.489 1.475 0 CA-C-O 121.241 0.543 . . . . 7.95 109.663 . . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' B' B ' 320' ' ' LYS . . . . . 0.447 ' CB ' ' O ' ' B' ' 319' ' ' LYS . 0.1 OUTLIER 72.19 8.31 5.85 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.314 -0.866 . . . . 6.73 109.747 -179.906 . . . . . . . . 3 3 . 1 . 034 nuclear orig full ' B' B ' 321' ' ' LYS . . . . . 0.501 ' N ' ' HD3' ' B' ' 322' ' ' PRO . 0.3 OUTLIER -158.41 61.6 2.08 Favored Pre-proline 0 N--CA 1.49 1.528 0 O-C-N 121.234 -0.916 . . . . 6.5 109.386 179.609 . . . . . . . . 3 3 . 1 . 034 nuclear orig full ' B' B ' 322' ' ' PRO . . . . . 0.501 ' HD3' ' N ' ' B' ' 321' ' ' LYS . 2.1 Cg_endo -62.33 93.01 0.13 Allowed 'Trans proline' 0 C--N 1.311 -1.446 0 C-N-CA 122.213 1.942 . . . . 3.29 110.373 -179.974 . . . . . . . . 2 2 . 1 . 034 nuclear orig full ' B' B ' 323' ' ' LEU . . . . . . . . . . . . . 88.2 mt -82.47 73.16 9.52 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.258 -0.901 . . . . 3.18 109.421 179.853 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' B' B ' 324' ' ' ASP . . . . . 0.461 ' HB2' ' OH ' ' B' ' 327' ' ' TYR . 4.7 m-20 -80.89 178.49 8.37 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.191 -0.943 . . . . 1.53 109.29 179.809 . . . . . . . . 2 2 . 1 . 034 nuclear orig full ' B' B ' 325' ' ' GLY . . . . . . . . . . . . . . . -70.91 -153.92 1.28 Allowed Glycine 0 N--CA 1.49 2.246 0 N-CA-C 109.445 -1.462 . . . . 0.65 109.445 179.853 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' B' B ' 326' ' ' GLU . . . . . . . . . . . . . 4.4 mt-10 -58.6 -167.01 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.482 0 O-C-N 121.253 -1.145 . . . . 2.13 109.497 179.936 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' B' B ' 327' ' ' TYR . . . . . 0.461 ' OH ' ' HB2' ' B' ' 324' ' ' ASP . 39.3 m-85 -148.92 109.73 4.28 Favored 'General case' 0 N--CA 1.489 1.49 0 O-C-N 121.353 -0.842 . . . . 0.99 109.51 179.854 . . . . . . . . 2 2 . 1 . 034 nuclear orig full ' B' B ' 328' ' ' PHE . . . . . . . . . . . . . 87.8 m-85 -113.61 -169.25 1.47 Allowed 'General case' 0 C--N 1.301 -1.522 0 O-C-N 121.305 -0.872 . . . . 0.36 108.965 179.748 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' B' B ' 329' ' ' THR . . . . . . . . . . . . . 23.8 p -153.37 169.1 23.94 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.072 -1.017 . . . . 1.05 109.728 -179.776 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' B' B ' 330' ' ' LEU . . . . . 0.431 ' O ' ' HA ' ' D' ' 329' ' ' THR . 17.2 tp -150.61 126.89 10.64 Favored 'General case' 0 N--CA 1.488 1.452 0 O-C-N 121.262 -0.899 . . . . 1.07 109.592 -179.768 . . . . . . . . 2 2 . 1 . 034 nuclear orig full ' B' B ' 331' ' ' GLN . . . . . 0.439 ' OE1' ' O ' ' D' ' 328' ' ' PHE . 3.7 tp-100 -87.2 120.07 28.1 Favored 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.253 -0.904 . . . . 0.91 109.378 179.876 . . . . . . . . 2 2 . 1 . 034 nuclear orig full ' B' B ' 332' ' ' ILE . . . . . 0.44 HD11 ' HA ' ' B' ' 338' ' ' PHE . 97.9 mt -103.56 107.92 23.31 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.564 0 O-C-N 121.136 -0.978 . . . . 1.08 109.433 179.867 . . . . . . . . 2 2 . 1 . 034 nuclear orig full ' B' B ' 333' ' ' ARG . . . . . 0.438 ' CG ' ' NH1' ' B' ' 333' ' ' ARG . 1.4 mtt-85 -72.2 131.67 43.07 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.267 -0.896 . . . . 3.42 109.439 -179.979 . . . . . . . . 2 2 . 1 . 034 nuclear orig full ' B' B ' 334' ' ' GLY . . . . . . . . . . . . . . . 88.18 138.58 6.17 Favored Glycine 0 N--CA 1.49 2.27 0 N-CA-C 109.749 -1.341 . . . . 0.4 109.749 179.704 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' B' B ' 335' ' ' ARG . . . . . 0.433 ' O ' ' HB3' ' B' ' 338' ' ' PHE . 39.1 ttt180 -79.88 -28.85 39.87 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.313 -1.11 . . . . 3.55 109.655 179.991 . . . . . . . . 2 2 . 1 . 034 nuclear orig full ' B' B ' 336' ' ' GLU . . . . . . . . . . . . . 39.3 mt-10 -56.74 -61.77 2.2 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.309 -0.869 . . . . 2.28 109.811 -179.67 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' B' B ' 337' ' ' ARG . . . . . 0.513 ' HG2' ' NH1' ' B' ' 337' ' ' ARG . 0.0 OUTLIER -60.54 -27.06 67.36 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.314 -0.866 . . . . 3.64 109.602 -179.8 . . . . . . . . 3 3 . 1 . 034 nuclear orig full ' B' B ' 338' ' ' PHE . . . . . 0.44 ' HA ' HD11 ' B' ' 332' ' ' ILE . 91.4 t80 -56.11 -53.64 54.61 Favored 'General case' 0 C--N 1.303 -1.418 0 O-C-N 121.199 -0.938 . . . . 0.39 110.045 -179.623 . . . . . . . . 2 2 . 1 . 034 nuclear orig full ' B' B ' 339' ' ' GLU . . . . . . . . . . . . . 7.0 mt-10 -54.75 -39.46 68.34 Favored 'General case' 0 N--CA 1.494 1.769 0 O-C-N 121.073 -1.017 . . . . 1.98 110.679 -179.459 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' B' B ' 340' ' ' MET . . . . . . . . . . . . . 30.5 ttp -64.12 -53.47 49.03 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 120.946 -1.096 . . . . 1.14 110.89 -178.845 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' B' B ' 341' ' ' PHE . . . . . 0.438 ' CZ ' ' HA ' ' D' ' 345' ' ' ASN . 56.2 m-85 -60.72 -48.15 83.1 Favored 'General case' 0 N--CA 1.494 1.725 0 O-C-N 120.96 -1.087 . . . . 0.22 110.412 -178.983 . . . . . . . . 2 2 . 1 . 034 nuclear orig full ' B' B ' 342' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -49.58 -43.85 46.48 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.137 -0.977 . . . . 3.15 110.124 -179.579 . . . . . . . . 2 2 . 1 . 034 nuclear orig full ' B' B ' 343' ' ' GLU . . . . . . . . . . . . . 2.1 tp10 -57.99 -42.46 85.19 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.178 -0.951 . . . . 2.35 109.607 -179.665 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' B' B ' 344' ' ' LEU . . . . . 0.461 ' O ' HD21 ' B' ' 348' ' ' LEU . 46.5 mt -63.5 -47.06 83.27 Favored 'General case' 0 N--CA 1.488 1.473 0 O-C-N 121.306 -0.871 . . . . 1.05 109.931 -179.722 . . . . . . . . 2 2 . 1 . 034 nuclear orig full ' B' B ' 345' ' ' ASN . . . . . 0.555 ' HA ' ' CZ ' ' D' ' 341' ' ' PHE . 40.2 t-20 -55.06 -47.95 74.14 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.123 -0.986 . . . . 1.35 109.679 -179.615 . . . . . . . . 2 2 . 1 . 034 nuclear orig full ' B' B ' 346' ' ' GLU . . . . . . . . . . . . . 56.3 tt0 -61.99 -35.86 79.77 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.118 -0.989 . . . . 1.66 109.661 -179.863 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' B' B ' 347' ' ' ALA . . . . . . . . . . . . . . . -59.93 -55.37 34.88 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.293 -0.879 . . . . 1.02 110.184 -179.478 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' B' B ' 348' ' ' LEU . . . . . 0.461 HD21 ' O ' ' B' ' 344' ' ' LEU . 3.8 mm? -60.72 -41.0 94.38 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.214 -0.929 . . . . 1.05 109.678 -179.595 . . . . . . . . 2 2 . 1 . 034 nuclear orig full ' B' B ' 349' ' ' GLU . . . . . . . . . . . . . 86.8 mt-10 -59.05 -33.07 70.34 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.269 -0.894 . . . . 1.95 109.75 -179.729 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' B' B ' 350' ' ' LEU . . . . . 0.466 HD22 ' O ' ' B' ' 350' ' ' LEU . 5.3 tt -63.67 -48.97 75.02 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.192 -0.942 . . . . 1.18 109.286 179.882 . . . . . . . . 2 2 . 1 . 034 nuclear orig full ' B' B ' 351' ' ' LYS . . . . . . . . . . . . . 6.2 ttmm -58.5 -44.76 89.56 Favored 'General case' 0 N--CA 1.489 1.483 0 O-C-N 121.309 -0.869 . . . . 1.96 109.254 179.894 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' B' B ' 352' ' ' ASP . . . . . . . . . . . . . 16.6 m-20 -57.18 -43.04 82.26 Favored 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.305 -0.872 . . . . 1.16 109.549 179.956 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' B' B ' 353' ' ' ALA . . . . . . . . . . . . . . . -67.32 -21.92 65.64 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.228 -0.92 . . . . 1.21 109.585 -179.776 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' B' B ' 354' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -82.49 -10.96 58.8 Favored 'General case' 0 N--CA 1.488 1.471 0 O-C-N 121.246 -0.909 . . . . 1.69 109.52 179.913 . . . . . . . . 2 2 . 1 . 034 nuclear orig full ' B' B ' 355' ' ' ALA . . . . . . . . . . . . . . . -72.66 -9.36 58.52 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.179 -0.951 . . . . 1.3 109.415 179.814 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' B' B ' 356' ' ' GLY . . . . . . . . . . . . . . . -81.05 -29.11 42.75 Favored Glycine 0 N--CA 1.492 2.37 0 N-CA-C 109.206 -1.557 . . . . 1.29 109.206 179.956 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' B' B ' 357' ' ' LYS . . . . . . . . . . . . . 34.9 mmtt -87.26 139.82 30.17 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.349 -1.089 . . . . 4.45 109.039 179.658 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' B' B ' 358' ' ' GLU . . . . . . . . . . . . . 2.0 mt-10 -47.03 150.64 1.31 Allowed Pre-proline 0 N--CA 1.491 1.617 0 O-C-N 121.227 -0.92 . . . . 5.72 109.301 -179.772 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' B' B ' 359' ' ' PRO . . . . . . . . . . . . . 2.1 Cg_endo -62.03 -159.5 0.03 OUTLIER 'Trans proline' 0 C--N 1.309 -1.515 0 C-N-CA 122.278 1.985 . . . . 5.6 110.214 -179.935 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' B' B ' 360' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.238 0 CA-C-O 118.001 -1.444 . . . . 6.98 109.568 179.96 . . . . . . . . 0 0 . 1 . 034 nuclear orig full ' C' C ' 319' ' ' LYS . . . . . . . . . . . . . 2.8 mmpp? . . . . . 0 N--CA 1.49 1.537 0 CA-C-O 121.32 0.581 . . . . 7.03 109.526 . . . . . . . . . 0 0 . 1 . 034 nuclear orig full ' C' C ' 320' ' ' LYS . . . . . . . . . . . . . 2.2 ttpt 58.13 92.94 0.03 OUTLIER 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.252 -0.905 . . . . 6.84 109.52 -179.801 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' C' C ' 321' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -158.51 125.16 2.53 Favored Pre-proline 0 N--CA 1.49 1.534 0 O-C-N 121.307 -0.87 . . . . 6.78 109.189 179.952 . . . . . . . . 2 2 . 1 . 034 nuclear orig full ' C' C ' 322' ' ' PRO . . . . . . . . . . . . . 2.9 Cg_endo -61.52 106.5 0.42 Allowed 'Trans proline' 0 C--N 1.313 -1.324 0 C-N-CA 121.89 1.727 . . . . 3.98 109.997 -179.967 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' C' C ' 323' ' ' LEU . . . . . . . . . . . . . 38.6 mt -85.44 -72.19 0.5 Allowed 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.344 -0.848 . . . . 4.31 110.159 -179.682 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' C' C ' 324' ' ' ASP . . . . . 0.431 ' OD2' ' HD2' ' A' ' 333' ' ' ARG . 87.7 m-20 -76.11 179.5 5.62 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.245 -0.909 . . . . 1.63 109.769 -179.277 . . . . . . . . 2 2 . 1 . 034 nuclear orig full ' C' C ' 325' ' ' GLY . . . . . . . . . . . . . . . -70.28 -150.46 0.57 Allowed Glycine 0 N--CA 1.49 2.235 0 N-CA-C 110.032 -1.227 . . . . 0.82 110.032 -179.649 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' C' C ' 326' ' ' GLU . . . . . . . . . . . . . 10.3 mt-10 -59.16 -165.07 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.453 -1.028 . . . . 2.17 110.134 -179.672 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' C' C ' 327' ' ' TYR . . . . . 0.494 ' CE2' ' HG2' ' A' ' 333' ' ' ARG . 40.3 m-85 -148.03 116.5 6.61 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.482 -0.761 . . . . 1.03 109.248 -179.945 . . . . . . . . 2 2 . 1 . 034 nuclear orig full ' C' C ' 328' ' ' PHE . . . . . 0.46 ' O ' HG21 ' C' ' 329' ' ' THR . 72.1 m-85 -113.29 -170.15 1.63 Allowed 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.176 -0.952 . . . . 0.37 109.49 -179.889 . . . . . . . . 2 2 . 1 . 034 nuclear orig full ' C' C ' 329' ' ' THR . . . . . 0.46 HG21 ' O ' ' C' ' 328' ' ' PHE . 17.8 p -152.66 168.22 26.36 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.266 -0.896 . . . . 1.04 109.483 -179.913 . . . . . . . . 2 2 . 1 . 034 nuclear orig full ' C' C ' 330' ' ' LEU . . . . . . . . . . . . . 16.5 tp -150.99 125.42 9.49 Favored 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.25 -0.906 . . . . 1.09 109.567 -179.677 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' C' C ' 331' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -88.91 113.16 24.15 Favored 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.224 -0.923 . . . . 1.48 109.522 179.965 . . . . . . . . 2 2 . 1 . 034 nuclear orig full ' C' C ' 332' ' ' ILE . . . . . . . . . . . . . 42.0 mt -104.12 113.9 42.29 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.631 0 O-C-N 121.171 -0.955 . . . . 1.08 109.589 179.73 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' C' C ' 333' ' ' ARG . . . . . 0.53 ' CG ' ' CE1' ' A' ' 327' ' ' TYR . 0.1 OUTLIER -73.59 144.18 46.1 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.195 -0.941 . . . . 3.36 109.586 179.868 . . . . . . . . 3 3 . 1 . 034 nuclear orig full ' C' C ' 334' ' ' GLY . . . . . . . . . . . . . . . 88.11 135.74 5.07 Favored Glycine 0 N--CA 1.493 2.465 0 N-CA-C 110.033 -1.227 . . . . 0.35 110.033 179.629 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' C' C ' 335' ' ' ARG . . . . . 0.444 ' O ' ' HB3' ' C' ' 338' ' ' PHE . 13.2 ttm180 -80.44 -41.49 24.38 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.384 -1.068 . . . . 3.23 109.704 179.938 . . . . . . . . 2 2 . 1 . 034 nuclear orig full ' C' C ' 336' ' ' GLU . . . . . . . . . . . . . 4.2 mt-10 -56.46 -53.7 54.38 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.245 -0.91 . . . . 2.62 109.5 -179.778 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' C' C ' 337' ' ' ARG . . . . . 0.412 HH11 ' HG3' ' C' ' 337' ' ' ARG . 0.1 OUTLIER -60.24 -33.61 72.52 Favored 'General case' 0 N--CA 1.489 1.499 0 O-C-N 121.149 -0.969 . . . . 3.61 109.128 179.782 . . . . . . . . 3 3 . 1 . 034 nuclear orig full ' C' C ' 338' ' ' PHE . . . . . 0.444 ' HB3' ' O ' ' C' ' 335' ' ' ARG . 86.6 t80 -56.33 -55.39 34.04 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.418 -0.801 . . . . 0.43 109.768 179.839 . . . . . . . . 2 2 . 1 . 034 nuclear orig full ' C' C ' 339' ' ' GLU . . . . . . . . . . . . . 47.6 mt-10 -50.13 -35.99 28.07 Favored 'General case' 0 N--CA 1.494 1.748 0 O-C-N 121.255 -0.903 . . . . 2.05 110.131 -179.75 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' C' C ' 340' ' ' MET . . . . . . . . . . . . . 37.0 ttp -63.98 -52.41 59.75 Favored 'General case' 0 N--CA 1.493 1.717 0 O-C-N 121.199 -0.938 . . . . 1.1 110.608 -179.153 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' C' C ' 341' ' ' PHE . . . . . . . . . . . . . 50.3 m-85 -61.73 -44.38 97.02 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.216 -0.928 . . . . 0.21 110.509 -178.976 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' C' C ' 342' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -50.39 -43.25 54.46 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 120.99 -1.069 . . . . 3.42 110.285 -179.491 . . . . . . . . 2 2 . 1 . 034 nuclear orig full ' C' C ' 343' ' ' GLU . . . . . . . . . . . . . 80.1 tt0 -59.07 -45.55 90.54 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.121 -0.987 . . . . 2.14 110.057 -179.388 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' C' C ' 344' ' ' LEU . . . . . . . . . . . . . 65.2 mt -62.87 -43.97 97.38 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.155 -0.966 . . . . 1.09 110.125 -179.502 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' C' C ' 345' ' ' ASN . . . . . 0.539 ' HA ' ' CZ ' ' A' ' 341' ' ' PHE . 64.6 t-20 -57.03 -51.23 70.1 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.171 -0.956 . . . . 1.38 109.868 -179.518 . . . . . . . . 2 2 . 1 . 034 nuclear orig full ' C' C ' 346' ' ' GLU . . . . . . . . . . . . . 10.8 tt0 -60.53 -30.52 69.8 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.089 -1.007 . . . . 2.21 109.431 -179.875 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' C' C ' 347' ' ' ALA . . . . . . . . . . . . . . . -60.23 -58.07 10.1 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.282 -0.886 . . . . 1.03 109.981 -179.946 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' C' C ' 348' ' ' LEU . . . . . 0.472 ' N ' ' CD2' ' C' ' 348' ' ' LEU . 4.0 mm? -61.66 -40.86 96.44 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.21 -0.931 . . . . 1.06 109.659 -179.7 . . . . . . . . 2 2 . 1 . 034 nuclear orig full ' C' C ' 349' ' ' GLU . . . . . . . . . . . . . 53.3 mm-40 -56.99 -36.11 70.0 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.223 -0.923 . . . . 2.19 109.552 -179.878 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' C' C ' 350' ' ' LEU . . . . . 0.531 ' CD1' HD21 ' D' ' 350' ' ' LEU . 4.5 tt -63.05 -47.1 84.43 Favored 'General case' 0 N--CA 1.488 1.46 0 O-C-N 121.236 -0.915 . . . . 1.2 109.227 179.996 . . . . . . . . 2 2 . 1 . 034 nuclear orig full ' C' C ' 351' ' ' LYS . . . . . . . . . . . . . 16.8 tttm -59.66 -42.11 92.09 Favored 'General case' 0 N--CA 1.49 1.525 0 O-C-N 121.211 -0.93 . . . . 1.92 109.547 179.879 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' C' C ' 352' ' ' ASP . . . . . . . . . . . . . 86.2 m-20 -56.13 -38.34 70.68 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.272 -0.893 . . . . 1.19 109.655 -179.941 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' C' C ' 353' ' ' ALA . . . . . . . . . . . . . . . -65.96 -29.68 70.13 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.24 -0.912 . . . . 1.15 109.613 -179.645 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' C' C ' 354' ' ' GLN . . . . . . . . . . . . . 13.4 mt-30 -82.76 -9.92 59.12 Favored 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.033 -1.042 . . . . 1.7 109.348 179.75 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' C' C ' 355' ' ' ALA . . . . . . . . . . . . . . . -72.29 -2.21 18.21 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.329 -0.857 . . . . 1.3 109.671 179.979 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' C' C ' 356' ' ' GLY . . . . . . . . . . . . . . . -71.96 -2.92 54.26 Favored Glycine 0 N--CA 1.49 2.26 0 N-CA-C 109.677 -1.369 . . . . 1.33 109.677 -179.903 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' C' C ' 357' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -87.62 122.66 31.6 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.308 -1.113 . . . . 4.39 109.381 179.825 . . . . . . . . 2 2 . 1 . 034 nuclear orig full ' C' C ' 358' ' ' GLU . . . . . . . . . . . . . 8.8 pt-20 -49.6 150.05 3.82 Favored Pre-proline 0 N--CA 1.489 1.518 0 O-C-N 121.188 -0.945 . . . . 5.75 109.325 179.878 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' C' C ' 359' ' ' PRO . . . . . . . . . . . . . 2.3 Cg_endo -62.1 -174.97 0.16 Allowed 'Trans proline' 0 C--N 1.308 -1.562 0 C-N-CA 122.15 1.9 . . . . 5.54 110.126 179.931 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' C' C ' 360' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.3 0 CA-C-O 117.885 -1.508 . . . . 6.5 109.501 179.91 . . . . . . . . 0 0 . 1 . 034 nuclear orig full ' D' D ' 319' ' ' LYS . . . . . 0.451 ' O ' ' HG2' ' D' ' 321' ' ' LYS . 9.1 mmtt . . . . . 0 N--CA 1.49 1.549 0 CA-C-O 121.411 0.624 . . . . 7.93 109.512 . . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' D' D ' 320' ' ' LYS . . . . . 0.44 ' CB ' ' O ' ' D' ' 319' ' ' LYS . 0.1 OUTLIER 71.78 8.39 6.08 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.199 -0.938 . . . . 6.7 109.74 179.97 . . . . . . . . 3 3 . 1 . 034 nuclear orig full ' D' D ' 321' ' ' LYS . . . . . 0.51 ' N ' ' HD3' ' D' ' 322' ' ' PRO . 0.4 OUTLIER -158.42 61.36 2.01 Favored Pre-proline 0 N--CA 1.491 1.61 0 O-C-N 121.134 -0.979 . . . . 6.49 109.432 179.667 . . . . . . . . 3 3 . 1 . 034 nuclear orig full ' D' D ' 322' ' ' PRO . . . . . 0.51 ' HD3' ' N ' ' D' ' 321' ' ' LYS . 2.0 Cg_endo -62.34 92.33 0.13 Allowed 'Trans proline' 0 C--N 1.311 -1.401 0 C-N-CA 122.32 2.014 . . . . 3.29 110.592 -179.829 . . . . . . . . 2 2 . 1 . 034 nuclear orig full ' D' D ' 323' ' ' LEU . . . . . . . . . . . . . 91.2 mt -82.01 72.64 9.07 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.261 -0.899 . . . . 3.16 109.671 179.933 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' D' D ' 324' ' ' ASP . . . . . 0.469 ' HB2' ' OH ' ' D' ' 327' ' ' TYR . 4.7 m-20 -80.62 178.13 8.55 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.156 -0.965 . . . . 1.54 109.332 179.81 . . . . . . . . 2 2 . 1 . 034 nuclear orig full ' D' D ' 325' ' ' GLY . . . . . . . . . . . . . . . -70.21 -153.91 1.05 Allowed Glycine 0 N--CA 1.49 2.258 0 N-CA-C 109.397 -1.481 . . . . 0.65 109.397 179.889 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' D' D ' 326' ' ' GLU . . . . . . . . . . . . . 4.7 mt-10 -58.85 -167.01 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.5 0 O-C-N 121.239 -1.153 . . . . 2.13 109.468 179.931 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' D' D ' 327' ' ' TYR . . . . . 0.469 ' OH ' ' HB2' ' D' ' 324' ' ' ASP . 39.0 m-85 -148.75 109.66 4.29 Favored 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.406 -0.809 . . . . 1.0 109.612 179.919 . . . . . . . . 2 2 . 1 . 034 nuclear orig full ' D' D ' 328' ' ' PHE . . . . . 0.439 ' O ' ' OE1' ' B' ' 331' ' ' GLN . 88.1 m-85 -113.56 -169.77 1.57 Allowed 'General case' 0 N--CA 1.488 1.467 0 O-C-N 121.268 -0.895 . . . . 0.34 109.055 179.76 . . . . . . . . 2 2 . 1 . 034 nuclear orig full ' D' D ' 329' ' ' THR . . . . . 0.431 ' HA ' ' O ' ' B' ' 330' ' ' LEU . 23.8 p -153.0 169.2 23.48 Favored 'General case' 0 N--CA 1.489 1.486 0 O-C-N 121.122 -0.986 . . . . 1.05 109.555 -179.845 . . . . . . . . 2 2 . 1 . 034 nuclear orig full ' D' D ' 330' ' ' LEU . . . . . . . . . . . . . 17.4 tp -150.72 127.09 10.68 Favored 'General case' 0 N--CA 1.488 1.457 0 O-C-N 121.297 -0.877 . . . . 1.07 109.427 -179.737 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' D' D ' 331' ' ' GLN . . . . . . . . . . . . . 3.6 tp-100 -87.42 120.12 28.39 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.266 -0.897 . . . . 0.93 109.377 179.862 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' D' D ' 332' ' ' ILE . . . . . 0.438 HD11 ' HA ' ' D' ' 338' ' ' PHE . 97.9 mt -103.36 108.59 24.79 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.566 0 O-C-N 121.184 -0.947 . . . . 1.07 109.354 179.814 . . . . . . . . 2 2 . 1 . 034 nuclear orig full ' D' D ' 333' ' ' ARG . . . . . 0.429 ' CG ' ' NH1' ' D' ' 333' ' ' ARG . 1.5 mtt-85 -72.76 131.81 42.81 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.229 -0.919 . . . . 3.42 109.488 -179.953 . . . . . . . . 2 2 . 1 . 034 nuclear orig full ' D' D ' 334' ' ' GLY . . . . . . . . . . . . . . . 88.05 138.9 6.23 Favored Glycine 0 N--CA 1.491 2.314 0 N-CA-C 109.648 -1.381 . . . . 0.41 109.648 179.741 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' D' D ' 335' ' ' ARG . . . . . 0.433 ' O ' ' HB3' ' D' ' 338' ' ' PHE . 40.7 ttt180 -80.12 -29.08 38.89 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.284 -1.127 . . . . 3.58 109.594 -179.906 . . . . . . . . 2 2 . 1 . 034 nuclear orig full ' D' D ' 336' ' ' GLU . . . . . . . . . . . . . 41.1 mt-10 -56.41 -62.29 1.82 Allowed 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.306 -0.871 . . . . 2.26 109.78 -179.715 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' D' D ' 337' ' ' ARG . . . . . 0.482 ' NH1' ' HG2' ' D' ' 337' ' ' ARG . 0.0 OUTLIER -59.92 -27.23 66.59 Favored 'General case' 0 N--CA 1.489 1.501 0 O-C-N 121.238 -0.914 . . . . 3.64 109.68 -179.813 . . . . . . . . 3 3 . 1 . 034 nuclear orig full ' D' D ' 338' ' ' PHE . . . . . 0.438 ' HA ' HD11 ' D' ' 332' ' ' ILE . 91.5 t80 -55.81 -54.26 46.68 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.175 -0.953 . . . . 0.4 109.923 -179.749 . . . . . . . . 2 2 . 1 . 034 nuclear orig full ' D' D ' 339' ' ' GLU . . . . . . . . . . . . . 6.9 mt-10 -54.04 -39.6 66.35 Favored 'General case' 0 N--CA 1.494 1.759 0 O-C-N 121.095 -1.003 . . . . 1.99 110.68 -179.345 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' D' D ' 340' ' ' MET . . . . . . . . . . . . . 30.0 ttp -64.43 -53.16 52.8 Favored 'General case' 0 N--CA 1.495 1.785 0 O-C-N 121.061 -1.025 . . . . 1.13 110.862 -178.703 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' D' D ' 341' ' ' PHE . . . . . 0.555 ' CZ ' ' HA ' ' B' ' 345' ' ' ASN . 56.8 m-85 -60.83 -48.43 81.82 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 120.958 -1.089 . . . . 0.21 110.364 -179.084 . . . . . . . . 2 2 . 1 . 034 nuclear orig full ' D' D ' 342' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -49.28 -44.06 43.64 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.155 -0.965 . . . . 3.15 110.054 -179.58 . . . . . . . . 2 2 . 1 . 034 nuclear orig full ' D' D ' 343' ' ' GLU . . . . . . . . . . . . . 2.1 tp10 -57.88 -42.5 84.72 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.101 -0.999 . . . . 2.35 109.652 -179.657 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' D' D ' 344' ' ' LEU . . . . . 0.466 ' O ' HD21 ' D' ' 348' ' ' LEU . 46.4 mt -63.31 -46.97 84.23 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.199 -0.938 . . . . 1.06 109.984 -179.878 . . . . . . . . 2 2 . 1 . 034 nuclear orig full ' D' D ' 345' ' ' ASN . . . . . 0.438 ' HA ' ' CZ ' ' B' ' 341' ' ' PHE . 40.5 t-20 -55.14 -48.31 73.87 Favored 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.174 -0.954 . . . . 1.35 109.672 -179.48 . . . . . . . . 2 2 . 1 . 034 nuclear orig full ' D' D ' 346' ' ' GLU . . . . . . . . . . . . . 56.2 tt0 -61.69 -36.0 79.63 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.088 -1.007 . . . . 1.69 109.681 179.997 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' D' D ' 347' ' ' ALA . . . . . . . . . . . . . . . -59.84 -55.79 29.85 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.185 -0.947 . . . . 1.03 110.044 -179.499 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' D' D ' 348' ' ' LEU . . . . . 0.466 HD21 ' O ' ' D' ' 344' ' ' LEU . 3.8 mm? -60.1 -41.24 92.11 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.304 -0.873 . . . . 1.04 109.69 -179.645 . . . . . . . . 2 2 . 1 . 034 nuclear orig full ' D' D ' 349' ' ' GLU . . . . . . . . . . . . . 84.6 mt-10 -59.07 -32.99 70.28 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.178 -0.952 . . . . 1.95 109.877 -179.652 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' D' D ' 350' ' ' LEU . . . . . 0.531 HD21 ' CD1' ' C' ' 350' ' ' LEU . 5.2 tt -63.69 -48.86 75.42 Favored 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.148 -0.97 . . . . 1.16 109.184 179.875 . . . . . . . . 2 2 . 1 . 034 nuclear orig full ' D' D ' 351' ' ' LYS . . . . . . . . . . . . . 6.0 ttmm -58.67 -44.67 90.25 Favored 'General case' 0 N--CA 1.488 1.431 0 O-C-N 121.347 -0.846 . . . . 1.97 109.378 179.881 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' D' D ' 352' ' ' ASP . . . . . . . . . . . . . 20.0 m-20 -57.26 -42.81 82.26 Favored 'General case' 0 N--CA 1.488 1.438 0 O-C-N 121.293 -0.88 . . . . 1.17 109.566 179.859 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' D' D ' 353' ' ' ALA . . . . . . . . . . . . . . . -67.58 -21.49 65.43 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.28 -0.888 . . . . 1.21 109.768 -179.739 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' D' D ' 354' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -82.68 -11.09 58.61 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.229 -0.919 . . . . 1.68 109.31 179.961 . . . . . . . . 2 2 . 1 . 034 nuclear orig full ' D' D ' 355' ' ' ALA . . . . . . . . . . . . . . . -72.16 -9.97 59.16 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.256 -0.902 . . . . 1.29 109.51 179.819 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' D' D ' 356' ' ' GLY . . . . . . . . . . . . . . . -80.75 -29.27 43.59 Favored Glycine 0 N--CA 1.49 2.281 0 N-CA-C 109.321 -1.512 . . . . 1.28 109.321 179.848 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' D' D ' 357' ' ' LYS . . . . . . . . . . . . . 34.4 mmtt -87.14 140.48 29.5 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.21 -1.171 . . . . 4.45 108.982 179.62 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' D' D ' 358' ' ' GLU . . . . . . . . . . . . . 2.0 mt-10 -47.7 150.41 1.84 Allowed Pre-proline 0 N--CA 1.489 1.502 0 O-C-N 121.155 -0.966 . . . . 5.71 109.507 -179.849 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' D' D ' 359' ' ' PRO . . . . . . . . . . . . . 2.1 Cg_endo -62.02 -159.32 0.03 OUTLIER 'Trans proline' 0 C--N 1.31 -1.497 0 C-N-CA 122.185 1.923 . . . . 5.6 110.298 -179.805 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' D' D ' 360' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.248 0 N-CA-C 109.469 -1.452 . . . . 6.97 109.469 -179.988 . . . . . . . . 0 0 . 1 . 035 nuclear orig full ' A' A ' 319' ' ' LYS . . . . . 0.465 ' O ' ' O ' ' A' ' 320' ' ' LYS . 18.9 ttpt . . . . . 0 N--CA 1.491 1.599 0 N-CA-C 109.448 -0.575 . . . . 7.95 109.448 . . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 320' ' ' LYS . . . . . 0.465 ' O ' ' O ' ' A' ' 319' ' ' LYS . 13.7 mttp 58.46 114.02 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.331 -0.856 . . . . 6.71 109.353 179.984 . . . . . . . . 2 2 . 1 . 035 nuclear orig full ' A' A ' 321' ' ' LYS . . . . . 0.584 ' CB ' ' CD ' ' A' ' 322' ' ' PRO . 0.0 OUTLIER -160.54 -64.66 0.02 OUTLIER Pre-proline 0 N--CA 1.492 1.628 0 O-C-N 121.314 -0.866 . . . . 6.5 109.708 179.832 . . . . . . . . 3 3 . 1 . 035 nuclear orig full ' A' A ' 322' ' ' PRO . . . . . 0.584 ' CD ' ' CB ' ' A' ' 321' ' ' LYS . 6.1 Cg_exo -54.59 174.26 0.2 Allowed 'Trans proline' 0 C--N 1.313 -1.316 0 C-N-CA 121.512 1.474 . . . . 3.3 110.028 179.672 . . . . . . . . 2 2 . 1 . 035 nuclear orig full ' A' A ' 323' ' ' LEU . . . . . . . . . . . . . 51.2 mt -79.19 142.47 36.27 Favored 'General case' 0 N--CA 1.489 1.499 0 O-C-N 121.202 -0.936 . . . . 3.16 109.609 -179.804 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 324' ' ' ASP . . . . . . . . . . . . . 69.7 m-20 -79.06 161.38 26.6 Favored 'General case' 0 N--CA 1.488 1.471 0 O-C-N 121.271 -0.893 . . . . 1.53 109.195 -179.968 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 325' ' ' GLY . . . . . . . . . . . . . . . -67.78 174.79 28.11 Favored Glycine 0 N--CA 1.489 2.213 0 N-CA-C 109.367 -1.493 . . . . 0.67 109.367 -179.884 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 326' ' ' GLU . . . . . . . . . . . . . 2.1 mt-10 -57.36 -176.34 0.02 OUTLIER 'General case' 0 N--CA 1.489 1.5 0 O-C-N 121.225 -1.162 . . . . 2.13 109.424 -179.92 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 327' ' ' TYR . . . . . . . . . . . . . 48.1 m-85 -148.87 109.06 4.11 Favored 'General case' 0 C--N 1.303 -1.415 0 O-C-N 121.259 -0.901 . . . . 1.0 109.413 179.989 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 328' ' ' PHE . . . . . 0.499 ' CZ ' ' HG3' ' C' ' 335' ' ' ARG . 88.4 m-85 -113.83 -169.01 1.43 Allowed 'General case' 0 N--CA 1.489 1.492 0 O-C-N 121.353 -0.842 . . . . 0.34 109.04 179.873 . . . . . . . . 2 2 . 1 . 035 nuclear orig full ' A' A ' 329' ' ' THR . . . . . . . . . . . . . 32.4 p -152.57 168.16 26.5 Favored 'General case' 0 C--N 1.302 -1.49 0 O-C-N 121.142 -0.973 . . . . 1.05 109.311 -179.925 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 330' ' ' LEU . . . . . . . . . . . . . 41.9 tp -149.72 127.69 11.89 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.196 -0.94 . . . . 1.07 109.694 -179.688 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 331' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -88.3 114.65 25.13 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.23 -0.919 . . . . 0.91 109.206 179.661 . . . . . . . . 2 2 . 1 . 035 nuclear orig full ' A' A ' 332' ' ' ILE . . . . . 0.432 HG23 ' HA ' ' A' ' 338' ' ' PHE . 23.0 mt -103.32 112.74 37.9 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.57 0 O-C-N 121.194 -0.941 . . . . 1.09 109.524 179.957 . . . . . . . . 2 2 . 1 . 035 nuclear orig full ' A' A ' 333' ' ' ARG . . . . . 0.432 ' HG2' ' CE1' ' C' ' 327' ' ' TYR . 2.4 mtt180 -72.5 145.24 47.65 Favored 'General case' 0 N--CA 1.488 1.459 0 O-C-N 121.332 -0.855 . . . . 3.41 109.31 179.918 . . . . . . . . 2 2 . 1 . 035 nuclear orig full ' A' A ' 334' ' ' GLY . . . . . . . . . . . . . . . 83.11 127.72 1.23 Allowed Glycine 0 N--CA 1.492 2.387 0 N-CA-C 109.567 -1.413 . . . . 0.4 109.567 179.936 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 335' ' ' ARG . . . . . 0.43 ' NH1' ' CG ' ' A' ' 335' ' ' ARG . 0.4 OUTLIER -75.01 -35.12 61.99 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.233 -1.157 . . . . 3.55 109.345 -179.965 . . . . . . . . 3 3 . 1 . 035 nuclear orig full ' A' A ' 336' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -58.06 -59.29 5.5 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.319 -0.863 . . . . 2.29 109.451 179.98 . . . . . . . . 2 2 . 1 . 035 nuclear orig full ' A' A ' 337' ' ' ARG . . . . . 0.5 ' NH2' HD11 ' C' ' 348' ' ' LEU . 6.0 mmt180 -60.72 -31.61 70.9 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.33 -0.856 . . . . 3.64 109.466 179.981 . . . . . . . . 2 2 . 1 . 035 nuclear orig full ' A' A ' 338' ' ' PHE . . . . . 0.432 ' HA ' HG23 ' A' ' 332' ' ' ILE . 52.5 t80 -55.43 -55.78 27.72 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.195 -0.94 . . . . 0.41 109.411 179.968 . . . . . . . . 2 2 . 1 . 035 nuclear orig full ' A' A ' 339' ' ' GLU . . . . . . . . . . . . . 4.9 mt-10 -52.07 -32.96 37.0 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.318 -0.864 . . . . 1.97 109.952 -179.812 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 340' ' ' MET . . . . . . . . . . . . . 21.8 ttp -63.52 -52.69 60.1 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.242 -0.911 . . . . 1.14 110.041 -179.519 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 341' ' ' PHE . . . . . . . . . . . . . 56.7 m-85 -62.22 -43.11 99.56 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.112 -0.993 . . . . 0.21 110.012 -179.384 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 342' ' ' ARG . . . . . 0.444 ' NH1' ' CG ' ' A' ' 342' ' ' ARG . 0.0 OUTLIER -50.8 -46.45 59.7 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.299 -0.876 . . . . 3.15 110.023 -179.655 . . . . . . . . 3 3 . 1 . 035 nuclear orig full ' A' A ' 343' ' ' GLU . . . . . . . . . . . . . 4.9 tt0 -59.29 -43.55 92.57 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.167 -0.958 . . . . 2.35 109.928 -179.562 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 344' ' ' LEU . . . . . . . . . . . . . 53.2 mt -62.19 -36.61 82.44 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.202 -0.936 . . . . 1.06 109.715 -179.793 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 345' ' ' ASN . . . . . 0.447 ' HA ' ' CZ ' ' C' ' 341' ' ' PHE . 56.7 t-20 -58.47 -55.59 33.1 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.284 -0.885 . . . . 1.36 109.612 -179.787 . . . . . . . . 2 2 . 1 . 035 nuclear orig full ' A' A ' 346' ' ' GLU . . . . . . . . . . . . . 3.5 tt0 -60.41 -29.42 68.97 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.281 -0.887 . . . . 1.65 109.575 -179.803 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 347' ' ' ALA . . . . . . . . . . . . . . . -60.77 -59.08 5.95 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.243 -0.911 . . . . 1.03 109.954 179.96 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 348' ' ' LEU . . . . . 0.433 ' N ' HD23 ' A' ' 348' ' ' LEU . 4.0 mm? -61.47 -45.44 94.26 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.265 -0.897 . . . . 1.04 110.026 -179.565 . . . . . . . . 2 2 . 1 . 035 nuclear orig full ' A' A ' 349' ' ' GLU . . . . . . . . . . . . . 3.8 mm-40 -55.78 -34.21 65.08 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.166 -0.959 . . . . 1.94 109.439 -179.623 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 350' ' ' LEU . . . . . 0.475 HD23 HD23 ' B' ' 350' ' ' LEU . 6.0 tt -63.36 -45.69 90.0 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.223 -0.923 . . . . 1.17 109.086 179.667 . . . . . . . . 2 2 . 1 . 035 nuclear orig full ' A' A ' 351' ' ' LYS . . . . . . . . . . . . . 30.4 tttt -59.72 -45.88 90.81 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.382 -0.824 . . . . 1.97 109.692 -179.943 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 352' ' ' ASP . . . . . . . . . . . . . 7.8 m-20 -54.81 -49.85 69.97 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.248 -0.908 . . . . 1.16 109.889 -179.717 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 353' ' ' ALA . . . . . . . . . . . . . . . -67.12 -23.85 65.86 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.192 -0.943 . . . . 1.22 109.681 -179.715 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 354' ' ' GLN . . . . . 0.409 ' NE2' ' CD1' ' B' ' 350' ' ' LEU . 1.2 tt0 -84.45 -7.78 59.17 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.278 -0.889 . . . . 1.71 109.797 -179.932 . . . . . . . . 2 2 . 1 . 035 nuclear orig full ' A' A ' 355' ' ' ALA . . . . . . . . . . . . . . . -71.59 -35.94 70.69 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.158 -0.964 . . . . 1.3 109.79 -179.825 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 356' ' ' GLY . . . . . . . . . . . . . . . -78.47 -2.48 84.62 Favored Glycine 0 N--CA 1.492 2.431 0 N-CA-C 109.662 -1.375 . . . . 1.3 109.662 -179.846 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 357' ' ' LYS . . . . . . . . . . . . . 16.8 mttt -89.16 112.76 23.84 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.188 -1.183 . . . . 4.46 109.642 179.953 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 358' ' ' GLU . . . . . . . . . . . . . 21.8 pt-20 -49.24 154.81 1.34 Allowed Pre-proline 0 N--CA 1.491 1.617 0 O-C-N 121.218 -0.926 . . . . 5.75 109.327 179.779 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 359' ' ' PRO . . . . . . . . . . . . . 2.3 Cg_endo -62.41 140.89 84.78 Favored 'Trans proline' 0 C--N 1.309 -1.523 0 C-N-CA 122.081 1.854 . . . . 5.63 110.131 179.882 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 360' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.285 0 CA-C-O 117.892 -1.505 . . . . 6.97 109.569 179.943 . . . . . . . . 0 0 . 1 . 035 nuclear orig full ' B' B ' 319' ' ' LYS . . . . . 0.469 ' O ' ' O ' ' B' ' 320' ' ' LYS . 18.8 ttpt . . . . . 0 N--CA 1.49 1.558 0 CA-C-O 121.259 0.552 . . . . 7.95 109.554 . . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' B' B ' 320' ' ' LYS . . . . . 0.469 ' O ' ' O ' ' B' ' 319' ' ' LYS . 13.8 mttp 58.36 113.84 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.288 -0.883 . . . . 6.73 109.388 179.975 . . . . . . . . 2 2 . 1 . 035 nuclear orig full ' B' B ' 321' ' ' LYS . . . . . 0.577 ' CB ' ' CD ' ' B' ' 322' ' ' PRO . 0.0 OUTLIER -160.53 -64.55 0.02 OUTLIER Pre-proline 0 N--CA 1.49 1.572 0 O-C-N 121.313 -0.867 . . . . 6.5 109.843 179.972 . . . . . . . . 3 3 . 1 . 035 nuclear orig full ' B' B ' 322' ' ' PRO . . . . . 0.577 ' CD ' ' CB ' ' B' ' 321' ' ' LYS . 6.2 Cg_exo -54.73 174.04 0.22 Allowed 'Trans proline' 0 C--N 1.316 -1.168 0 C-N-CA 121.477 1.451 . . . . 3.29 109.961 179.597 . . . . . . . . 2 2 . 1 . 035 nuclear orig full ' B' B ' 323' ' ' LEU . . . . . . . . . . . . . 47.2 mt -79.12 142.37 36.47 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.222 -0.924 . . . . 3.18 109.646 -179.701 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' B' B ' 324' ' ' ASP . . . . . . . . . . . . . 70.2 m-20 -79.06 159.71 27.44 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.294 -0.879 . . . . 1.53 109.477 179.934 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' B' B ' 325' ' ' GLY . . . . . . . . . . . . . . . -65.83 174.43 19.89 Favored Glycine 0 N--CA 1.489 2.167 0 N-CA-C 109.603 -1.399 . . . . 0.65 109.603 179.988 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' B' B ' 326' ' ' GLU . . . . . . . . . . . . . 2.1 mt-10 -57.44 -176.35 0.02 OUTLIER 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.243 -1.151 . . . . 2.13 109.366 179.901 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' B' B ' 327' ' ' TYR . . . . . . . . . . . . . 47.9 m-85 -148.62 108.97 4.13 Favored 'General case' 0 N--CA 1.489 1.481 0 O-C-N 121.199 -0.938 . . . . 0.99 109.427 -179.974 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' B' B ' 328' ' ' PHE . . . . . 0.5 ' CZ ' ' HG3' ' D' ' 335' ' ' ARG . 88.5 m-85 -113.62 -169.07 1.43 Allowed 'General case' 0 N--CA 1.487 1.419 0 O-C-N 121.254 -0.904 . . . . 0.36 109.044 179.897 . . . . . . . . 2 2 . 1 . 035 nuclear orig full ' B' B ' 329' ' ' THR . . . . . . . . . . . . . 30.3 p -152.45 168.11 26.56 Favored 'General case' 0 N--CA 1.489 1.494 0 O-C-N 121.217 -0.927 . . . . 1.05 109.325 -179.965 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' B' B ' 330' ' ' LEU . . . . . . . . . . . . . 39.9 tp -149.78 127.7 11.84 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.24 -0.913 . . . . 1.07 109.656 -179.742 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' B' B ' 331' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -88.43 114.58 25.2 Favored 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.35 -0.844 . . . . 0.91 109.299 179.708 . . . . . . . . 2 2 . 1 . 035 nuclear orig full ' B' B ' 332' ' ' ILE . . . . . 0.442 HG23 ' HA ' ' B' ' 338' ' ' PHE . 22.2 mt -103.18 112.57 37.13 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.542 0 O-C-N 121.107 -0.995 . . . . 1.08 109.563 -179.923 . . . . . . . . 2 2 . 1 . 035 nuclear orig full ' B' B ' 333' ' ' ARG . . . . . 0.464 ' HG2' ' CE1' ' D' ' 327' ' ' TYR . 2.3 mtt180 -72.19 145.15 48.22 Favored 'General case' 0 N--CA 1.489 1.49 0 O-C-N 121.306 -0.871 . . . . 3.42 109.312 179.86 . . . . . . . . 2 2 . 1 . 035 nuclear orig full ' B' B ' 334' ' ' GLY . . . . . . . . . . . . . . . 83.08 127.87 1.24 Allowed Glycine 0 N--CA 1.49 2.269 0 N-CA-C 109.646 -1.382 . . . . 0.4 109.646 -179.999 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' B' B ' 335' ' ' ARG . . . . . 0.434 HH11 ' CG ' ' B' ' 335' ' ' ARG . 0.3 OUTLIER -75.16 -35.38 61.63 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.338 -1.095 . . . . 3.55 109.34 179.935 . . . . . . . . 3 3 . 1 . 035 nuclear orig full ' B' B ' 336' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -57.93 -59.15 5.69 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.296 -0.877 . . . . 2.28 109.403 179.941 . . . . . . . . 2 2 . 1 . 035 nuclear orig full ' B' B ' 337' ' ' ARG . . . . . . . . . . . . . 6.2 mmt180 -60.86 -31.86 71.3 Favored 'General case' 0 N--CA 1.489 1.495 0 O-C-N 121.337 -0.852 . . . . 3.64 109.434 -179.944 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' B' B ' 338' ' ' PHE . . . . . 0.442 ' HA ' HG23 ' B' ' 332' ' ' ILE . 52.7 t80 -55.14 -55.88 26.17 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.297 -0.877 . . . . 0.39 109.495 179.909 . . . . . . . . 2 2 . 1 . 035 nuclear orig full ' B' B ' 339' ' ' GLU . . . . . . . . . . . . . 4.9 mt-10 -51.77 -33.18 34.04 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.316 -0.865 . . . . 1.98 110.019 -179.865 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' B' B ' 340' ' ' MET . . . . . . . . . . . . . 20.9 ttp -63.45 -52.63 60.63 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.198 -0.939 . . . . 1.14 110.113 -179.428 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' B' B ' 341' ' ' PHE . . . . . 0.451 ' CZ ' ' HA ' ' D' ' 345' ' ' ASN . 56.2 m-85 -62.42 -42.99 99.86 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.171 -0.956 . . . . 0.22 109.988 -179.466 . . . . . . . . 2 2 . 1 . 035 nuclear orig full ' B' B ' 342' ' ' ARG . . . . . 0.448 ' NH1' ' CG ' ' B' ' 342' ' ' ARG . 0.0 OUTLIER -50.97 -46.51 61.24 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.315 -0.866 . . . . 3.15 110.049 -179.647 . . . . . . . . 3 3 . 1 . 035 nuclear orig full ' B' B ' 343' ' ' GLU . . . . . . . . . . . . . 5.1 tt0 -59.23 -43.39 92.35 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.121 -0.987 . . . . 2.35 109.953 -179.696 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' B' B ' 344' ' ' LEU . . . . . . . . . . . . . 55.7 mt -62.31 -36.56 82.51 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.184 -0.948 . . . . 1.05 109.75 -179.774 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' B' B ' 345' ' ' ASN . . . . . 0.56 ' HA ' ' CZ ' ' D' ' 341' ' ' PHE . 56.9 t-20 -58.61 -55.02 40.4 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.239 -0.913 . . . . 1.35 109.689 -179.838 . . . . . . . . 2 2 . 1 . 035 nuclear orig full ' B' B ' 346' ' ' GLU . . . . . . . . . . . . . 3.4 tt0 -60.77 -29.49 69.45 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.354 -0.841 . . . . 1.66 109.574 -179.815 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' B' B ' 347' ' ' ALA . . . . . . . . . . . . . . . -60.88 -58.91 6.43 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.292 -0.88 . . . . 1.02 109.924 -179.896 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' B' B ' 348' ' ' LEU . . . . . 0.511 HD11 ' NH2' ' D' ' 337' ' ' ARG . 4.0 mm? -61.45 -45.93 92.22 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.196 -0.94 . . . . 1.05 109.887 -179.622 . . . . . . . . 2 2 . 1 . 035 nuclear orig full ' B' B ' 349' ' ' GLU . . . . . . . . . . . . . 3.9 mm-40 -55.38 -34.23 64.14 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.17 -0.957 . . . . 1.95 109.534 -179.705 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' B' B ' 350' ' ' LEU . . . . . 0.475 HD23 HD23 ' A' ' 350' ' ' LEU . 6.1 tt -63.32 -45.77 89.78 Favored 'General case' 0 N--CA 1.488 1.457 0 O-C-N 121.205 -0.934 . . . . 1.18 109.173 179.69 . . . . . . . . 2 2 . 1 . 035 nuclear orig full ' B' B ' 351' ' ' LYS . . . . . . . . . . . . . 30.5 tttt -59.79 -45.87 90.98 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.442 -0.786 . . . . 1.96 109.713 -179.967 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' B' B ' 352' ' ' ASP . . . . . . . . . . . . . 7.8 m-20 -54.88 -49.58 70.84 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.22 -0.925 . . . . 1.16 109.84 -179.735 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' B' B ' 353' ' ' ALA . . . . . . . . . . . . . . . -67.32 -24.03 65.7 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.19 -0.943 . . . . 1.21 109.601 -179.749 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' B' B ' 354' ' ' GLN . . . . . . . . . . . . . 1.2 tt0 -84.17 -8.32 59.11 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.233 -0.917 . . . . 1.69 109.779 -179.883 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' B' B ' 355' ' ' ALA . . . . . . . . . . . . . . . -71.3 -35.73 71.4 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.14 -0.975 . . . . 1.3 109.937 -179.779 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' B' B ' 356' ' ' GLY . . . . . . . . . . . . . . . -78.51 -2.66 85.22 Favored Glycine 0 N--CA 1.49 2.284 0 N-CA-C 109.7 -1.36 . . . . 1.29 109.7 -179.888 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' B' B ' 357' ' ' LYS . . . . . . . . . . . . . 16.9 mttt -89.02 112.72 23.71 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.219 -1.165 . . . . 4.45 109.611 -179.922 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' B' B ' 358' ' ' GLU . . . . . . . . . . . . . 22.0 pt-20 -49.26 154.37 1.47 Allowed Pre-proline 0 N--CA 1.491 1.584 0 O-C-N 121.29 -0.881 . . . . 5.72 109.306 179.759 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' B' B ' 359' ' ' PRO . . . . . . . . . . . . . 2.1 Cg_endo -62.29 140.47 83.16 Favored 'Trans proline' 0 C--N 1.309 -1.506 0 C-N-CA 122.07 1.847 . . . . 5.6 110.26 179.989 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' B' B ' 360' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.303 0 N-CA-C 109.418 -1.473 . . . . 6.98 109.418 179.911 . . . . . . . . 0 0 . 1 . 035 nuclear orig full ' C' C ' 319' ' ' LYS . . . . . 0.465 ' O ' ' HB2' ' C' ' 320' ' ' LYS . 0.0 OUTLIER . . . . . 0 N--CA 1.49 1.54 0 N-CA-C 109.499 -0.556 . . . . 7.03 109.499 . . . . . . . . . 2 2 . 1 . 035 nuclear orig full ' C' C ' 320' ' ' LYS . . . . . 0.465 ' HB2' ' O ' ' C' ' 319' ' ' LYS . 16.0 mtmm 61.49 151.15 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.235 -0.916 . . . . 6.84 109.657 179.884 . . . . . . . . 2 2 . 1 . 035 nuclear orig full ' C' C ' 321' ' ' LYS . . . . . 0.508 ' N ' ' HD3' ' C' ' 322' ' ' PRO . 0.0 OUTLIER -158.22 61.19 2.02 Favored Pre-proline 0 N--CA 1.49 1.54 0 O-C-N 121.251 -0.906 . . . . 6.78 109.273 179.977 . . . . . . . . 3 3 . 1 . 035 nuclear orig full ' C' C ' 322' ' ' PRO . . . . . 0.508 ' HD3' ' N ' ' C' ' 321' ' ' LYS . 4.8 Cg_exo -60.1 149.53 84.19 Favored 'Trans proline' 0 C--N 1.309 -1.514 0 C-N-CA 122.225 1.95 . . . . 3.98 110.576 -179.797 . . . . . . . . 2 2 . 1 . 035 nuclear orig full ' C' C ' 323' ' ' LEU . . . . . . . . . . . . . 16.4 mt -79.52 177.42 8.88 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.335 -0.853 . . . . 4.31 109.324 179.868 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' C' C ' 324' ' ' ASP . . . . . . . . . . . . . 17.5 m-20 -80.12 146.58 31.79 Favored 'General case' 0 N--CA 1.489 1.492 0 O-C-N 121.308 -0.87 . . . . 1.63 109.475 179.938 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' C' C ' 325' ' ' GLY . . . . . . . . . . . . . . . -68.42 176.9 26.7 Favored Glycine 0 N--CA 1.49 2.27 0 N-CA-C 109.265 -1.534 . . . . 0.82 109.265 179.701 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' C' C ' 326' ' ' GLU . . . . . 0.464 ' HB3' ' CE1' ' C' ' 328' ' ' PHE . 60.7 mm-40 -56.84 179.38 0.04 OUTLIER 'General case' 0 N--CA 1.488 1.451 0 O-C-N 121.137 -1.214 . . . . 2.17 109.204 -179.883 . . . . . . . . 2 2 . 1 . 035 nuclear orig full ' C' C ' 327' ' ' TYR . . . . . 0.432 ' CE1' ' HG2' ' A' ' 333' ' ' ARG . 37.0 m-85 -149.22 109.59 4.18 Favored 'General case' 0 C--N 1.302 -1.462 0 O-C-N 121.354 -0.841 . . . . 1.03 109.41 179.94 . . . . . . . . 2 2 . 1 . 035 nuclear orig full ' C' C ' 328' ' ' PHE . . . . . 0.464 ' CE1' ' HB3' ' C' ' 326' ' ' GLU . 65.2 m-85 -113.58 -167.72 1.24 Allowed 'General case' 0 N--CA 1.489 1.477 0 O-C-N 121.431 -0.793 . . . . 0.37 109.393 179.969 . . . . . . . . 2 2 . 1 . 035 nuclear orig full ' C' C ' 329' ' ' THR . . . . . . . . . . . . . 14.6 p -151.86 168.66 24.43 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.242 -0.911 . . . . 1.04 109.342 -179.865 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' C' C ' 330' ' ' LEU . . . . . . . . . . . . . 30.6 tp -149.48 127.02 11.58 Favored 'General case' 0 C--N 1.303 -1.453 0 O-C-N 121.201 -0.937 . . . . 1.09 109.505 -179.741 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' C' C ' 331' ' ' GLN . . . . . 0.536 ' CG ' ' NH2' ' C' ' 333' ' ' ARG . 6.9 tp-100 -87.23 114.22 23.65 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.312 -0.868 . . . . 1.48 109.46 179.941 . . . . . . . . 2 2 . 1 . 035 nuclear orig full ' C' C ' 332' ' ' ILE . . . . . 0.501 HD12 ' CB ' ' C' ' 341' ' ' PHE . 84.7 mt -103.7 110.99 31.7 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.548 0 O-C-N 121.297 -0.877 . . . . 1.08 109.687 179.925 . . . . . . . . 2 2 . 1 . 035 nuclear orig full ' C' C ' 333' ' ' ARG . . . . . 0.536 ' NH2' ' CG ' ' C' ' 331' ' ' GLN . 0.0 OUTLIER -72.92 147.3 45.42 Favored 'General case' 0 N--CA 1.488 1.439 0 O-C-N 121.156 -0.965 . . . . 3.36 109.277 179.711 . . . . . . . . 3 3 . 1 . 035 nuclear orig full ' C' C ' 334' ' ' GLY . . . . . . . . . . . . . . . 76.65 131.73 0.45 Allowed Glycine 0 N--CA 1.492 2.388 0 N-CA-C 109.632 -1.387 . . . . 0.35 109.632 179.815 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' C' C ' 335' ' ' ARG . . . . . 0.499 ' HG3' ' CZ ' ' A' ' 328' ' ' PHE . 1.1 tmt_? -76.84 -30.51 56.35 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.327 -1.102 . . . . 3.23 109.61 -179.994 . . . . . . . . 2 2 . 1 . 035 nuclear orig full ' C' C ' 336' ' ' GLU . . . . . . . . . . . . . 21.2 mt-10 -57.62 -60.08 4.21 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.345 -0.847 . . . . 2.62 109.729 -179.725 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' C' C ' 337' ' ' ARG . . . . . 0.511 ' HD2' ' N ' ' C' ' 337' ' ' ARG . 11.4 mmm180 -59.85 -31.52 69.83 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.305 -0.872 . . . . 3.61 109.609 -179.592 . . . . . . . . 2 2 . 1 . 035 nuclear orig full ' C' C ' 338' ' ' PHE . . . . . . . . . . . . . 61.3 t80 -56.12 -56.74 17.21 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.365 -0.834 . . . . 0.43 109.858 -179.724 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' C' C ' 339' ' ' GLU . . . . . . . . . . . . . 3.8 mt-10 -49.45 -38.38 29.45 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.254 -0.904 . . . . 2.05 110.302 -179.462 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' C' C ' 340' ' ' MET . . . . . . . . . . . . . 35.1 ttp -64.61 -47.15 79.68 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.11 -0.994 . . . . 1.1 110.279 -179.396 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' C' C ' 341' ' ' PHE . . . . . 0.501 ' CB ' HD12 ' C' ' 332' ' ' ILE . 38.0 m-85 -62.47 -52.87 61.82 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.173 -0.954 . . . . 0.21 110.139 -179.352 . . . . . . . . 2 2 . 1 . 035 nuclear orig full ' C' C ' 342' ' ' ARG . . . . . . . . . . . . . 7.4 tmm_? -46.51 -40.08 11.95 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.267 -0.896 . . . . 3.42 109.718 -179.751 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' C' C ' 343' ' ' GLU . . . . . . . . . . . . . 6.4 tp10 -59.06 -50.2 74.98 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.236 -0.915 . . . . 2.14 109.721 -179.956 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' C' C ' 344' ' ' LEU . . . . . . . . . . . . . 41.0 mt -61.91 -28.36 69.47 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.263 -0.898 . . . . 1.09 109.419 179.992 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' C' C ' 345' ' ' ASN . . . . . 0.5 ' ND2' ' OE2' ' C' ' 349' ' ' GLU . 13.9 t-20 -57.8 -59.64 4.91 Favored 'General case' 0 N--CA 1.489 1.484 0 O-C-N 121.243 -0.911 . . . . 1.38 109.45 179.929 . . . . . . . . 2 2 . 1 . 035 nuclear orig full ' C' C ' 346' ' ' GLU . . . . . . . . . . . . . 1.3 tt0 -61.74 -24.23 66.67 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.431 -0.793 . . . . 2.21 109.655 -179.954 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' C' C ' 347' ' ' ALA . . . . . . . . . . . . . . . -61.71 -62.8 1.55 Allowed 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.204 -0.935 . . . . 1.03 110.025 -179.76 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' C' C ' 348' ' ' LEU . . . . . 0.5 HD11 ' NH2' ' A' ' 337' ' ' ARG . 3.6 mm? -61.9 -45.0 95.64 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.19 -0.944 . . . . 1.06 110.018 -179.405 . . . . . . . . 2 2 . 1 . 035 nuclear orig full ' C' C ' 349' ' ' GLU . . . . . 0.5 ' OE2' ' ND2' ' C' ' 345' ' ' ASN . 3.6 mt-10 -56.37 -34.16 66.4 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.153 -0.967 . . . . 2.19 109.525 -179.629 . . . . . . . . 2 2 . 1 . 035 nuclear orig full ' C' C ' 350' ' ' LEU . . . . . 0.481 HD21 ' CD1' ' D' ' 350' ' ' LEU . 7.4 tt -65.0 -41.29 95.51 Favored 'General case' 0 N--CA 1.489 1.483 0 O-C-N 121.217 -0.927 . . . . 1.2 109.188 179.674 . . . . . . . . 2 2 . 1 . 035 nuclear orig full ' C' C ' 351' ' ' LYS . . . . . . . . . . . . . 13.7 tttt -60.3 -48.9 79.78 Favored 'General case' 0 N--CA 1.489 1.501 0 O-C-N 121.353 -0.842 . . . . 1.92 109.621 -179.919 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' C' C ' 352' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -57.23 -44.24 83.58 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.244 -0.91 . . . . 1.19 109.774 -179.902 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' C' C ' 353' ' ' ALA . . . . . . . . . . . . . . . -68.01 -19.28 64.9 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.296 -0.877 . . . . 1.15 109.764 -179.825 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' C' C ' 354' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -82.76 -7.88 59.62 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.268 -0.895 . . . . 1.7 109.741 -179.893 . . . . . . . . 2 2 . 1 . 035 nuclear orig full ' C' C ' 355' ' ' ALA . . . . . . . . . . . . . . . -70.76 -36.08 72.93 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.229 -0.919 . . . . 1.3 109.564 179.992 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' C' C ' 356' ' ' GLY . . . . . . . . . . . . . . . -78.1 3.43 61.73 Favored Glycine 0 N--CA 1.491 2.328 0 N-CA-C 109.855 -1.298 . . . . 1.33 109.855 -179.785 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' C' C ' 357' ' ' LYS . . . . . . . . . . . . . 3.1 tptm -85.92 46.88 1.37 Allowed 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.172 -1.193 . . . . 4.39 109.616 -179.933 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' C' C ' 358' ' ' GLU . . . . . 0.461 ' HG2' ' HD2' ' C' ' 359' ' ' PRO . 1.0 OUTLIER -49.56 162.6 0.43 Allowed Pre-proline 0 N--CA 1.49 1.565 0 O-C-N 121.176 -0.952 . . . . 5.75 109.159 179.75 . . . . . . . . 3 3 . 1 . 035 nuclear orig full ' C' C ' 359' ' ' PRO . . . . . 0.461 ' HD2' ' HG2' ' C' ' 358' ' ' GLU . 4.1 Cg_exo -60.42 -158.12 0.02 OUTLIER 'Trans proline' 0 C--N 1.309 -1.549 0 C-N-CA 121.932 1.755 . . . . 5.54 109.937 179.928 . . . . . . . . 2 2 . 1 . 035 nuclear orig full ' C' C ' 360' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.293 0 CA-C-O 118.058 -1.412 . . . . 6.5 109.589 179.959 . . . . . . . . 0 0 . 1 . 035 nuclear orig full ' D' D ' 319' ' ' LYS . . . . . 0.462 ' O ' ' O ' ' D' ' 320' ' ' LYS . 18.9 ttpt . . . . . 0 N--CA 1.491 1.583 0 N-CA-C 109.387 -0.597 . . . . 7.93 109.387 . . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' D' D ' 320' ' ' LYS . . . . . 0.462 ' O ' ' O ' ' D' ' 319' ' ' LYS . 13.7 mttp 58.54 113.98 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.359 -0.838 . . . . 6.7 109.354 -179.827 . . . . . . . . 2 2 . 1 . 035 nuclear orig full ' D' D ' 321' ' ' LYS . . . . . 0.592 ' CB ' ' CD ' ' D' ' 322' ' ' PRO . 0.0 OUTLIER -160.41 -64.8 0.02 OUTLIER Pre-proline 0 N--CA 1.492 1.642 0 O-C-N 121.364 -0.835 . . . . 6.49 109.806 179.871 . . . . . . . . 3 3 . 1 . 035 nuclear orig full ' D' D ' 322' ' ' PRO . . . . . 0.592 ' CD ' ' CB ' ' D' ' 321' ' ' LYS . 6.2 Cg_exo -54.55 174.2 0.2 Allowed 'Trans proline' 0 C--N 1.315 -1.217 0 C-N-CA 121.644 1.563 . . . . 3.29 109.958 179.71 . . . . . . . . 2 2 . 1 . 035 nuclear orig full ' D' D ' 323' ' ' LEU . . . . . . . . . . . . . 47.5 mt -79.38 142.03 36.37 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.161 -0.962 . . . . 3.16 109.612 -179.735 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' D' D ' 324' ' ' ASP . . . . . . . . . . . . . 70.5 m-20 -78.64 160.75 27.38 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.274 -0.891 . . . . 1.54 109.274 -179.975 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' D' D ' 325' ' ' GLY . . . . . . . . . . . . . . . -67.21 174.78 26.0 Favored Glycine 0 N--CA 1.489 2.233 0 N-CA-C 109.448 -1.461 . . . . 0.65 109.448 -179.822 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' D' D ' 326' ' ' GLU . . . . . . . . . . . . . 2.1 mt-10 -57.3 -176.15 0.02 OUTLIER 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.339 -1.095 . . . . 2.13 109.355 -179.936 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' D' D ' 327' ' ' TYR . . . . . 0.464 ' CE1' ' HG2' ' B' ' 333' ' ' ARG . 47.0 m-85 -148.91 108.65 4.02 Favored 'General case' 0 N--CA 1.488 1.444 0 O-C-N 121.318 -0.864 . . . . 1.0 109.453 -179.934 . . . . . . . . 2 2 . 1 . 035 nuclear orig full ' D' D ' 328' ' ' PHE . . . . . 0.425 ' CZ ' ' HG3' ' B' ' 335' ' ' ARG . 88.7 m-85 -113.47 -169.02 1.42 Allowed 'General case' 0 N--CA 1.489 1.481 0 O-C-N 121.356 -0.84 . . . . 0.34 109.103 179.936 . . . . . . . . 2 2 . 1 . 035 nuclear orig full ' D' D ' 329' ' ' THR . . . . . . . . . . . . . 31.1 p -152.44 168.18 26.32 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.208 -0.932 . . . . 1.05 109.336 -179.968 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' D' D ' 330' ' ' LEU . . . . . . . . . . . . . 38.5 tp -149.96 127.2 11.34 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.197 -0.94 . . . . 1.07 109.642 -179.667 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' D' D ' 331' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -87.83 114.56 24.55 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.312 -0.868 . . . . 0.93 109.299 179.604 . . . . . . . . 2 2 . 1 . 035 nuclear orig full ' D' D ' 332' ' ' ILE . . . . . 0.429 HG23 ' HA ' ' D' ' 338' ' ' PHE . 21.9 mt -103.29 112.88 38.41 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.55 0 O-C-N 121.121 -0.987 . . . . 1.07 109.493 179.925 . . . . . . . . 2 2 . 1 . 035 nuclear orig full ' D' D ' 333' ' ' ARG . . . . . . . . . . . . . 2.3 mtt180 -72.43 145.23 47.77 Favored 'General case' 0 N--CA 1.488 1.445 0 O-C-N 121.141 -0.974 . . . . 3.42 109.365 179.938 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' D' D ' 334' ' ' GLY . . . . . . . . . . . . . . . 83.08 127.57 1.2 Allowed Glycine 0 N--CA 1.49 2.271 0 N-CA-C 109.608 -1.397 . . . . 0.41 109.608 179.861 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' D' D ' 335' ' ' ARG . . . . . 0.5 ' HG3' ' CZ ' ' B' ' 328' ' ' PHE . 0.4 OUTLIER -74.75 -35.23 62.62 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.225 -1.162 . . . . 3.58 109.466 179.953 . . . . . . . . 3 3 . 1 . 035 nuclear orig full ' D' D ' 336' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -58.02 -59.29 5.5 Favored 'General case' 0 N--CA 1.489 1.484 0 O-C-N 121.253 -0.904 . . . . 2.26 109.522 179.956 . . . . . . . . 2 2 . 1 . 035 nuclear orig full ' D' D ' 337' ' ' ARG . . . . . 0.511 ' NH2' HD11 ' B' ' 348' ' ' LEU . 6.2 mmt180 -60.73 -31.77 71.06 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.317 -0.865 . . . . 3.64 109.426 -179.97 . . . . . . . . 2 2 . 1 . 035 nuclear orig full ' D' D ' 338' ' ' PHE . . . . . 0.429 ' HA ' HG23 ' D' ' 332' ' ' ILE . 52.9 t80 -55.19 -55.9 26.05 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.234 -0.916 . . . . 0.4 109.517 179.927 . . . . . . . . 2 2 . 1 . 035 nuclear orig full ' D' D ' 339' ' ' GLU . . . . . . . . . . . . . 5.0 mt-10 -51.94 -33.06 35.78 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.261 -0.899 . . . . 1.99 109.893 -179.755 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' D' D ' 340' ' ' MET . . . . . . . . . . . . . 21.1 ttp -63.53 -52.51 60.86 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.262 -0.898 . . . . 1.13 110.12 -179.422 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' D' D ' 341' ' ' PHE . . . . . 0.56 ' CZ ' ' HA ' ' B' ' 345' ' ' ASN . 57.0 m-85 -62.38 -43.17 99.45 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.137 -0.977 . . . . 0.21 110.016 -179.515 . . . . . . . . 2 2 . 1 . 035 nuclear orig full ' D' D ' 342' ' ' ARG . . . . . 0.447 ' NH1' ' CG ' ' D' ' 342' ' ' ARG . 0.0 OUTLIER -50.77 -46.47 59.49 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.229 -0.92 . . . . 3.15 110.017 -179.657 . . . . . . . . 3 3 . 1 . 035 nuclear orig full ' D' D ' 343' ' ' GLU . . . . . . . . . . . . . 4.7 tt0 -59.12 -43.71 91.96 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.181 -0.949 . . . . 2.35 109.887 -179.636 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' D' D ' 344' ' ' LEU . . . . . . . . . . . . . 54.4 mt -62.18 -36.54 82.19 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.175 -0.953 . . . . 1.06 109.783 -179.79 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' D' D ' 345' ' ' ASN . . . . . 0.451 ' HA ' ' CZ ' ' B' ' 341' ' ' PHE . 56.5 t-20 -58.61 -55.43 35.17 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.243 -0.911 . . . . 1.35 109.664 -179.824 . . . . . . . . 2 2 . 1 . 035 nuclear orig full ' D' D ' 346' ' ' GLU . . . . . . . . . . . . . 3.3 tt0 -60.52 -29.44 69.11 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.193 -0.942 . . . . 1.69 109.534 -179.777 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' D' D ' 347' ' ' ALA . . . . . . . . . . . . . . . -60.91 -58.84 6.74 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.154 -0.966 . . . . 1.03 109.885 -179.943 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' D' D ' 348' ' ' LEU . . . . . 0.434 ' N ' HD23 ' D' ' 348' ' ' LEU . 4.0 mm? -61.53 -45.82 92.55 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.212 -0.93 . . . . 1.04 109.9 -179.557 . . . . . . . . 2 2 . 1 . 035 nuclear orig full ' D' D ' 349' ' ' GLU . . . . . . . . . . . . . 3.9 mm-40 -55.51 -34.17 64.41 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.273 -0.892 . . . . 1.95 109.607 -179.622 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' D' D ' 350' ' ' LEU . . . . . 0.481 ' CD1' HD21 ' C' ' 350' ' ' LEU . 6.1 tt -63.44 -45.79 89.31 Favored 'General case' 0 N--CA 1.489 1.484 0 O-C-N 121.273 -0.892 . . . . 1.16 109.069 179.701 . . . . . . . . 2 2 . 1 . 035 nuclear orig full ' D' D ' 351' ' ' LYS . . . . . . . . . . . . . 30.2 tttt -59.77 -45.74 91.34 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.402 -0.811 . . . . 1.97 109.664 -179.942 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' D' D ' 352' ' ' ASP . . . . . . . . . . . . . 7.6 m-20 -54.91 -49.85 70.25 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.293 -0.879 . . . . 1.17 109.845 -179.766 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' D' D ' 353' ' ' ALA . . . . . . . . . . . . . . . -67.22 -23.88 65.77 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.198 -0.939 . . . . 1.21 109.651 -179.731 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' D' D ' 354' ' ' GLN . . . . . 0.469 ' NE2' HD12 ' C' ' 350' ' ' LEU . 1.2 tt0 -84.46 -8.02 59.09 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.249 -0.907 . . . . 1.68 109.728 -179.889 . . . . . . . . 2 2 . 1 . 035 nuclear orig full ' D' D ' 355' ' ' ALA . . . . . . . . . . . . . . . -71.51 -35.64 70.81 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.273 -0.892 . . . . 1.29 109.749 -179.752 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' D' D ' 356' ' ' GLY . . . . . . . . . . . . . . . -78.58 -2.57 85.32 Favored Glycine 0 N--CA 1.49 2.289 0 N-CA-C 109.675 -1.37 . . . . 1.28 109.675 -179.84 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' D' D ' 357' ' ' LYS . . . . . . . . . . . . . 16.7 mttt -89.04 112.78 23.8 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.272 -1.134 . . . . 4.45 109.633 -179.914 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' D' D ' 358' ' ' GLU . . . . . . . . . . . . . 21.8 pt-20 -49.51 154.53 1.57 Allowed Pre-proline 0 N--CA 1.491 1.581 0 O-C-N 121.114 -0.991 . . . . 5.71 109.272 179.803 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' D' D ' 359' ' ' PRO . . . . . . . . . . . . . 2.3 Cg_endo -62.28 140.59 83.82 Favored 'Trans proline' 0 C--N 1.31 -1.47 0 C-N-CA 122.165 1.91 . . . . 5.6 110.152 179.947 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' D' D ' 360' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.299 0 CA-C-O 117.964 -1.464 . . . . 6.97 109.448 179.888 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 326' ' ' GLU . . . . . . . . . . . . . 4.2 mm-40 . . . . . 0 N--CA 1.487 1.424 0 N-CA-C 109.235 -0.654 . . . . 2.1299999999999999 109.235 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 327' ' ' TYR . . . . . . . . . . . . . 42.2 m-85 -147.31 96.28 2.68 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.248 -0.908 . . . . 0.47999999999999998 109.437 -179.974 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 328' ' ' PHE . . . . . 0.564 ' CE2' ' HG3' ' C' ' 335' ' ' ARG . 56.8 m-85 -103.46 -160.34 0.77 Allowed 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.319 -0.863 . . . . 0.31 109.588 -179.759 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 329' ' ' THR . . . . . 0.455 ' HA ' ' O ' ' C' ' 330' ' ' LEU . 34.8 p -154.11 169.22 24.07 Favored 'General case' 0 N--CA 1.489 1.49 0 O-C-N 121.455 -0.778 . . . . 0.22 108.922 179.894 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 330' ' ' LEU . . . . . 0.478 ' O ' ' HA ' ' C' ' 329' ' ' THR . 24.4 tp -151.42 132.97 14.76 Favored 'General case' 0 N--CA 1.488 1.474 0 O-C-N 121.071 -1.018 . . . . 0.28000000000000003 109.768 -179.717 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 331' ' ' GLN . . . . . . . . . . . . . 7.1 tp-100 -85.66 115.94 23.64 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.343 -0.848 . . . . 0.91000000000000003 108.946 179.695 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 332' ' ' ILE . . . . . 0.794 HG21 ' HA ' ' A' ' 338' ' ' PHE . 75.0 mt -103.17 104.25 16.34 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.555 0 O-C-N 121.261 -0.899 . . . . 0.26000000000000001 109.819 -179.714 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 333' ' ' ARG . . . . . 0.554 ' CG ' ' CE1' ' C' ' 327' ' ' TYR . 1.9 mpt_? -72.74 138.86 46.78 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.376 -0.828 . . . . 2.9199999999999999 109.35 179.744 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 334' ' ' GLY . . . . . . . . . . . . . . . 91.25 130.21 4.69 Favored Glycine 0 N--CA 1.491 2.367 0 N-CA-C 109.573 -1.411 . . . . 0.40000000000000002 109.573 179.868 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 335' ' ' ARG . . . . . 0.424 ' O ' ' HB3' ' A' ' 338' ' ' PHE . 57.5 ttt180 -79.36 -37.8 36.55 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.34 -1.094 . . . . 3.0099999999999998 109.653 179.919 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 336' ' ' GLU . . . . . . . . . . . . . 5.0 mt-10 -58.0 -60.87 3.07 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.187 -0.946 . . . . 2.29 109.671 -179.863 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 337' ' ' ARG . . . . . . . . . . . . . 4.0 mtt180 -59.98 -28.58 67.8 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.232 -0.918 . . . . 2.9300000000000002 109.603 -179.831 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 338' ' ' PHE . . . . . 0.794 ' HA ' HG21 ' A' ' 332' ' ' ILE . 59.1 t80 -54.51 -60.24 3.62 Favored 'General case' 0 N--CA 1.489 1.494 0 O-C-N 121.175 -0.953 . . . . 0.38 109.477 -179.996 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 339' ' ' GLU . . . . . . . . . . . . . 5.8 mt-10 -51.36 -31.29 21.65 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.291 -0.881 . . . . 1.97 109.771 -179.917 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 340' ' ' MET . . . . . . . . . . . . . 27.7 ttp -64.19 -52.61 58.11 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.128 -0.982 . . . . 0.31 109.881 -179.703 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 341' ' ' PHE . . . . . . . . . . . . . 39.2 m-85 -61.79 -47.84 83.31 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.205 -0.935 . . . . 0.17999999999999999 109.766 -179.623 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 342' ' ' ARG . . . . . . . . . . . . . 9.7 ttt180 -49.67 -40.21 39.16 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.21 -0.931 . . . . 2.4199999999999999 109.779 -179.811 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 343' ' ' GLU . . . . . . . . . . . . . 4.3 tt0 -59.29 -49.7 76.84 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.196 -0.94 . . . . 2.3500000000000001 109.8 -179.762 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 344' ' ' LEU . . . . . 0.548 ' CD2' HD22 ' B' ' 344' ' ' LEU . 45.4 mt -61.84 -31.47 71.73 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.148 -0.97 . . . . 0.17999999999999999 109.569 -179.805 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 345' ' ' ASN . . . . . . . . . . . . . 15.9 t-20 -57.87 -57.87 10.87 Favored 'General case' 0 N--CA 1.489 1.477 0 O-C-N 121.229 -0.919 . . . . 1.0900000000000001 109.53 -179.965 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 346' ' ' GLU . . . . . . . . . . . . . 37.3 tt0 -60.98 -29.06 69.46 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.296 -0.878 . . . . 1.6499999999999999 109.628 -179.848 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 347' ' ' ALA . . . . . 0.4 ' HB1' ' HB1' ' B' ' 347' ' ' ALA . . . -59.45 -58.43 8.65 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.195 -0.941 . . . . 0.17999999999999999 109.843 -179.83 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 348' ' ' LEU . . . . . 0.608 HD22 ' N ' ' A' ' 348' ' ' LEU . 4.2 mm? -61.52 -38.73 88.45 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.282 -0.887 . . . . 0.29999999999999999 109.71 -179.671 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 349' ' ' GLU . . . . . . . . . . . . . 9.2 mt-10 -57.83 -38.31 75.41 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.337 -0.852 . . . . 1.9399999999999999 110.063 -179.57 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 350' ' ' LEU . . . . . 0.664 HD22 HD13 ' B' ' 350' ' ' LEU . 6.1 tt -62.75 -48.74 77.88 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.165 -0.96 . . . . 0.46000000000000002 109.73 -179.755 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 351' ' ' LYS . . . . . . . . . . . . . 5.8 tttt -59.33 -36.92 76.55 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.221 -0.924 . . . . 1.3999999999999999 109.471 -179.808 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 352' ' ' ASP . . . . . 0.403 ' OD1' ' CZ ' ' C' ' 337' ' ' ARG . 55.3 m-20 -56.36 -42.3 77.57 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.254 -0.904 . . . . 1.1599999999999999 109.709 -179.974 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 353' ' ' ALA . . . . . . . . . . . . . . . -67.62 -23.02 65.32 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.271 -0.893 . . . . 0.63 109.93 -179.573 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 354' ' ' GLN . . . . . . . . . . . . . 2.4 mt-30 . . . . . 0 N--CA 1.491 1.602 0 O-C-N 121.185 -0.947 . . . . 1.47 109.746 -179.736 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' B' B ' 326' ' ' GLU . . . . . . . . . . . . . 4.1 mm-40 . . . . . 0 N--CA 1.489 1.514 0 N-CA-C 109.208 -0.664 . . . . 2.1299999999999999 109.208 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' B' B ' 327' ' ' TYR . . . . . 0.606 ' CE2' ' HG2' ' D' ' 333' ' ' ARG . 42.3 m-85 -147.55 96.1 2.63 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.322 -0.861 . . . . 0.47999999999999998 109.426 179.986 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 328' ' ' PHE . . . . . . . . . . . . . 58.1 m-85 -103.27 -160.2 0.76 Allowed 'General case' 0 N--CA 1.489 1.482 0 O-C-N 121.323 -0.861 . . . . 0.32000000000000001 109.57 -179.841 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 329' ' ' THR . . . . . . . . . . . . . 35.4 p -154.18 169.2 24.17 Favored 'General case' 0 N--CA 1.489 1.482 0 O-C-N 121.354 -0.841 . . . . 0.23000000000000001 108.987 179.825 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 330' ' ' LEU . . . . . . . . . . . . . 25.0 tp -151.34 133.04 14.89 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.084 -1.01 . . . . 0.28000000000000003 109.735 -179.765 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 331' ' ' GLN . . . . . . . . . . . . . 7.1 tp-100 -85.65 116.1 23.73 Favored 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.283 -0.885 . . . . 0.91000000000000003 108.999 179.546 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 332' ' ' ILE . . . . . 0.783 HG21 ' HA ' ' B' ' 338' ' ' PHE . 75.3 mt -103.44 104.3 16.46 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.523 0 O-C-N 121.258 -0.901 . . . . 0.23999999999999999 109.761 -179.669 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 333' ' ' ARG . . . . . 0.527 ' CG ' ' CE2' ' D' ' 327' ' ' TYR . 1.9 mpt_? -72.87 139.05 46.66 Favored 'General case' 0 N--CA 1.489 1.493 0 O-C-N 121.271 -0.893 . . . . 2.9300000000000002 109.352 179.737 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 334' ' ' GLY . . . . . . . . . . . . . . . 91.24 129.89 4.58 Favored Glycine 0 N--CA 1.489 2.206 0 N-CA-C 109.679 -1.369 . . . . 0.40000000000000002 109.679 179.906 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 335' ' ' ARG . . . . . 0.421 ' O ' ' HB3' ' B' ' 338' ' ' PHE . 57.5 ttt180 -79.15 -37.88 37.37 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.34 -1.094 . . . . 3.0099999999999998 109.581 -179.955 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 336' ' ' GLU . . . . . . . . . . . . . 5.0 mt-10 -57.95 -60.81 3.14 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.348 -0.845 . . . . 2.2799999999999998 109.719 -179.823 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 337' ' ' ARG . . . . . 0.511 ' CZ ' ' OD1' ' D' ' 352' ' ' ASP . 4.0 mtt180 -60.02 -28.53 67.81 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.188 -0.945 . . . . 2.9300000000000002 109.641 -179.806 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 338' ' ' PHE . . . . . 0.783 ' HA ' HG21 ' B' ' 332' ' ' ILE . 59.4 t80 -54.42 -60.41 3.38 Favored 'General case' 0 N--CA 1.488 1.458 0 O-C-N 121.184 -0.948 . . . . 0.37 109.397 179.969 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 339' ' ' GLU . . . . . . . . . . . . . 5.7 mt-10 -51.31 -31.23 20.88 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.248 -0.907 . . . . 1.98 109.781 -179.88 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 340' ' ' MET . . . . . . . . . . . . . 27.5 ttp -64.19 -52.64 57.92 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.221 -0.924 . . . . 0.32000000000000001 109.982 -179.711 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 341' ' ' PHE . . . . . . . . . . . . . 39.1 m-85 -61.72 -47.87 83.3 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.103 -0.998 . . . . 0.17999999999999999 109.78 -179.694 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 342' ' ' ARG . . . . . . . . . . . . . 9.8 ttt180 -49.62 -40.16 38.28 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.294 -0.879 . . . . 2.4199999999999999 109.828 -179.846 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 343' ' ' GLU . . . . . . . . . . . . . 4.2 tt0 -59.36 -49.64 77.04 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.227 -0.92 . . . . 2.3500000000000001 109.742 -179.745 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 344' ' ' LEU . . . . . 0.548 HD22 ' CD2' ' A' ' 344' ' ' LEU . 45.4 mt -61.88 -31.56 71.85 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.234 -0.916 . . . . 0.17999999999999999 109.597 -179.788 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 345' ' ' ASN . . . . . . . . . . . . . 16.7 t-20 -57.64 -58.0 10.26 Favored 'General case' 0 N--CA 1.489 1.483 0 O-C-N 121.235 -0.916 . . . . 1.0900000000000001 109.571 179.956 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 346' ' ' GLU . . . . . . . . . . . . . 36.8 tt0 -60.84 -29.35 69.45 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.354 -0.841 . . . . 1.6599999999999999 109.658 -179.901 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 347' ' ' ALA . . . . . 0.4 ' HB1' ' HB1' ' A' ' 347' ' ' ALA . . . -59.29 -58.41 8.76 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.24 -0.912 . . . . 0.17000000000000001 109.891 -179.774 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 348' ' ' LEU . . . . . 0.609 HD22 ' N ' ' B' ' 348' ' ' LEU . 4.1 mm? -61.5 -38.68 88.22 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.19 -0.944 . . . . 0.28999999999999998 109.737 -179.737 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 349' ' ' GLU . . . . . . . . . . . . . 9.3 mt-10 -57.86 -38.42 75.67 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.247 -0.908 . . . . 1.95 110.074 -179.539 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 350' ' ' LEU . . . . . 0.664 HD13 HD22 ' A' ' 350' ' ' LEU . 6.1 tt -62.69 -48.82 77.64 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.197 -0.94 . . . . 0.45000000000000001 109.659 -179.705 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 351' ' ' LYS . . . . . . . . . . . . . 5.8 tttt -59.26 -36.92 76.38 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.115 -0.99 . . . . 1.3799999999999999 109.525 -179.847 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 352' ' ' ASP . . . . . . . . . . . . . 55.4 m-20 -56.33 -42.34 77.53 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.26 -0.9 . . . . 1.1599999999999999 109.668 -179.96 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 353' ' ' ALA . . . . . . . . . . . . . . . -67.6 -23.22 65.36 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.217 -0.927 . . . . 0.60999999999999999 109.868 -179.504 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 354' ' ' GLN . . . . . . . . . . . . . 2.5 mt-30 . . . . . 0 N--CA 1.491 1.598 0 O-C-N 121.194 -0.941 . . . . 1.45 109.812 -179.86 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' C' C ' 326' ' ' GLU . . . . . . . . . . . . . 3.2 mm-40 . . . . . 0 N--CA 1.489 1.517 0 N-CA-C 109.47 -0.567 . . . . 2.1699999999999999 109.47 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' C' C ' 327' ' ' TYR . . . . . 0.554 ' CE1' ' CG ' ' A' ' 333' ' ' ARG . 49.3 m-85 -149.05 101.71 3.18 Favored 'General case' 0 N--CA 1.488 1.46 0 O-C-N 121.333 -0.854 . . . . 0.47999999999999998 109.505 179.891 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' C' C ' 328' ' ' PHE . . . . . . . . . . . . . 63.9 m-85 -103.15 -165.85 1.21 Allowed 'General case' 0 N--CA 1.488 1.472 0 O-C-N 121.381 -0.824 . . . . 0.33000000000000002 109.129 179.985 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 329' ' ' THR . . . . . 0.478 ' HA ' ' O ' ' A' ' 330' ' ' LEU . 43.1 p -150.71 167.04 28.57 Favored 'General case' 0 N--CA 1.488 1.468 0 O-C-N 121.204 -0.935 . . . . 0.23000000000000001 109.353 -179.952 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' C' C ' 330' ' ' LEU . . . . . 0.455 ' O ' ' HA ' ' A' ' 329' ' ' THR . 17.7 tp -150.67 125.94 10.03 Favored 'General case' 0 C--N 1.303 -1.451 0 O-C-N 121.184 -0.948 . . . . 0.28000000000000003 109.939 -179.585 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' C' C ' 331' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -87.0 110.29 19.96 Favored 'General case' 0 N--CA 1.488 1.433 0 N-CA-C 108.554 -0.906 . . . . 1.48 108.554 179.236 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' C' C ' 332' ' ' ILE . . . . . 0.482 HG21 ' HA ' ' C' ' 338' ' ' PHE . 51.5 mt -100.87 111.44 30.56 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.521 0 O-C-N 121.232 -0.917 . . . . 0.23999999999999999 109.622 -179.382 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' C' C ' 333' ' ' ARG . . . . . 0.476 ' NH1' ' HG2' ' C' ' 333' ' ' ARG . 0.0 OUTLIER -72.71 153.07 41.34 Favored 'General case' 0 C--N 1.304 -1.374 0 O-C-N 121.395 -0.815 . . . . 2.7400000000000002 109.421 179.848 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' C' C ' 334' ' ' GLY . . . . . . . . . . . . . . . 73.97 118.67 0.08 OUTLIER Glycine 0 N--CA 1.491 2.323 0 N-CA-C 109.464 -1.455 . . . . 0.34999999999999998 109.464 -179.933 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 335' ' ' ARG . . . . . 0.564 ' HG3' ' CE2' ' A' ' 328' ' ' PHE . 4.6 ttt-85 -69.76 -30.39 67.96 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.251 -1.147 . . . . 2.5299999999999998 109.611 -179.826 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' C' C ' 336' ' ' GLU . . . . . . . . . . . . . 4.2 tt0 -57.89 -62.92 1.46 Allowed 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.134 -0.979 . . . . 2.6200000000000001 109.552 -179.828 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 337' ' ' ARG . . . . . 0.403 ' CZ ' ' OD1' ' A' ' 352' ' ' ASP . 2.3 mpt_? -60.5 -27.1 67.32 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.217 -0.927 . . . . 2.8100000000000001 109.588 -179.918 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' C' C ' 338' ' ' PHE . . . . . 0.482 ' HA ' HG21 ' C' ' 332' ' ' ILE . 61.2 t80 -54.58 -59.33 4.84 Favored 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.259 -0.901 . . . . 0.40000000000000002 109.536 -179.903 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' C' C ' 339' ' ' GLU . . . . . . . . . . . . . 1.5 mt-10 -52.56 -34.13 48.91 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.326 -0.859 . . . . 2.0499999999999998 109.884 -179.917 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 340' ' ' MET . . . . . . . . . . . . . 38.5 ttp -62.85 -49.98 72.76 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.194 -0.942 . . . . 0.32000000000000001 109.901 -179.558 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 341' ' ' PHE . . . . . 0.403 ' CD2' HD13 ' C' ' 332' ' ' ILE . 41.6 m-85 -62.59 -41.81 99.19 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.191 -0.943 . . . . 0.17999999999999999 109.724 -179.826 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' C' C ' 342' ' ' ARG . . . . . 0.449 ' NH1' ' HG3' ' C' ' 342' ' ' ARG . 0.0 OUTLIER -50.94 -43.68 60.23 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.323 -0.861 . . . . 2.9100000000000001 109.922 -179.83 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' C' C ' 343' ' ' GLU . . . . . . . . . . . . . 3.3 tp10 -58.53 -45.72 88.27 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.166 -0.959 . . . . 2.1400000000000001 109.725 -179.599 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 344' ' ' LEU . . . . . 0.465 HD22 ' CD2' ' D' ' 344' ' ' LEU . 81.0 mt -61.76 -37.63 85.01 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.18 -0.95 . . . . 0.22 109.499 -179.809 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' C' C ' 345' ' ' ASN . . . . . 0.436 ' O ' ' HG3' ' C' ' 349' ' ' GLU . 16.9 t-20 -58.74 -54.18 50.01 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.232 -0.917 . . . . 1.0800000000000001 109.567 179.929 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' C' C ' 346' ' ' GLU . . . . . . . . . . . . . 1.3 tm-20 -60.3 -32.12 70.91 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.283 -0.886 . . . . 2.21 109.792 -179.661 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 347' ' ' ALA . . . . . 0.703 ' HB1' ' HB1' ' D' ' 347' ' ' ALA . . . -59.44 -60.55 3.68 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.142 -0.974 . . . . 0.17999999999999999 109.828 -179.856 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' C' C ' 348' ' ' LEU . . . . . 0.637 ' N ' HD22 ' C' ' 348' ' ' LEU . 4.0 mm? -61.05 -31.57 71.22 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.2 -0.938 . . . . 0.32000000000000001 109.453 -179.836 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' C' C ' 349' ' ' GLU . . . . . 0.436 ' HG3' ' O ' ' C' ' 345' ' ' ASN . 7.6 mt-10 -59.46 -48.4 81.8 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.247 -0.908 . . . . 2.1899999999999999 110.013 -179.644 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' C' C ' 350' ' ' LEU . . . . . 0.66 HD13 HD22 ' D' ' 350' ' ' LEU . 6.6 tt -62.83 -38.56 91.25 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.069 -1.019 . . . . 0.46000000000000002 109.73 -179.623 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' C' C ' 351' ' ' LYS . . . . . . . . . . . . . 20.8 ttmt -58.08 -46.7 85.04 Favored 'General case' 0 N--CA 1.487 1.42 0 O-C-N 121.138 -0.976 . . . . 1.3500000000000001 109.204 179.921 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 352' ' ' ASP . . . . . . . . . . . . . 3.4 m-20 -56.71 -41.21 77.01 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.261 -0.899 . . . . 1.1899999999999999 109.576 179.863 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 353' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 1.646 0 O-C-N 121.29 -0.881 . . . . 0.56999999999999995 109.805 -179.647 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' D' D ' 326' ' ' GLU . . . . . . . . . . . . . 4.2 mm-40 . . . . . 0 N--CA 1.489 1.509 0 N-CA-C 109.214 -0.662 . . . . 2.1299999999999999 109.214 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' D' D ' 327' ' ' TYR . . . . . 0.527 ' CE2' ' CG ' ' B' ' 333' ' ' ARG . 42.1 m-85 -147.38 96.04 2.64 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.299 -0.875 . . . . 0.46999999999999997 109.396 -179.967 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' D' D ' 328' ' ' PHE . . . . . . . . . . . . . 58.1 m-85 -103.27 -160.35 0.77 Allowed 'General case' 0 N--CA 1.489 1.48 0 O-C-N 121.395 -0.816 . . . . 0.29999999999999999 109.639 -179.842 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' D' D ' 329' ' ' THR . . . . . . . . . . . . . 35.7 p -154.1 169.24 24.02 Favored 'General case' 0 N--CA 1.489 1.477 0 O-C-N 121.355 -0.841 . . . . 0.22 108.95 179.869 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' D' D ' 330' ' ' LEU . . . . . . . . . . . . . 24.9 tp -151.4 133.09 14.87 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.206 -0.934 . . . . 0.28000000000000003 109.796 -179.692 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' D' D ' 331' ' ' GLN . . . . . . . . . . . . . 7.1 tp-100 -85.82 115.96 23.78 Favored 'General case' 0 N--CA 1.489 1.494 0 O-C-N 121.325 -0.859 . . . . 0.93000000000000005 109.037 179.646 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' D' D ' 332' ' ' ILE . . . . . 0.78 HG21 ' HA ' ' D' ' 338' ' ' PHE . 75.3 mt -103.35 104.42 16.62 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.558 0 O-C-N 121.166 -0.959 . . . . 0.25 109.8 -179.603 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' D' D ' 333' ' ' ARG . . . . . 0.606 ' HG2' ' CE2' ' B' ' 327' ' ' TYR . 2.0 mpt_? -72.73 138.82 46.78 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.294 -0.879 . . . . 2.9300000000000002 109.36 179.738 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' D' D ' 334' ' ' GLY . . . . . . . . . . . . . . . 91.31 129.9 4.61 Favored Glycine 0 N--CA 1.491 2.313 0 N-CA-C 109.645 -1.382 . . . . 0.40999999999999998 109.645 179.838 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' D' D ' 335' ' ' ARG . . . . . 0.415 ' O ' ' HB3' ' D' ' 338' ' ' PHE . 57.6 ttt180 -79.12 -37.9 37.48 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.36 -1.082 . . . . 3.0299999999999998 109.57 -179.957 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' D' D ' 336' ' ' GLU . . . . . . . . . . . . . 5.1 mt-10 -57.9 -60.94 2.95 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.292 -0.88 . . . . 2.2599999999999998 109.774 -179.86 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' D' D ' 337' ' ' ARG . . . . . . . . . . . . . 4.0 mtt180 -59.96 -28.43 67.64 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.15 -0.968 . . . . 2.9199999999999999 109.693 -179.908 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' D' D ' 338' ' ' PHE . . . . . 0.78 ' HA ' HG21 ' D' ' 332' ' ' ILE . 59.5 t80 -54.56 -60.19 3.69 Favored 'General case' 0 N--CA 1.488 1.464 0 O-C-N 121.244 -0.91 . . . . 0.37 109.486 179.991 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' D' D ' 339' ' ' GLU . . . . . . . . . . . . . 5.7 mt-10 -51.35 -31.27 21.46 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.191 -0.943 . . . . 1.99 109.76 -179.951 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' D' D ' 340' ' ' MET . . . . . . . . . . . . . 27.4 ttp -64.18 -52.69 57.72 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.286 -0.884 . . . . 0.31 109.964 -179.715 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' D' D ' 341' ' ' PHE . . . . . . . . . . . . . 38.9 m-85 -61.83 -47.72 83.8 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.138 -0.976 . . . . 0.17999999999999999 109.794 -179.638 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' D' D ' 342' ' ' ARG . . . . . . . . . . . . . 9.8 ttt180 -49.7 -40.12 39.23 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.21 -0.931 . . . . 2.4100000000000001 109.85 -179.864 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' D' D ' 343' ' ' GLU . . . . . . . . . . . . . 4.2 tt0 -59.32 -49.81 76.41 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.147 -0.971 . . . . 2.3500000000000001 109.742 -179.76 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' D' D ' 344' ' ' LEU . . . . . 0.465 ' CD2' HD22 ' C' ' 344' ' ' LEU . 45.2 mt -61.85 -31.34 71.59 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.276 -0.89 . . . . 0.19 109.616 -179.787 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' D' D ' 345' ' ' ASN . . . . . . . . . . . . . 16.3 t-20 -57.88 -57.81 11.14 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.279 -0.888 . . . . 1.0900000000000001 109.526 -179.978 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' D' D ' 346' ' ' GLU . . . . . . . . . . . . . 36.6 tt0 -61.03 -29.2 69.58 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.43 -0.794 . . . . 1.6899999999999999 109.682 -179.878 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' D' D ' 347' ' ' ALA . . . . . 0.703 ' HB1' ' HB1' ' C' ' 347' ' ' ALA . . . -59.36 -58.35 9.0 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.239 -0.913 . . . . 0.17999999999999999 109.827 -179.827 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' D' D ' 348' ' ' LEU . . . . . 0.608 HD22 ' N ' ' D' ' 348' ' ' LEU . 4.1 mm? -61.65 -38.55 88.13 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.271 -0.893 . . . . 0.31 109.772 -179.656 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' D' D ' 349' ' ' GLU . . . . . . . . . . . . . 9.3 mt-10 -58.02 -38.33 76.0 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.228 -0.92 . . . . 1.95 110.013 -179.588 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' D' D ' 350' ' ' LEU . . . . . 0.66 HD22 HD13 ' C' ' 350' ' ' LEU . 6.1 tt -62.7 -48.83 77.57 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.11 -0.994 . . . . 0.42999999999999999 109.697 -179.757 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' D' D ' 351' ' ' LYS . . . . . . . . . . . . . 5.9 tttt -59.21 -36.86 76.14 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.14 -0.975 . . . . 1.3999999999999999 109.6 -179.895 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' D' D ' 352' ' ' ASP . . . . . 0.511 ' OD1' ' CZ ' ' B' ' 337' ' ' ARG . 55.5 m-20 -56.47 -42.33 78.05 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.332 -0.855 . . . . 1.1699999999999999 109.664 -179.972 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' D' D ' 353' ' ' ALA . . . . . . . . . . . . . . . -67.59 -23.07 65.35 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.219 -0.925 . . . . 0.58999999999999997 109.913 -179.598 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' D' D ' 354' ' ' GLN . . . . . . . . . . . . . 2.5 mt-30 . . . . . 0 N--CA 1.491 1.59 0 O-C-N 121.048 -1.033 . . . . 1.4399999999999999 109.762 -179.844 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 326' ' ' GLU . . . . . 0.427 ' O ' ' CD1' ' A' ' 327' ' ' TYR . 70.0 mm-40 . . . . . 0 N--CA 1.49 1.566 0 CA-C-O 121.388 0.614 . . . . 2.1299999999999999 109.579 . . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 327' ' ' TYR . . . . . 0.604 ' CE2' ' HG2' ' C' ' 333' ' ' ARG . 46.6 m-85 -149.54 110.15 4.26 Favored 'General case' 0 N--CA 1.487 1.42 0 O-C-N 121.484 -0.76 . . . . 0.47999999999999998 109.0 179.573 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 328' ' ' PHE . . . . . 0.424 ' CE1' ' HB3' ' A' ' 326' ' ' GLU . 54.8 m-85 -112.22 -167.99 1.26 Allowed 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.185 -0.947 . . . . 0.31 109.602 -179.696 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 329' ' ' THR . . . . . . . . . . . . . 53.3 p -152.06 164.81 36.46 Favored 'General case' 0 N--CA 1.488 1.457 0 O-C-N 121.416 -0.802 . . . . 0.22 108.973 -179.878 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 330' ' ' LEU . . . . . 0.435 ' O ' ' HA ' ' C' ' 329' ' ' THR . 19.1 tp -151.2 131.22 13.41 Favored 'General case' 0 C--N 1.301 -1.507 0 O-C-N 121.127 -0.983 . . . . 0.28000000000000003 109.769 -179.606 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 331' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -85.37 116.49 23.73 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.223 -0.923 . . . . 0.91000000000000003 108.989 179.524 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 332' ' ' ILE . . . . . 0.797 HG21 ' HA ' ' A' ' 338' ' ' PHE . 86.3 mt -101.52 103.44 14.91 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.53 0 O-C-N 121.281 -0.887 . . . . 0.26000000000000001 109.742 -179.619 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 333' ' ' ARG . . . . . 0.601 ' HG3' ' CD1' ' C' ' 327' ' ' TYR . 3.7 mpt_? -70.27 149.42 47.44 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.238 -0.914 . . . . 2.9199999999999999 109.199 179.632 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 334' ' ' GLY . . . . . . . . . . . . . . . 78.29 125.37 0.37 Allowed Glycine 0 N--CA 1.49 2.294 0 N-CA-C 109.6 -1.4 . . . . 0.40000000000000002 109.6 -179.799 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 335' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -74.62 -36.02 62.93 Favored 'General case' 0 N--CA 1.489 1.494 0 O-C-N 121.36 -1.082 . . . . 3.0099999999999998 109.546 179.956 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 336' ' ' GLU . . . . . . . . . . . . . 27.8 mt-10 -57.77 -58.95 6.1 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.149 -0.969 . . . . 2.29 109.739 -179.562 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 337' ' ' ARG . . . . . 0.644 ' NH1' HD12 ' C' ' 348' ' ' LEU . 15.8 mmt180 -60.77 -28.92 69.1 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.222 -0.924 . . . . 2.9300000000000002 110.178 -179.573 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 338' ' ' PHE . . . . . 0.797 ' HA ' HG21 ' A' ' 332' ' ' ILE . 41.8 t80 -57.31 -58.88 6.33 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.087 -1.008 . . . . 0.38 110.126 -179.655 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 339' ' ' GLU . . . . . . . . . . . . . 3.5 mt-10 -52.07 -33.91 41.35 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.132 -0.98 . . . . 1.97 110.165 -179.399 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 340' ' ' MET . . . . . . . . . . . . . 32.8 ttp -63.72 -49.94 71.1 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.21 -0.931 . . . . 0.31 109.965 -179.577 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 341' ' ' PHE . . . . . 0.519 ' CZ ' ' HA ' ' C' ' 345' ' ' ASN . 35.6 m-85 -62.14 -44.1 97.37 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.117 -0.99 . . . . 0.17999999999999999 110.038 -179.646 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 342' ' ' ARG . . . . . 0.479 ' HG2' ' NH1' ' A' ' 342' ' ' ARG . 0.1 OUTLIER -48.98 -45.48 42.29 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.236 -0.915 . . . . 2.4199999999999999 110.118 -179.537 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 343' ' ' GLU . . . . . . . . . . . . . 5.4 tt0 -57.83 -47.9 81.3 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.28 -0.888 . . . . 2.3500000000000001 109.977 -179.606 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 344' ' ' LEU . . . . . 0.413 ' O ' ' HB3' ' A' ' 347' ' ' ALA . 50.0 mt -61.36 -32.05 71.95 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.055 -1.028 . . . . 0.17999999999999999 109.734 -179.715 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 345' ' ' ASN . . . . . 0.464 ' HA ' ' CZ ' ' C' ' 341' ' ' PHE . 17.0 t-20 -56.81 -60.73 3.13 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.326 -0.858 . . . . 1.0900000000000001 109.752 -179.783 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 346' ' ' GLU . . . . . . . . . . . . . 4.3 tt0 -61.19 -24.41 66.3 Favored 'General case' 0 N--CA 1.488 1.438 0 O-C-N 121.269 -0.895 . . . . 1.6499999999999999 109.785 -179.801 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 347' ' ' ALA . . . . . 0.496 ' HB1' ' HB1' ' B' ' 347' ' ' ALA . . . -60.34 -61.76 2.37 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.213 -0.929 . . . . 0.17999999999999999 110.097 -179.728 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 348' ' ' LEU . . . . . 0.806 HD12 ' NH1' ' C' ' 337' ' ' ARG . 3.5 mm? -61.52 -47.43 85.63 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.165 -0.96 . . . . 0.29999999999999999 109.857 -179.455 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 349' ' ' GLU . . . . . . . . . . . . . 3.3 mm-40 -56.21 -30.6 62.53 Favored 'General case' 0 C--N 1.301 -1.539 0 O-C-N 121.17 -0.956 . . . . 1.9399999999999999 109.87 -179.307 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 350' ' ' LEU . . . . . 0.803 HD23 ' O ' ' A' ' 350' ' ' LEU . 4.0 tt -65.1 -45.1 86.58 Favored 'General case' 0 N--CA 1.488 1.463 0 O-C-N 121.217 -0.927 . . . . 0.46000000000000002 109.621 -179.743 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 351' ' ' LYS . . . . . . . . . . . . . 28.5 tttt -59.94 -50.72 72.64 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.263 -0.898 . . . . 1.3999999999999999 109.587 -179.836 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 352' ' ' ASP . . . . . . . . . . . . . 66.0 m-20 -55.8 -37.56 68.77 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.153 -0.967 . . . . 1.1599999999999999 109.689 -179.848 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 353' ' ' ALA . . . . . . . . . . . . . . . -65.36 -35.65 81.6 Favored 'General case' 0 N--CA 1.488 1.467 0 O-C-N 121.269 -0.894 . . . . 0.63 109.492 -179.834 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 354' ' ' GLN . . . . . . . . . . . . . 12.2 tt0 . . . . . 0 N--CA 1.489 1.516 0 O-C-N 121.287 -0.883 . . . . 1.47 109.353 179.839 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' B' B ' 326' ' ' GLU . . . . . 0.425 ' HB3' ' CE1' ' B' ' 328' ' ' PHE . 70.8 mm-40 . . . . . 0 N--CA 1.491 1.582 0 CA-C-O 121.308 0.575 . . . . 2.1299999999999999 109.535 . . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 327' ' ' TYR . . . . . 0.59 ' CE2' ' HG3' ' D' ' 333' ' ' ARG . 45.8 m-85 -150.15 109.46 3.96 Favored 'General case' 0 N--CA 1.487 1.421 0 O-C-N 121.274 -0.891 . . . . 0.47999999999999998 108.851 179.769 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 328' ' ' PHE . . . . . 0.442 ' HB2' ' CD1' ' D' ' 338' ' ' PHE . 53.0 m-85 -111.84 -167.44 1.18 Allowed 'General case' 0 N--CA 1.488 1.473 0 O-C-N 121.326 -0.859 . . . . 0.32000000000000001 109.666 -179.635 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 329' ' ' THR . . . . . . . . . . . . . 59.1 p -152.28 163.64 39.04 Favored 'General case' 0 C--N 1.302 -1.477 0 O-C-N 121.389 -0.82 . . . . 0.23000000000000001 109.144 -179.889 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 330' ' ' LEU . . . . . . . . . . . . . 17.3 tp -150.12 131.68 14.84 Favored 'General case' 0 N--CA 1.488 1.46 0 O-C-N 121.166 -0.958 . . . . 0.28000000000000003 109.743 -179.84 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 331' ' ' GLN . . . . . . . . . . . . . 1.4 tt0 -85.77 116.78 24.24 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.373 -0.829 . . . . 0.91000000000000003 108.906 179.587 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 332' ' ' ILE . . . . . 0.79 HG21 ' HA ' ' B' ' 338' ' ' PHE . 85.1 mt -101.97 104.04 15.83 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.489 0 O-C-N 121.207 -0.933 . . . . 0.23999999999999999 109.513 -179.573 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 333' ' ' ARG . . . . . 0.518 ' HG3' ' CE2' ' D' ' 327' ' ' TYR . 4.1 mpt_? -71.21 150.48 45.27 Favored 'General case' 0 C--N 1.305 -1.365 0 O-C-N 121.255 -0.903 . . . . 2.9300000000000002 109.011 179.746 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 334' ' ' GLY . . . . . . . . . . . . . . . 77.58 126.17 0.33 Allowed Glycine 0 N--CA 1.489 2.175 0 N-CA-C 109.388 -1.485 . . . . 0.40000000000000002 109.388 -179.986 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 335' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -75.22 -36.91 61.32 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.413 -1.051 . . . . 3.0099999999999998 109.608 -179.727 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 336' ' ' GLU . . . . . . . . . . . . . 38.7 mt-10 -56.96 -57.49 12.29 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.39 -0.819 . . . . 2.2799999999999998 110.069 -179.593 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 337' ' ' ARG . . . . . . . . . . . . . 17.0 mmt180 -62.38 -29.24 70.34 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.229 -0.919 . . . . 2.9300000000000002 109.877 -179.635 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 338' ' ' PHE . . . . . 0.79 ' HA ' HG21 ' B' ' 332' ' ' ILE . 44.5 t80 -56.57 -59.94 4.27 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.26 -0.9 . . . . 0.37 110.121 -179.692 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 339' ' ' GLU . . . . . . . . . . . . . 4.2 mt-10 -51.98 -33.44 38.0 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.238 -0.914 . . . . 1.98 110.102 -179.347 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 340' ' ' MET . . . . . . . . . . . . . 31.8 ttp -63.89 -49.68 71.74 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.066 -1.021 . . . . 0.32000000000000001 109.822 -179.578 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 341' ' ' PHE . . . . . . . . . . . . . 35.4 m-85 -62.31 -44.28 96.87 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.163 -0.961 . . . . 0.17999999999999999 110.04 -179.54 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 342' ' ' ARG . . . . . 0.474 ' NH1' ' HG2' ' B' ' 342' ' ' ARG . 0.1 OUTLIER -49.33 -44.62 44.58 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.283 -0.886 . . . . 2.4199999999999999 110.096 -179.576 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' B' B ' 343' ' ' GLU . . . . . . . . . . . . . 4.6 tt0 -58.18 -47.27 83.92 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.196 -0.94 . . . . 2.3500000000000001 109.914 -179.393 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 344' ' ' LEU . . . . . . . . . . . . . 50.3 mt -62.11 -31.68 72.16 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.309 -0.87 . . . . 0.17999999999999999 109.954 -179.825 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 345' ' ' ASN . . . . . 0.49 ' HA ' ' CZ ' ' D' ' 341' ' ' PHE . 17.0 t-20 -57.43 -60.48 3.58 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.232 -0.918 . . . . 1.0900000000000001 109.849 -179.683 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 346' ' ' GLU . . . . . . . . . . . . . 4.0 tt0 -61.1 -24.61 66.37 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.304 -0.872 . . . . 1.6599999999999999 109.791 -179.655 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 347' ' ' ALA . . . . . 0.496 ' HB1' ' HB1' ' A' ' 347' ' ' ALA . . . -60.18 -61.86 2.29 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.147 -0.971 . . . . 0.17000000000000001 110.016 -179.7 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 348' ' ' LEU . . . . . 0.589 HD22 ' N ' ' B' ' 348' ' ' LEU . 3.5 mm? -61.3 -47.73 84.61 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.234 -0.916 . . . . 0.28999999999999998 109.917 -179.418 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 349' ' ' GLU . . . . . . . . . . . . . 3.6 mm-40 -56.25 -30.3 62.21 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.174 -0.954 . . . . 1.95 109.825 -179.383 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 350' ' ' LEU . . . . . 0.756 HD23 ' O ' ' B' ' 350' ' ' LEU . 4.2 tt -65.17 -45.95 82.79 Favored 'General case' 0 N--CA 1.489 1.492 0 O-C-N 121.116 -0.99 . . . . 0.45000000000000001 109.328 179.912 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 351' ' ' LYS . . . . . . . . . . . . . 29.3 tttt -59.33 -51.5 69.69 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.233 -0.917 . . . . 1.3799999999999999 109.646 -179.898 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 352' ' ' ASP . . . . . . . . . . . . . 67.3 m-20 -55.35 -37.62 67.72 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.236 -0.915 . . . . 1.1599999999999999 109.748 -179.757 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 353' ' ' ALA . . . . . . . . . . . . . . . -65.68 -34.94 79.37 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.377 -0.827 . . . . 0.60999999999999999 109.403 -179.581 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 354' ' ' GLN . . . . . . . . . . . . . 14.4 tt0 . . . . . 0 N--CA 1.487 1.421 0 O-C-N 121.201 -0.937 . . . . 1.45 109.225 179.775 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' C' C ' 326' ' ' GLU . . . . . 0.424 ' HB3' ' CE1' ' C' ' 328' ' ' PHE . 3.0 mm-40 . . . . . 0 N--CA 1.487 1.389 0 N-CA-C 108.972 -0.751 . . . . 2.1699999999999999 108.972 . . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 327' ' ' TYR . . . . . 0.601 ' CD1' ' HG3' ' A' ' 333' ' ' ARG . 42.2 m-85 -146.82 100.54 3.33 Favored 'General case' 0 C--N 1.302 -1.5 0 O-C-N 121.238 -0.914 . . . . 0.47999999999999998 108.973 -179.885 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' C' C ' 328' ' ' PHE . . . . . 0.424 ' CE1' ' HB3' ' C' ' 326' ' ' GLU . 87.6 m-85 -103.2 -166.41 1.27 Allowed 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.278 -0.889 . . . . 0.33000000000000002 109.711 -179.449 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' C' C ' 329' ' ' THR . . . . . 0.435 ' HA ' ' O ' ' A' ' 330' ' ' LEU . 24.7 p -152.97 161.44 42.53 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.413 -0.804 . . . . 0.23000000000000001 109.014 -179.865 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' C' C ' 330' ' ' LEU . . . . . . . . . . . . . 17.2 tp -149.95 133.42 16.57 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.158 -0.963 . . . . 0.28000000000000003 109.508 -179.525 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 331' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -87.72 116.22 25.7 Favored 'General case' 0 N--CA 1.488 1.47 0 O-C-N 121.352 -0.843 . . . . 1.48 109.36 179.802 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' C' C ' 332' ' ' ILE . . . . . 0.806 HG21 ' HA ' ' C' ' 338' ' ' PHE . 15.1 mt -104.24 104.76 17.3 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.68 0 O-C-N 121.247 -0.908 . . . . 0.23999999999999999 109.607 179.961 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' C' C ' 333' ' ' ARG . . . . . 0.604 ' HG2' ' CE2' ' A' ' 327' ' ' TYR . 0.7 OUTLIER -73.04 143.38 47.52 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.392 -0.817 . . . . 2.7400000000000002 109.423 179.582 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' C' C ' 334' ' ' GLY . . . . . . . . . . . . . . . 80.63 131.61 1.06 Allowed Glycine 0 N--CA 1.495 2.623 0 N-CA-C 109.722 -1.351 . . . . 0.34999999999999998 109.722 179.848 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 335' ' ' ARG . . . . . 0.522 ' NH1' ' HG2' ' C' ' 335' ' ' ARG . 0.0 OUTLIER -79.48 -32.75 42.58 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.241 -1.152 . . . . 2.5299999999999998 109.725 179.975 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' C' C ' 336' ' ' GLU . . . . . . . . . . . . . 49.2 mt-10 -55.55 -61.97 2.0 Allowed 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.238 -0.914 . . . . 2.6200000000000001 109.208 -179.737 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 337' ' ' ARG . . . . . 0.806 ' NH1' HD12 ' A' ' 348' ' ' LEU . 30.5 mmt180 -61.98 -28.56 69.65 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.192 -0.942 . . . . 2.8100000000000001 109.493 179.737 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' C' C ' 338' ' ' PHE . . . . . 0.806 ' HA ' HG21 ' C' ' 332' ' ' ILE . 86.4 t80 -54.94 -61.22 2.46 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.361 -0.837 . . . . 0.40000000000000002 110.135 -179.552 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' C' C ' 339' ' ' GLU . . . . . . . . . . . . . 50.1 mt-10 -51.2 -34.2 30.86 Favored 'General case' 0 N--CA 1.495 1.787 0 O-C-N 121.257 -0.902 . . . . 2.0499999999999998 109.777 -179.836 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 340' ' ' MET . . . . . . . . . . . . . 33.0 ttp -62.66 -50.77 69.89 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.316 -0.865 . . . . 0.32000000000000001 109.791 -179.492 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 341' ' ' PHE . . . . . 0.464 ' CZ ' ' HA ' ' A' ' 345' ' ' ASN . 50.7 m-85 -61.11 -42.52 98.67 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.025 -1.047 . . . . 0.17999999999999999 109.89 -179.772 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' C' C ' 342' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -52.35 -46.11 65.99 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.025 -1.047 . . . . 2.9100000000000001 109.782 179.984 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' C' C ' 343' ' ' GLU . . . . . . . . . . . . . 9.4 tt0 -57.12 -49.14 76.81 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.225 -0.922 . . . . 2.1400000000000001 109.835 -179.528 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 344' ' ' LEU . . . . . . . . . . . . . 85.4 mt -62.25 -28.06 69.44 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.292 -0.88 . . . . 0.22 109.552 179.945 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 345' ' ' ASN . . . . . 0.519 ' HA ' ' CZ ' ' A' ' 341' ' ' PHE . 24.8 t-20 -58.74 -63.21 1.37 Allowed 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.425 -0.797 . . . . 1.0800000000000001 110.303 -179.422 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' C' C ' 346' ' ' GLU . . . . . 0.44 ' O ' ' HB2' ' C' ' 350' ' ' LEU . 17.9 tt0 -61.66 -21.77 64.71 Favored 'General case' 0 C--N 1.301 -1.509 0 O-C-N 121.3 -0.875 . . . . 2.21 109.948 -179.444 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' C' C ' 347' ' ' ALA . . . . . 0.454 ' HB1' ' HB1' ' D' ' 347' ' ' ALA . . . -61.67 -58.43 8.08 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.004 -1.06 . . . . 0.17999999999999999 110.214 -179.617 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' C' C ' 348' ' ' LEU . . . . . 0.644 HD12 ' NH1' ' A' ' 337' ' ' ARG . 3.4 mm? -63.47 -53.94 44.26 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.071 -1.018 . . . . 0.32000000000000001 110.344 -179.214 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' C' C ' 349' ' ' GLU . . . . . . . . . . . . . 1.9 mp0 -57.22 -26.84 61.37 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.002 -1.061 . . . . 2.1899999999999999 109.735 -179.472 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 350' ' ' LEU . . . . . 0.99 ' CD2' HD13 ' D' ' 350' ' ' LEU . 7.7 tt -65.12 -46.7 79.92 Favored 'General case' 0 N--CA 1.488 1.453 0 O-C-N 121.015 -1.053 . . . . 0.46000000000000002 109.165 179.666 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' C' C ' 351' ' ' LYS . . . . . 0.414 ' N ' HD23 ' C' ' 350' ' ' LEU . 42.1 tttt -61.19 -43.63 98.58 Favored 'General case' 0 N--CA 1.488 1.438 0 O-C-N 121.385 -0.822 . . . . 1.3500000000000001 109.473 179.924 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' C' C ' 352' ' ' ASP . . . . . . . . . . . . . 2.9 m-20 -56.28 -47.79 77.9 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.264 -0.898 . . . . 1.1899999999999999 109.655 -179.95 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 353' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 1.499 0 O-C-N 121.189 -0.944 . . . . 0.56999999999999995 109.424 -179.934 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' D' D ' 326' ' ' GLU . . . . . 0.433 ' O ' ' CD1' ' D' ' 327' ' ' TYR . 71.8 mm-40 . . . . . 0 N--CA 1.488 1.437 0 CA-C-O 121.514 0.673 . . . . 2.1299999999999999 109.617 . . . . . . . . . 1 1 . 1 . 002 nuclear build core ' D' D ' 327' ' ' TYR . . . . . 0.518 ' CE2' ' HG3' ' B' ' 333' ' ' ARG . 47.4 m-85 -150.12 109.49 3.98 Favored 'General case' 0 C--N 1.302 -1.5 0 O-C-N 121.276 -0.89 . . . . 0.46999999999999997 109.082 179.817 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' D' D ' 328' ' ' PHE . . . . . 0.417 ' CE1' ' HB3' ' D' ' 326' ' ' GLU . 52.0 m-85 -111.35 -166.71 1.1 Allowed 'General case' 0 N--CA 1.488 1.472 0 O-C-N 121.398 -0.814 . . . . 0.29999999999999999 109.623 -179.674 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' D' D ' 329' ' ' THR . . . . . . . . . . . . . 66.4 p -152.56 163.33 39.8 Favored 'General case' 0 N--CA 1.488 1.425 0 O-C-N 121.34 -0.85 . . . . 0.22 108.843 179.991 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' D' D ' 330' ' ' LEU . . . . . . . . . . . . . 17.7 tp -149.85 131.35 14.8 Favored 'General case' 0 C--N 1.301 -1.507 0 O-C-N 121.158 -0.964 . . . . 0.28000000000000003 109.655 -179.702 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' D' D ' 331' ' ' GLN . . . . . . . . . . . . . 1.5 tt0 -86.0 116.66 24.36 Favored 'General case' 0 C--N 1.303 -1.433 0 O-C-N 121.347 -0.846 . . . . 0.93000000000000005 108.804 179.593 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' D' D ' 332' ' ' ILE . . . . . 0.774 HG21 ' HA ' ' D' ' 338' ' ' PHE . 80.4 mt -102.4 103.68 15.36 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.452 0 O-C-N 121.344 -0.848 . . . . 0.25 109.572 -179.545 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' D' D ' 333' ' ' ARG . . . . . 0.59 ' HG3' ' CE2' ' B' ' 327' ' ' TYR . 4.5 mpt_? -70.64 151.22 45.2 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.282 -0.886 . . . . 2.9300000000000002 109.294 179.731 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' D' D ' 334' ' ' GLY . . . . . . . . . . . . . . . 77.07 126.77 0.29 Allowed Glycine 0 N--CA 1.489 2.199 0 N-CA-C 109.389 -1.485 . . . . 0.40999999999999998 109.389 -179.953 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' D' D ' 335' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -75.68 -36.83 59.96 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.426 -1.043 . . . . 3.0299999999999998 109.56 -179.815 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' D' D ' 336' ' ' GLU . . . . . . . . . . . . . 43.8 mt-10 -56.8 -58.77 6.67 Favored 'General case' 0 C--N 1.301 -1.505 0 O-C-N 121.281 -0.887 . . . . 2.2599999999999998 109.778 -179.633 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' D' D ' 337' ' ' ARG . . . . . 0.475 ' CZ ' HD12 ' B' ' 348' ' ' LEU . 16.9 mmt180 -60.94 -28.94 69.33 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.195 -0.941 . . . . 2.9199999999999999 110.196 -179.578 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' D' D ' 338' ' ' PHE . . . . . 0.774 ' HA ' HG21 ' D' ' 332' ' ' ILE . 40.5 t80 -57.22 -60.29 3.83 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.261 -0.899 . . . . 0.37 110.081 -179.45 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' D' D ' 339' ' ' GLU . . . . . . . . . . . . . 5.3 mt-10 -51.89 -33.0 34.8 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.328 -0.858 . . . . 1.99 110.218 -179.203 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' D' D ' 340' ' ' MET . . . . . . . . . . . . . 30.2 ttp -63.96 -49.94 70.6 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.065 -1.022 . . . . 0.31 109.755 -179.659 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' D' D ' 341' ' ' PHE . . . . . 0.49 ' CZ ' ' HA ' ' B' ' 345' ' ' ASN . 36.2 m-85 -61.97 -43.96 97.74 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.314 -0.866 . . . . 0.17999999999999999 110.106 -179.721 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' D' D ' 342' ' ' ARG . . . . . 0.493 ' NH1' ' HG2' ' D' ' 342' ' ' ARG . 0.1 OUTLIER -49.32 -44.54 44.49 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.401 -0.812 . . . . 2.4100000000000001 110.042 -179.54 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' D' D ' 343' ' ' GLU . . . . . . . . . . . . . 4.4 tt0 -58.49 -47.85 82.73 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.247 -0.908 . . . . 2.3500000000000001 109.949 -179.448 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' D' D ' 344' ' ' LEU . . . . . . . . . . . . . 47.3 mt -61.58 -32.03 72.11 Favored 'General case' 0 N--CA 1.489 1.493 0 O-C-N 121.065 -1.022 . . . . 0.19 109.979 -179.66 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' D' D ' 345' ' ' ASN . . . . . . . . . . . . . 16.3 t-20 -57.09 -60.39 3.66 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.23 -0.919 . . . . 1.0900000000000001 109.85 -179.538 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' D' D ' 346' ' ' GLU . . . . . . . . . . . . . 3.9 tt0 -61.09 -24.71 66.44 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.391 -0.818 . . . . 1.6899999999999999 109.699 -179.549 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' D' D ' 347' ' ' ALA . . . . . 0.454 ' HB1' ' HB1' ' C' ' 347' ' ' ALA . . . -60.15 -61.7 2.41 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.162 -0.961 . . . . 0.17999999999999999 110.058 -179.719 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' D' D ' 348' ' ' LEU . . . . . 0.606 HD22 ' N ' ' D' ' 348' ' ' LEU . 3.5 mm? -61.4 -47.72 84.52 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.144 -0.972 . . . . 0.31 110.219 -179.616 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' D' D ' 349' ' ' GLU . . . . . . . . . . . . . 3.5 mm-40 -56.71 -29.81 62.84 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.131 -0.981 . . . . 1.95 109.723 -179.327 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' D' D ' 350' ' ' LEU . . . . . 0.99 HD13 ' CD2' ' C' ' 350' ' ' LEU . 4.3 tt -64.95 -45.92 83.75 Favored 'General case' 0 N--CA 1.488 1.469 0 O-C-N 121.252 -0.905 . . . . 0.42999999999999999 109.368 179.947 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' D' D ' 351' ' ' LYS . . . . . . . . . . . . . 29.3 tttt -60.04 -51.62 68.85 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.504 -0.748 . . . . 1.3999999999999999 109.584 179.959 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' D' D ' 352' ' ' ASP . . . . . . . . . . . . . 69.3 m-20 -55.3 -38.04 68.13 Favored 'General case' 0 N--CA 1.489 1.48 0 O-C-N 121.343 -0.848 . . . . 1.1699999999999999 109.382 -179.916 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' D' D ' 353' ' ' ALA . . . . . . . . . . . . . . . -65.17 -35.17 80.24 Favored 'General case' 0 N--CA 1.489 1.489 0 O-C-N 121.146 -0.971 . . . . 0.58999999999999997 109.552 -179.998 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' D' D ' 354' ' ' GLN . . . . . . . . . . . . . 15.1 tt0 . . . . . 0 N--CA 1.488 1.457 0 O-C-N 121.151 -0.968 . . . . 1.4399999999999999 109.557 -179.944 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 326' ' ' GLU . . . . . 0.453 ' HB3' ' CE2' ' A' ' 328' ' ' PHE . 43.5 mm-40 . . . . . 0 N--CA 1.49 1.568 0 N-CA-C 109.093 -0.706 . . . . 2.1299999999999999 109.093 . . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 327' ' ' TYR . . . . . 0.611 ' CE1' ' HG2' ' C' ' 333' ' ' ARG . 41.2 m-85 -149.69 104.83 3.37 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.169 -0.957 . . . . 0.47999999999999998 109.428 -179.894 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 328' ' ' PHE . . . . . 0.453 ' CE2' ' HB3' ' A' ' 326' ' ' GLU . 88.9 m-85 -111.46 -166.19 1.06 Allowed 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.419 -0.801 . . . . 0.31 109.576 -179.72 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 329' ' ' THR . . . . . 0.404 ' HA ' ' O ' ' C' ' 330' ' ' LEU . 33.5 p -153.61 160.92 42.56 Favored 'General case' 0 N--CA 1.488 1.435 0 O-C-N 121.451 -0.781 . . . . 0.22 108.923 -179.826 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 330' ' ' LEU . . . . . 0.59 HD11 HD22 ' C' ' 345' ' ' ASN . 25.9 tp -150.78 129.84 12.62 Favored 'General case' 0 N--CA 1.488 1.465 0 O-C-N 121.167 -0.958 . . . . 0.28000000000000003 109.738 -179.611 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 331' ' ' GLN . . . . . . . . . . . . . 1.3 tt0 -88.82 113.81 24.77 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.22 -0.925 . . . . 0.91000000000000003 109.189 179.732 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 332' ' ' ILE . . . . . 0.478 HD12 ' CD1' ' A' ' 338' ' ' PHE . 38.5 mt -103.41 111.76 34.35 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.505 0 O-C-N 121.08 -1.013 . . . . 0.26000000000000001 109.911 -179.864 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 333' ' ' ARG . . . . . 0.594 ' CG ' ' CE1' ' C' ' 327' ' ' TYR . 0.0 OUTLIER -73.12 149.28 43.17 Favored 'General case' 0 C--N 1.302 -1.47 0 O-C-N 121.27 -0.894 . . . . 2.9199999999999999 109.488 179.725 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 334' ' ' GLY . . . . . . . . . . . . . . . 84.77 132.57 2.53 Favored Glycine 0 N--CA 1.49 2.259 0 N-CA-C 109.514 -1.434 . . . . 0.40000000000000002 109.514 -179.917 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 335' ' ' ARG . . . . . . . . . . . . . 36.0 ttt180 -78.92 -42.48 26.98 Favored 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.199 -1.177 . . . . 3.0099999999999998 109.59 -179.83 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 336' ' ' GLU . . . . . . . . . . . . . 3.5 pt-20 -57.22 -53.08 62.14 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.232 -0.917 . . . . 2.29 110.115 -179.589 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 337' ' ' ARG . . . . . 0.604 ' CZ ' HD12 ' C' ' 348' ' ' LEU . 12.6 mmt180 -61.97 -34.81 76.82 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 120.97 -1.081 . . . . 2.9300000000000002 109.809 -179.754 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 338' ' ' PHE . . . . . 0.478 ' CD1' HD12 ' A' ' 332' ' ' ILE . 80.8 t80 -55.32 -57.55 11.36 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.173 -0.955 . . . . 0.38 109.802 -179.711 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 339' ' ' GLU . . . . . . . . . . . . . 44.1 mt-10 -51.43 -36.09 42.29 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.224 -0.923 . . . . 1.97 110.425 -179.681 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 340' ' ' MET . . . . . . . . . . . . . 47.1 ttp -62.44 -48.57 79.08 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.119 -0.988 . . . . 0.31 109.808 -179.448 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 341' ' ' PHE . . . . . 0.434 ' CZ ' ' HA ' ' C' ' 345' ' ' ASN . 43.3 m-85 -62.55 -47.81 82.24 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.128 -0.982 . . . . 0.17999999999999999 109.982 -179.614 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 342' ' ' ARG . . . . . . . . . . . . . 19.7 ttt180 -49.23 -42.32 40.18 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.316 -0.865 . . . . 2.4199999999999999 110.21 -179.496 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 343' ' ' GLU . . . . . . . . . . . . . 4.2 tp10 -58.89 -49.05 79.24 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.143 -0.973 . . . . 2.3500000000000001 109.921 -179.611 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 344' ' ' LEU . . . . . 0.569 HD22 ' CD2' ' B' ' 344' ' ' LEU . 37.1 mt -61.34 -31.56 71.43 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.217 -0.927 . . . . 0.17999999999999999 109.76 -179.568 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 345' ' ' ASN . . . . . . . . . . . . . 62.4 t-20 -57.36 -54.3 48.4 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.295 -0.878 . . . . 1.0900000000000001 109.698 -179.717 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 346' ' ' GLU . . . . . . . . . . . . . 6.0 tp10 -62.62 -27.74 69.41 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.331 -0.855 . . . . 1.6499999999999999 110.097 -179.661 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 347' ' ' ALA . . . . . 0.891 ' HB1' ' HB1' ' B' ' 347' ' ' ALA . . . -61.85 -58.82 6.5 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.217 -0.927 . . . . 0.17999999999999999 110.025 -179.609 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 348' ' ' LEU . . . . . 0.583 HD22 ' N ' ' A' ' 348' ' ' LEU . 3.8 mm? -60.72 -48.53 81.37 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.119 -0.988 . . . . 0.29999999999999999 110.053 -179.304 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 349' ' ' GLU . . . . . 0.452 ' OE1' ' NH1' ' C' ' 333' ' ' ARG . 43.4 mt-10 -56.98 -33.13 66.79 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.155 -0.966 . . . . 1.9399999999999999 109.533 -179.47 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 350' ' ' LEU . . . . . 0.817 HD23 ' O ' ' A' ' 350' ' ' LEU . 3.9 tt -63.96 -45.34 89.59 Favored 'General case' 0 C--N 1.302 -1.469 0 O-C-N 121.269 -0.895 . . . . 0.46000000000000002 109.182 179.887 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 351' ' ' LYS . . . . . . . . . . . . . 9.5 tttp -60.5 -45.33 94.19 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.279 -0.888 . . . . 1.3999999999999999 109.624 179.858 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 352' ' ' ASP . . . . . . . . . . . . . 7.0 m-20 -55.19 -37.56 67.23 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.233 -0.917 . . . . 1.1599999999999999 109.633 -179.844 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 353' ' ' ALA . . . . . . . . . . . . . . . -66.08 -30.29 70.78 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.228 -0.92 . . . . 0.63 109.702 -179.795 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 354' ' ' GLN . . . . . . . . . . . . . 2.4 tt0 . . . . . 0 N--CA 1.492 1.658 0 O-C-N 121.239 -0.913 . . . . 1.47 109.727 -179.954 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' B' B ' 326' ' ' GLU . . . . . 0.452 ' HB3' ' CE2' ' B' ' 328' ' ' PHE . 45.1 mm-40 . . . . . 0 N--CA 1.491 1.582 0 N-CA-C 109.205 -0.665 . . . . 2.1299999999999999 109.205 . . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 327' ' ' TYR . . . . . 0.622 ' CE1' ' CG ' ' D' ' 333' ' ' ARG . 42.9 m-85 -149.16 106.36 3.61 Favored 'General case' 0 C--N 1.301 -1.516 0 O-C-N 121.177 -0.952 . . . . 0.47999999999999998 109.199 179.974 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 328' ' ' PHE . . . . . 0.53 ' CE2' ' HA ' ' D' ' 335' ' ' ARG . 89.3 m-85 -113.57 -167.07 1.15 Allowed 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.331 -0.856 . . . . 0.32000000000000001 109.458 -179.563 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 329' ' ' THR . . . . . . . . . . . . . 33.9 p -152.74 161.32 42.72 Favored 'General case' 0 N--CA 1.488 1.459 0 O-C-N 121.314 -0.866 . . . . 0.23000000000000001 109.08 -179.912 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 330' ' ' LEU . . . . . . . . . . . . . 25.4 tp -151.19 129.09 11.69 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 120.966 -1.084 . . . . 0.28000000000000003 109.779 -179.637 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 331' ' ' GLN . . . . . . . . . . . . . 1.3 tt0 -87.96 114.91 25.03 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.201 -0.937 . . . . 0.91000000000000003 109.185 179.623 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 332' ' ' ILE . . . . . 0.474 HD12 ' CD1' ' B' ' 338' ' ' PHE . 39.1 mt -103.89 111.81 34.97 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.594 0 O-C-N 121.09 -1.006 . . . . 0.23999999999999999 109.718 -179.871 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 333' ' ' ARG . . . . . 0.598 ' HG2' ' CE1' ' D' ' 327' ' ' TYR . 0.0 OUTLIER -73.34 149.21 42.77 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.231 -0.918 . . . . 2.9300000000000002 109.587 179.755 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' B' B ' 334' ' ' GLY . . . . . . . . . . . . . . . 84.23 132.36 2.29 Favored Glycine 0 N--CA 1.492 2.391 0 N-CA-C 109.437 -1.465 . . . . 0.40000000000000002 109.437 -179.834 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 335' ' ' ARG . . . . . 0.492 ' HA ' ' CE2' ' D' ' 328' ' ' PHE . 38.4 ttt180 -78.62 -41.96 30.15 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.332 -1.099 . . . . 3.0099999999999998 109.737 -179.768 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 336' ' ' GLU . . . . . . . . . . . . . 3.7 pt-20 -57.16 -53.2 60.84 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.224 -0.922 . . . . 2.2799999999999998 110.09 -179.677 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 337' ' ' ARG . . . . . . . . . . . . . 13.0 mmt180 -62.05 -34.9 77.12 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.044 -1.035 . . . . 2.9300000000000002 109.929 -179.75 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 338' ' ' PHE . . . . . 0.474 ' CD1' HD12 ' B' ' 332' ' ' ILE . 80.3 t80 -55.61 -56.71 17.2 Favored 'General case' 0 C--N 1.303 -1.455 0 O-C-N 121.211 -0.931 . . . . 0.37 109.88 -179.618 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 339' ' ' GLU . . . . . . . . . . . . . 44.0 mt-10 -52.4 -35.2 51.13 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.222 -0.923 . . . . 1.98 110.337 -179.489 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 340' ' ' MET . . . . . . . . . . . . . 47.4 ttp -63.27 -48.27 78.85 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.135 -0.978 . . . . 0.32000000000000001 109.755 -179.405 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 341' ' ' PHE . . . . . . . . . . . . . 43.9 m-85 -62.49 -47.94 81.74 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.204 -0.935 . . . . 0.17999999999999999 109.848 -179.886 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 342' ' ' ARG . . . . . . . . . . . . . 17.2 ttt180 -49.24 -41.98 39.25 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.246 -0.909 . . . . 2.4199999999999999 110.162 -179.55 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 343' ' ' GLU . . . . . . . . . . . . . 4.3 tp10 -59.16 -48.72 80.57 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.026 -1.046 . . . . 2.3500000000000001 109.839 -179.53 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 344' ' ' LEU . . . . . 0.569 ' CD2' HD22 ' A' ' 344' ' ' LEU . 38.0 mt -61.76 -31.3 71.48 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.207 -0.933 . . . . 0.17999999999999999 109.865 -179.609 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 345' ' ' ASN . . . . . 0.594 ' C ' HD21 ' B' ' 345' ' ' ASN . 0.3 OUTLIER -57.64 -54.65 44.42 Favored 'General case' 0 C--N 1.302 -1.465 0 O-C-N 121.175 -0.953 . . . . 1.0900000000000001 109.641 -179.714 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' B' B ' 346' ' ' GLU . . . . . . . . . . . . . 6.3 tp10 -62.0 -28.06 69.3 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.29 -0.881 . . . . 1.6599999999999999 110.047 -179.659 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 347' ' ' ALA . . . . . 0.891 ' HB1' ' HB1' ' A' ' 347' ' ' ALA . . . -61.62 -58.32 8.55 Favored 'General case' 0 N--CA 1.495 1.795 0 O-C-N 121.138 -0.976 . . . . 0.17000000000000001 110.238 -179.732 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 348' ' ' LEU . . . . . 0.569 HD22 ' N ' ' B' ' 348' ' ' LEU . 3.8 mm? -61.09 -49.54 76.88 Favored 'General case' 0 N--CA 1.493 1.692 0 O-C-N 121.287 -0.883 . . . . 0.28999999999999998 109.869 -179.283 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 349' ' ' GLU . . . . . . . . . . . . . 44.0 mt-10 -56.1 -32.9 64.6 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.047 -1.033 . . . . 1.95 109.617 -179.624 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 350' ' ' LEU . . . . . 0.832 HD23 ' O ' ' B' ' 350' ' ' LEU . 4.0 tt -64.46 -44.38 91.26 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.245 -0.909 . . . . 0.45000000000000001 109.399 179.929 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 351' ' ' LYS . . . . . . . . . . . . . 9.9 tttp -61.56 -45.32 94.65 Favored 'General case' 0 N--CA 1.488 1.45 0 O-C-N 121.337 -0.852 . . . . 1.3799999999999999 109.619 179.872 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 352' ' ' ASP . . . . . . . . . . . . . 6.3 m-20 -55.23 -37.21 66.86 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.201 -0.937 . . . . 1.1599999999999999 109.602 -179.995 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 353' ' ' ALA . . . . . . . . . . . . . . . -66.44 -30.97 71.44 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.164 -0.96 . . . . 0.60999999999999999 109.548 -179.75 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 354' ' ' GLN . . . . . . . . . . . . . 2.4 tt0 . . . . . 0 N--CA 1.489 1.505 0 O-C-N 121.109 -0.994 . . . . 1.45 109.552 -179.962 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' C' C ' 326' ' ' GLU . . . . . . . . . . . . . 3.1 mt-10 . . . . . 0 N--CA 1.492 1.652 0 CA-C-O 121.392 0.615 . . . . 2.1699999999999999 109.635 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' C' C ' 327' ' ' TYR . . . . . 0.594 ' CE1' ' CG ' ' A' ' 333' ' ' ARG . 38.2 m-85 -149.14 111.45 4.69 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.412 -0.805 . . . . 0.47999999999999998 109.512 179.823 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' C' C ' 328' ' ' PHE . . . . . 0.418 ' O ' HG23 ' C' ' 329' ' ' THR . 93.8 m-85 -113.47 -170.17 1.64 Allowed 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.2 -0.938 . . . . 0.33000000000000002 109.578 -179.941 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' C' C ' 329' ' ' THR . . . . . 0.418 HG23 ' O ' ' C' ' 328' ' ' PHE . 6.3 p -153.28 161.78 42.01 Favored 'General case' 0 N--CA 1.491 1.609 0 N-CA-C 108.807 -0.812 . . . . 0.23000000000000001 108.807 179.84 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' C' C ' 330' ' ' LEU . . . . . 0.404 ' O ' ' HA ' ' A' ' 329' ' ' THR . 15.7 tp -150.46 130.01 13.05 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.0 -1.063 . . . . 0.28000000000000003 110.609 -179.027 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' C' C ' 331' ' ' GLN . . . . . . . . . . . . . 1.8 tp60 -89.32 116.0 27.21 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.394 -0.816 . . . . 1.48 108.938 178.885 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 332' ' ' ILE . . . . . . . . . . . . . 58.5 mt -103.7 115.04 44.91 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.695 0 O-C-N 121.011 -1.056 . . . . 0.23999999999999999 109.984 -179.569 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 333' ' ' ARG . . . . . 0.611 ' HG2' ' CE1' ' A' ' 327' ' ' TYR . 0.7 OUTLIER -72.61 146.64 46.5 Favored 'General case' 0 N--CA 1.489 1.494 0 O-C-N 121.319 -0.863 . . . . 2.7400000000000002 109.223 179.58 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' C' C ' 334' ' ' GLY . . . . . . . . . . . . . . . 84.43 127.79 1.6 Allowed Glycine 0 N--CA 1.49 2.272 0 N-CA-C 109.896 -1.282 . . . . 0.34999999999999998 109.896 179.759 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 335' ' ' ARG . . . . . 0.418 ' O ' ' HB3' ' C' ' 338' ' ' PHE . 62.4 ttt180 -78.5 -32.97 48.4 Favored 'General case' 0 C--N 1.301 -1.501 0 O-C-N 121.331 -1.099 . . . . 2.5299999999999998 109.271 179.634 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' C' C ' 336' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -57.74 -62.03 2.09 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.355 -0.841 . . . . 2.6200000000000001 110.027 -179.702 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' C' C ' 337' ' ' ARG . . . . . . . . . . . . . 1.1 mpt_? -60.43 -26.54 66.8 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.287 -0.883 . . . . 2.8100000000000001 109.905 -179.427 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 338' ' ' PHE . . . . . 0.418 ' HB3' ' O ' ' C' ' 335' ' ' ARG . 76.1 t80 -55.89 -58.95 5.71 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.236 -0.915 . . . . 0.40000000000000002 109.855 -179.899 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' C' C ' 339' ' ' GLU . . . . . . . . . . . . . 10.2 mm-40 -51.64 -34.51 38.21 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.309 -0.87 . . . . 2.0499999999999998 109.884 -179.537 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 340' ' ' MET . . . . . . . . . . . . . 33.4 ttp -64.43 -49.53 71.11 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.22 -0.925 . . . . 0.32000000000000001 109.898 -179.665 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 341' ' ' PHE . . . . . . . . . . . . . 41.2 m-85 -60.78 -39.54 89.19 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.177 -0.952 . . . . 0.17999999999999999 109.848 -179.505 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 342' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -51.77 -45.83 63.9 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.119 -0.988 . . . . 2.9100000000000001 109.835 179.879 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' C' C ' 343' ' ' GLU . . . . . . . . . . . . . 2.3 tp10 -59.17 -47.77 84.09 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.309 -0.869 . . . . 2.1400000000000001 110.486 -179.267 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 344' ' ' LEU . . . . . 0.464 ' CD2' HD22 ' D' ' 344' ' ' LEU . 30.2 mt -61.62 -35.0 76.65 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.034 -1.041 . . . . 0.22 110.159 -179.376 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' C' C ' 345' ' ' ASN . . . . . 0.59 HD22 HD11 ' A' ' 330' ' ' LEU . 50.4 t-20 -58.17 -59.76 4.8 Favored 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.245 -0.91 . . . . 1.0800000000000001 110.217 -179.506 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' C' C ' 346' ' ' GLU . . . . . . . . . . . . . 2.6 tt0 -60.55 -22.95 64.22 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.183 -0.948 . . . . 2.21 110.168 -179.375 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 347' ' ' ALA . . . . . 0.652 ' HB1' ' HB1' ' D' ' 347' ' ' ALA . . . -61.52 -57.47 12.0 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.124 -0.985 . . . . 0.17999999999999999 110.159 -179.657 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' C' C ' 348' ' ' LEU . . . . . 0.604 HD12 ' CZ ' ' A' ' 337' ' ' ARG . 4.2 mm? -61.83 -52.92 62.19 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.267 -0.896 . . . . 0.32000000000000001 110.272 -179.165 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' C' C ' 349' ' ' GLU . . . . . . . . . . . . . 21.4 mm-40 -55.75 -31.29 62.42 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.157 -0.964 . . . . 2.1899999999999999 109.995 -179.195 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 350' ' ' LEU . . . . . 1.029 ' CD1' HD13 ' D' ' 350' ' ' LEU . 0.3 OUTLIER -65.22 -49.24 70.46 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.126 -0.984 . . . . 0.46000000000000002 109.342 -179.91 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' C' C ' 351' ' ' LYS . . . . . 0.861 ' N ' HD13 ' C' ' 350' ' ' LEU . 9.6 tttt -61.4 -44.19 97.57 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.322 -0.861 . . . . 1.3500000000000001 109.744 179.696 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' C' C ' 352' ' ' ASP . . . . . . . . . . . . . 77.8 m-20 -55.98 -31.48 63.06 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.47 -0.769 . . . . 1.1899999999999999 110.182 -179.53 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 353' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 1.493 0 O-C-N 121.066 -1.021 . . . . 0.56999999999999995 109.441 -179.676 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' D' D ' 326' ' ' GLU . . . . . 0.46 ' HB3' ' CE2' ' D' ' 328' ' ' PHE . 48.1 mm-40 . . . . . 0 N--CA 1.487 1.399 0 N-CA-C 109.123 -0.695 . . . . 2.1299999999999999 109.123 . . . . . . . . . 1 1 . 1 . 003 nuclear build core ' D' D ' 327' ' ' TYR . . . . . 0.598 ' CE1' ' HG2' ' B' ' 333' ' ' ARG . 41.8 m-85 -149.16 106.21 3.59 Favored 'General case' 0 C--N 1.302 -1.467 0 O-C-N 121.203 -0.935 . . . . 0.46999999999999997 109.385 179.814 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' D' D ' 328' ' ' PHE . . . . . 0.492 ' CE2' ' HA ' ' B' ' 335' ' ' ARG . 87.8 m-85 -113.09 -166.39 1.08 Allowed 'General case' 0 N--CA 1.488 1.456 0 O-C-N 121.298 -0.876 . . . . 0.29999999999999999 109.623 -179.557 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' D' D ' 329' ' ' THR . . . . . . . . . . . . . 35.2 p -153.51 160.32 42.48 Favored 'General case' 0 N--CA 1.488 1.464 0 O-C-N 121.345 -0.847 . . . . 0.22 109.012 -179.544 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' D' D ' 330' ' ' LEU . . . . . . . . . . . . . 23.4 tp -151.05 129.6 12.2 Favored 'General case' 0 N--CA 1.488 1.475 0 O-C-N 121.152 -0.968 . . . . 0.28000000000000003 109.639 -179.677 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' D' D ' 331' ' ' GLN . . . . . . . . . . . . . 1.3 tt0 -88.44 114.54 25.16 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.367 -0.833 . . . . 0.93000000000000005 109.271 179.865 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' D' D ' 332' ' ' ILE . . . . . 0.478 HD12 ' CD1' ' D' ' 338' ' ' PHE . 38.5 mt -103.52 111.7 34.24 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.447 0 O-C-N 121.094 -1.004 . . . . 0.25 109.849 -179.604 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' D' D ' 333' ' ' ARG . . . . . 0.622 ' CG ' ' CE1' ' B' ' 327' ' ' TYR . 0.0 OUTLIER -73.11 148.9 43.52 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.291 -0.88 . . . . 2.9300000000000002 109.527 179.803 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' D' D ' 334' ' ' GLY . . . . . . . . . . . . . . . 84.97 131.94 2.48 Favored Glycine 0 N--CA 1.492 2.37 0 N-CA-C 109.567 -1.413 . . . . 0.40999999999999998 109.567 179.988 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' D' D ' 335' ' ' ARG . . . . . 0.53 ' HA ' ' CE2' ' B' ' 328' ' ' PHE . 39.7 ttt180 -78.75 -40.66 32.78 Favored 'General case' 0 N--CA 1.49 1.525 0 O-C-N 121.158 -1.201 . . . . 3.0299999999999998 109.558 -179.821 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' D' D ' 336' ' ' GLU . . . . . . . . . . . . . 3.7 pt-20 -58.18 -53.28 60.02 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.173 -0.955 . . . . 2.2599999999999998 110.001 -179.566 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' D' D ' 337' ' ' ARG . . . . . . . . . . . . . 12.9 mmt180 -61.79 -35.98 79.76 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.182 -0.949 . . . . 2.9199999999999999 109.795 -179.719 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' D' D ' 338' ' ' PHE . . . . . 0.478 ' CD1' HD12 ' D' ' 332' ' ' ILE . 80.5 t80 -54.73 -56.66 16.9 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.145 -0.972 . . . . 0.37 110.054 -179.65 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' D' D ' 339' ' ' GLU . . . . . . . . . . . . . 43.4 mt-10 -52.26 -35.9 51.19 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.214 -0.929 . . . . 1.99 110.337 -179.565 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' D' D ' 340' ' ' MET . . . . . . . . . . . . . 46.9 ttp -62.97 -48.03 80.62 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 120.989 -1.069 . . . . 0.31 109.83 -179.454 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' D' D ' 341' ' ' PHE . . . . . . . . . . . . . 44.5 m-85 -62.83 -47.9 81.39 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.207 -0.933 . . . . 0.17999999999999999 109.859 -179.752 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' D' D ' 342' ' ' ARG . . . . . . . . . . . . . 16.7 ttt180 -48.98 -42.26 37.05 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.374 -0.829 . . . . 2.4100000000000001 110.104 -179.544 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' D' D ' 343' ' ' GLU . . . . . . . . . . . . . 4.2 tp10 -59.12 -48.95 79.73 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.037 -1.039 . . . . 2.3500000000000001 109.845 -179.692 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' D' D ' 344' ' ' LEU . . . . . 0.464 HD22 ' CD2' ' C' ' 344' ' ' LEU . 39.0 mt -60.95 -33.03 72.56 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.097 -1.002 . . . . 0.19 109.741 -179.68 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' D' D ' 345' ' ' ASN . . . . . 0.597 ' C ' HD21 ' D' ' 345' ' ' ASN . 0.3 OUTLIER -56.2 -54.6 43.31 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.223 -0.923 . . . . 1.0900000000000001 109.739 -179.928 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' D' D ' 346' ' ' GLU . . . . . . . . . . . . . 6.6 tp10 -62.46 -27.48 69.15 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.124 -0.985 . . . . 1.6899999999999999 110.101 -179.589 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' D' D ' 347' ' ' ALA . . . . . 0.652 ' HB1' ' HB1' ' C' ' 347' ' ' ALA . . . -62.16 -58.48 7.63 Favored 'General case' 0 N--CA 1.493 1.725 0 O-C-N 121.051 -1.03 . . . . 0.17999999999999999 110.221 -179.573 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' D' D ' 348' ' ' LEU . . . . . 0.582 HD22 ' N ' ' D' ' 348' ' ' LEU . 3.8 mm? -60.8 -48.81 80.09 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.26 -0.9 . . . . 0.31 110.017 -179.321 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' D' D ' 349' ' ' GLU . . . . . . . . . . . . . 43.4 mt-10 -56.83 -33.31 66.62 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.073 -1.017 . . . . 1.95 109.594 -179.591 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' D' D ' 350' ' ' LEU . . . . . 1.029 HD13 ' CD1' ' C' ' 350' ' ' LEU . 4.2 tt -64.16 -44.4 92.21 Favored 'General case' 0 N--CA 1.489 1.479 0 O-C-N 121.374 -0.829 . . . . 0.42999999999999999 109.243 179.968 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' D' D ' 351' ' ' LYS . . . . . . . . . . . . . 10.1 tttp -61.51 -44.78 96.45 Favored 'General case' 0 N--CA 1.489 1.486 0 O-C-N 121.393 -0.817 . . . . 1.3999999999999999 109.677 -179.943 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' D' D ' 352' ' ' ASP . . . . . . . . . . . . . 6.0 m-20 -55.96 -37.1 68.57 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.352 -0.842 . . . . 1.1699999999999999 109.701 -179.795 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' D' D ' 353' ' ' ALA . . . . . . . . . . . . . . . -66.44 -30.51 70.88 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.278 -0.889 . . . . 0.58999999999999997 109.722 -179.767 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' D' D ' 354' ' ' GLN . . . . . . . . . . . . . 2.5 tt0 . . . . . 0 N--CA 1.49 1.526 0 O-C-N 121.269 -0.894 . . . . 1.4399999999999999 109.603 -179.947 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 326' ' ' GLU . . . . . . . . . . . . . 3.5 mt-10 . . . . . 0 N--CA 1.489 1.518 0 CA-C-O 121.427 0.632 . . . . 2.1299999999999999 109.716 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 327' ' ' TYR . . . . . 0.611 ' CE1' ' HG2' ' C' ' 333' ' ' ARG . 39.1 m-85 -149.44 109.66 4.16 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.471 -0.768 . . . . 0.47999999999999998 109.613 -179.877 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 328' ' ' PHE . . . . . 0.45 ' O ' ' OE1' ' C' ' 331' ' ' GLN . 81.2 m-85 -113.01 -166.6 1.09 Allowed 'General case' 0 N--CA 1.489 1.487 0 O-C-N 121.439 -0.788 . . . . 0.31 109.293 179.658 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 329' ' ' THR . . . . . 0.441 ' HA ' ' O ' ' C' ' 330' ' ' LEU . 15.2 p -153.77 167.14 30.63 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.305 -0.872 . . . . 0.22 109.216 179.985 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 330' ' ' LEU . . . . . 0.423 HD11 HD22 ' C' ' 345' ' ' ASN . 15.1 tp -152.79 131.55 12.39 Favored 'General case' 0 C--N 1.303 -1.415 0 O-C-N 121.278 -0.889 . . . . 0.28000000000000003 109.876 -179.698 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 331' ' ' GLN . . . . . 0.406 ' O ' ' NH2' ' A' ' 333' ' ' ARG . 1.5 tt0 -86.4 117.42 25.19 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.29 -0.881 . . . . 0.91000000000000003 108.87 179.635 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 332' ' ' ILE . . . . . 0.586 HG21 ' HA ' ' A' ' 338' ' ' PHE . 61.1 mt -102.91 103.55 15.24 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.526 0 O-C-N 121.042 -1.036 . . . . 0.26000000000000001 109.725 -179.796 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 333' ' ' ARG . . . . . 0.469 ' CG ' HH11 ' A' ' 333' ' ' ARG . 0.0 OUTLIER -69.96 145.86 51.56 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.372 -0.83 . . . . 2.9199999999999999 109.123 179.659 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 334' ' ' GLY . . . . . . . . . . . . . . . 82.5 126.86 1.02 Allowed Glycine 0 N--CA 1.492 2.421 0 N-CA-C 109.654 -1.378 . . . . 0.40000000000000002 109.654 -179.801 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 335' ' ' ARG . . . . . 0.462 ' O ' ' HB3' ' A' ' 338' ' ' PHE . 10.2 ttm180 -74.6 -38.5 62.59 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.387 -1.066 . . . . 3.0099999999999998 109.334 179.881 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 336' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -55.54 -54.94 37.73 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.416 -0.802 . . . . 2.29 109.792 -179.555 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 337' ' ' ARG . . . . . . . . . . . . . 17.8 mtp180 -62.81 -28.65 70.15 Favored 'General case' 0 N--CA 1.496 1.835 0 O-C-N 121.381 -0.824 . . . . 2.9300000000000002 109.87 179.803 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 338' ' ' PHE . . . . . 0.586 ' HA ' HG21 ' A' ' 332' ' ' ILE . 77.9 t80 -55.05 -61.5 2.27 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.035 -1.04 . . . . 0.38 109.833 -179.453 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 339' ' ' GLU . . . . . . . . . . . . . 43.1 mt-10 -50.58 -31.75 16.69 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 120.935 -1.103 . . . . 1.97 109.769 -179.748 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 340' ' ' MET . . . . . . . . . . . . . 27.2 ttp -63.8 -55.06 25.82 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 120.991 -1.068 . . . . 0.31 110.153 -179.519 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 341' ' ' PHE . . . . . . . . . . . . . 43.5 m-85 -61.37 -53.72 53.03 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.346 -0.846 . . . . 0.17999999999999999 109.647 -179.502 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 342' ' ' ARG . . . . . . . . . . . . . 5.4 ttp180 -44.52 -40.57 5.75 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.466 -0.771 . . . . 2.4199999999999999 109.596 -179.866 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 343' ' ' GLU . . . . . . . . . . . . . 21.6 tt0 -58.68 -46.69 86.66 Favored 'General case' 0 N--CA 1.489 1.5 0 O-C-N 121.18 -0.95 . . . . 2.3500000000000001 109.866 -179.689 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 344' ' ' LEU . . . . . 0.616 HD22 ' CD2' ' B' ' 344' ' ' LEU . 49.3 mt -63.36 -45.16 92.46 Favored 'General case' 0 C--N 1.3 -1.552 0 O-C-N 121.269 -0.895 . . . . 0.17999999999999999 109.988 -179.628 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 345' ' ' ASN . . . . . . . . . . . . . 34.5 t-20 -53.02 -48.93 67.18 Favored 'General case' 0 C--N 1.302 -1.478 0 O-C-N 121.247 -0.908 . . . . 1.0900000000000001 109.595 -179.613 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 346' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -59.61 -36.34 76.12 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.178 -0.951 . . . . 1.6499999999999999 109.514 -179.922 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 347' ' ' ALA . . . . . 0.837 ' HB1' ' HB1' ' B' ' 347' ' ' ALA . . . -61.05 -49.44 77.35 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.239 -0.913 . . . . 0.17999999999999999 109.854 -179.924 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 348' ' ' LEU . . . . . 0.518 HD22 ' N ' ' A' ' 348' ' ' LEU . 4.0 mm? -61.84 -41.6 98.0 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 120.949 -1.094 . . . . 0.29999999999999999 109.739 -179.729 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 349' ' ' GLU . . . . . . . . . . . . . 61.5 mt-10 -58.06 -41.02 82.47 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.231 -0.918 . . . . 1.9399999999999999 110.117 -179.441 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 350' ' ' LEU . . . . . 0.621 HD22 HD13 ' B' ' 350' ' ' LEU . 7.7 tt -62.9 -41.43 99.44 Favored 'General case' 0 N--CA 1.488 1.461 0 O-C-N 121.109 -0.995 . . . . 0.46000000000000002 109.86 -179.52 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 351' ' ' LYS . . . . . . . . . . . . . 10.5 tttt -58.04 -46.7 84.91 Favored 'General case' 0 N--CA 1.494 1.751 0 O-C-N 121.0 -1.063 . . . . 1.3999999999999999 109.387 -179.741 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 352' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -55.8 -51.88 65.91 Favored 'General case' 0 N--CA 1.487 1.389 0 O-C-N 121.481 -0.762 . . . . 1.1599999999999999 109.778 -179.951 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 353' ' ' ALA . . . . . . . . . . . . . . . -68.65 -14.76 63.23 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 120.964 -1.085 . . . . 0.63 109.574 -179.829 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 354' ' ' GLN . . . . . . . . . . . . . 2.4 tt0 . . . . . 0 N--CA 1.492 1.63 0 O-C-N 121.279 -0.888 . . . . 1.47 109.611 -179.893 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' B' B ' 326' ' ' GLU . . . . . . . . . . . . . 3.4 mt-10 . . . . . 0 N--CA 1.492 1.639 0 CA-C-O 121.367 0.603 . . . . 2.1299999999999999 109.391 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' B' B ' 327' ' ' TYR . . . . . 0.455 ' CE1' ' HG2' ' D' ' 333' ' ' ARG . 41.1 m-85 -150.35 109.72 3.98 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.444 -0.785 . . . . 0.47999999999999998 109.556 179.902 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 328' ' ' PHE . . . . . 0.402 ' O ' HG23 ' B' ' 329' ' ' THR . 91.1 m-85 -113.41 -167.05 1.14 Allowed 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.363 -0.835 . . . . 0.32000000000000001 109.399 179.999 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 329' ' ' THR . . . . . 0.446 ' HA ' ' O ' ' D' ' 330' ' ' LEU . 18.0 p -153.53 165.64 35.24 Favored 'General case' 0 N--CA 1.487 1.41 0 O-C-N 121.122 -0.987 . . . . 0.23000000000000001 109.351 179.836 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 330' ' ' LEU . . . . . 0.416 HD11 HD22 ' D' ' 345' ' ' ASN . 14.9 tp -151.19 132.8 14.83 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.206 -0.934 . . . . 0.28000000000000003 110.102 -179.685 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 331' ' ' GLN . . . . . . . . . . . . . 1.4 tt0 -87.06 117.95 26.13 Favored 'General case' 0 C--N 1.301 -1.528 0 O-C-N 121.296 -0.877 . . . . 0.91000000000000003 109.067 179.496 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 332' ' ' ILE . . . . . 0.601 HG21 ' HA ' ' B' ' 338' ' ' PHE . 56.4 mt -103.02 104.89 17.29 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.5 0 O-C-N 121.14 -0.975 . . . . 0.23999999999999999 109.664 179.813 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 333' ' ' ARG . . . . . 0.472 HH11 ' CG ' ' B' ' 333' ' ' ARG . 0.0 OUTLIER -70.76 145.44 50.43 Favored 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.385 -0.822 . . . . 2.9300000000000002 108.927 179.602 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' B' B ' 334' ' ' GLY . . . . . . . . . . . . . . . 81.62 131.18 1.27 Allowed Glycine 0 N--CA 1.491 2.303 0 N-CA-C 109.264 -1.534 . . . . 0.40000000000000002 109.264 -179.685 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 335' ' ' ARG . . . . . 0.47 ' O ' ' HB3' ' B' ' 338' ' ' PHE . 9.9 ttm180 -77.5 -38.14 49.62 Favored 'General case' 0 N--CA 1.489 1.48 0 O-C-N 121.283 -1.128 . . . . 3.0099999999999998 109.472 -179.931 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 336' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -56.38 -54.48 45.11 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.362 -0.837 . . . . 2.2799999999999998 109.382 -179.924 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 337' ' ' ARG . . . . . . . . . . . . . 18.6 mtp180 -62.19 -28.49 69.71 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.189 -0.944 . . . . 2.9300000000000002 109.944 -179.987 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 338' ' ' PHE . . . . . 0.601 ' HA ' HG21 ' B' ' 332' ' ' ILE . 80.2 t80 -55.85 -61.18 2.54 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 120.985 -1.072 . . . . 0.37 109.848 -179.617 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 339' ' ' GLU . . . . . . . . . . . . . 35.8 mt-10 -50.44 -32.84 18.96 Favored 'General case' 0 N--CA 1.494 1.77 0 O-C-N 121.241 -0.912 . . . . 1.98 109.846 -179.6 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 340' ' ' MET . . . . . . . . . . . . . 27.0 ttp -63.08 -54.42 38.33 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.265 -0.897 . . . . 0.32000000000000001 109.921 -179.725 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 341' ' ' PHE . . . . . 0.416 ' O ' ' C ' ' B' ' 342' ' ' ARG . 45.0 m-85 -62.28 -54.06 46.1 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.464 -0.772 . . . . 0.17999999999999999 109.826 -179.721 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 342' ' ' ARG . . . . . 0.416 ' C ' ' O ' ' B' ' 341' ' ' PHE . 4.4 ttp180 -45.0 -39.14 5.31 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 120.926 -1.108 . . . . 2.4199999999999999 109.768 -179.954 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 343' ' ' GLU . . . . . . . . . . . . . 20.1 tt0 -58.68 -47.6 83.94 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.111 -0.993 . . . . 2.3500000000000001 109.568 -179.911 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 344' ' ' LEU . . . . . 0.616 ' CD2' HD22 ' A' ' 344' ' ' LEU . 48.0 mt -63.27 -45.25 92.33 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.047 -1.033 . . . . 0.17999999999999999 110.244 -179.628 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 345' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -52.79 -48.12 67.09 Favored 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.28 -0.887 . . . . 1.0900000000000001 109.666 -179.316 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 346' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -60.48 -35.64 76.39 Favored 'General case' 0 N--CA 1.488 1.447 0 O-C-N 121.021 -1.049 . . . . 1.6599999999999999 109.465 179.882 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 347' ' ' ALA . . . . . 0.837 ' HB1' ' HB1' ' A' ' 347' ' ' ALA . . . -61.72 -48.88 78.75 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.145 -0.972 . . . . 0.17000000000000001 110.406 -179.732 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 348' ' ' LEU . . . . . 0.543 HD22 ' N ' ' B' ' 348' ' ' LEU . 3.8 mm? -63.0 -40.85 99.0 Favored 'General case' 0 N--CA 1.495 1.818 0 O-C-N 121.263 -0.898 . . . . 0.28999999999999998 109.661 -179.647 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 349' ' ' GLU . . . . . . . . . . . . . 64.5 mt-10 -58.32 -41.54 84.79 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.264 -0.898 . . . . 1.95 110.254 -179.863 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 350' ' ' LEU . . . . . 0.621 HD13 HD22 ' A' ' 350' ' ' LEU . 8.6 tt -61.93 -41.65 98.2 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.067 -1.021 . . . . 0.45000000000000001 109.969 -179.428 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 351' ' ' LYS . . . . . . . . . . . . . 10.9 tttt -57.9 -47.02 84.03 Favored 'General case' 0 C--N 1.3 -1.577 0 O-C-N 121.084 -1.01 . . . . 1.3799999999999999 109.425 179.952 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 352' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -55.28 -50.62 69.06 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 120.917 -1.114 . . . . 1.1599999999999999 109.835 -179.9 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 353' ' ' ALA . . . . . . . . . . . . . . . -69.26 -16.0 63.49 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 121.284 -0.885 . . . . 0.60999999999999999 109.667 -179.853 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 354' ' ' GLN . . . . . . . . . . . . . 3.2 tt0 . . . . . 0 N--CA 1.492 1.674 0 O-C-N 121.263 -0.898 . . . . 1.45 109.892 -179.808 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' C' C ' 326' ' ' GLU . . . . . . . . . . . . . 8.0 mm-40 . . . . . 0 N--CA 1.486 1.327 0 N-CA-C 108.938 -0.764 . . . . 2.1699999999999999 108.938 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' C' C ' 327' ' ' TYR . . . . . . . . . . . . . 47.9 m-85 -149.78 109.46 4.04 Favored 'General case' 0 C--N 1.3 -1.561 0 O-C-N 121.014 -1.054 . . . . 0.47999999999999998 110.139 -179.804 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 328' ' ' PHE . . . . . 0.407 ' CZ ' ' HG3' ' A' ' 335' ' ' ARG . 77.4 m-85 -110.72 -167.79 1.23 Allowed 'General case' 0 N--CA 1.491 1.59 0 N-CA-C 108.886 -0.783 . . . . 0.33000000000000002 108.886 179.742 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' C' C ' 329' ' ' THR . . . . . 0.402 HG23 ' O ' ' C' ' 328' ' ' PHE . 6.4 p -151.77 160.12 43.69 Favored 'General case' 0 C--N 1.302 -1.486 0 O-C-N 121.052 -1.03 . . . . 0.23000000000000001 109.312 -179.779 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' C' C ' 330' ' ' LEU . . . . . 0.441 ' O ' ' HA ' ' A' ' 329' ' ' THR . 21.8 tp -149.32 126.87 11.61 Favored 'General case' 0 N--CA 1.494 1.771 0 O-C-N 121.083 -1.01 . . . . 0.28000000000000003 109.833 -179.674 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' C' C ' 331' ' ' GLN . . . . . 0.45 ' OE1' ' O ' ' A' ' 328' ' ' PHE . 0.7 OUTLIER -87.14 120.99 28.99 Favored 'General case' 0 N--CA 1.496 1.851 0 O-C-N 121.437 -0.79 . . . . 1.48 109.578 179.904 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' C' C ' 332' ' ' ILE . . . . . 0.493 HD12 ' CD1' ' C' ' 338' ' ' PHE . 15.2 mt -103.88 111.1 32.25 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.854 0 O-C-N 121.023 -1.048 . . . . 0.23999999999999999 109.843 179.762 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' C' C ' 333' ' ' ARG . . . . . 0.611 ' HG2' ' CE1' ' A' ' 327' ' ' TYR . 4.4 mtp180 -72.06 137.66 47.29 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.351 -0.843 . . . . 2.7400000000000002 109.332 179.709 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' C' C ' 334' ' ' GLY . . . . . . . . . . . . . . . 90.94 137.0 7.01 Favored Glycine 0 N--CA 1.491 2.303 0 N-CA-C 109.82 -1.312 . . . . 0.34999999999999998 109.82 179.709 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 335' ' ' ARG . . . . . 0.409 ' HA ' ' CE1' ' A' ' 328' ' ' PHE . 3.1 ttt180 -80.09 -38.9 30.76 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.272 -1.134 . . . . 2.5299999999999998 109.31 179.929 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' C' C ' 336' ' ' GLU . . . . . 0.418 ' HA ' ' OE1' ' C' ' 339' ' ' GLU . 1.7 tm-20 -58.91 -52.8 64.18 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.569 -0.707 . . . . 2.6200000000000001 109.391 179.992 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' C' C ' 337' ' ' ARG . . . . . . . . . . . . . 34.9 mtp180 -60.91 -34.66 75.02 Favored 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.33 -0.856 . . . . 2.8100000000000001 109.324 179.975 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 338' ' ' PHE . . . . . 0.493 ' CD1' HD12 ' C' ' 332' ' ' ILE . 57.5 t80 -53.57 -65.21 0.6 Allowed 'General case' 0 N--CA 1.487 1.403 0 O-C-N 121.264 -0.898 . . . . 0.40000000000000002 109.745 -179.735 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' C' C ' 339' ' ' GLU . . . . . 0.418 ' OE1' ' HA ' ' C' ' 336' ' ' GLU . 3.2 mp0 -47.13 -34.84 6.46 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.249 -0.907 . . . . 2.0499999999999998 110.375 -179.217 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' C' C ' 340' ' ' MET . . . . . . . . . . . . . 15.2 ttp -63.92 -53.4 50.98 Favored 'General case' 0 C--N 1.301 -1.51 0 O-C-N 120.841 -1.162 . . . . 0.32000000000000001 110.034 -179.208 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 341' ' ' PHE . . . . . 0.441 ' HB2' HD13 ' C' ' 332' ' ' ILE . 40.6 m-85 -61.29 -44.92 96.42 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.032 -1.043 . . . . 0.17999999999999999 109.614 -179.581 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' C' C ' 342' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -50.5 -45.52 56.51 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.213 -0.929 . . . . 2.9100000000000001 110.41 -179.699 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' C' C ' 343' ' ' GLU . . . . . . . . . . . . . 5.1 tt0 -57.34 -43.58 83.52 Favored 'General case' 0 N--CA 1.489 1.497 0 O-C-N 121.331 -0.856 . . . . 2.1400000000000001 109.786 -179.431 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 344' ' ' LEU . . . . . 0.437 HD22 HD22 ' D' ' 344' ' ' LEU . 41.3 mt -62.64 -46.93 85.95 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.192 -0.942 . . . . 0.22 109.779 179.945 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' C' C ' 345' ' ' ASN . . . . . 0.423 HD22 HD11 ' A' ' 330' ' ' LEU . 31.2 t-20 -55.22 -49.48 71.87 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.287 -0.883 . . . . 1.0800000000000001 109.896 -179.499 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' C' C ' 346' ' ' GLU . . . . . . . . . . . . . 13.6 tp10 -58.18 -35.95 72.35 Favored 'General case' 0 N--CA 1.489 1.5 0 O-C-N 121.098 -1.001 . . . . 2.21 109.713 -179.556 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 347' ' ' ALA . . . . . 0.809 ' HB1' ' HB1' ' D' ' 347' ' ' ALA . . . -61.49 -47.0 87.61 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.03 -1.044 . . . . 0.17999999999999999 109.802 -179.931 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' C' C ' 348' ' ' LEU . . . . . 0.496 ' N ' HD22 ' C' ' 348' ' ' LEU . 4.2 mm? -62.83 -48.44 79.08 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.104 -0.998 . . . . 0.32000000000000001 110.401 -179.552 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' C' C ' 349' ' ' GLU . . . . . . . . . . . . . 33.4 mt-10 -57.7 -36.53 72.1 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.151 -0.968 . . . . 2.1899999999999999 109.878 -179.176 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 350' ' ' LEU . . . . . 0.597 ' CD2' HD22 ' D' ' 350' ' ' LEU . 3.9 tt -62.05 -40.07 94.53 Favored 'General case' 0 N--CA 1.489 1.482 0 O-C-N 121.312 -0.867 . . . . 0.46000000000000002 109.424 -179.87 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' C' C ' 351' ' ' LYS . . . . . . . . . . . . . 12.3 tttt -58.72 -37.83 77.0 Favored 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.147 -0.97 . . . . 1.3500000000000001 109.084 -179.929 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 352' ' ' ASP . . . . . . . . . . . . . 49.0 m-20 -55.1 -54.97 36.41 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.29 -0.881 . . . . 1.1899999999999999 109.556 179.519 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 353' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 1.566 0 O-C-N 121.351 -0.843 . . . . 0.56999999999999995 109.544 -179.85 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' D' D ' 326' ' ' GLU . . . . . . . . . . . . . 3.4 mt-10 . . . . . 0 N--CA 1.489 1.491 0 CA-C-O 121.331 0.586 . . . . 2.1299999999999999 109.723 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' D' D ' 327' ' ' TYR . . . . . . . . . . . . . 40.5 m-85 -149.39 109.88 4.22 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.277 -0.89 . . . . 0.46999999999999997 109.541 -179.695 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' D' D ' 328' ' ' PHE . . . . . 0.442 ' O ' HG23 ' D' ' 329' ' ' THR . 94.9 m-85 -113.29 -166.83 1.12 Allowed 'General case' 0 N--CA 1.488 1.469 0 O-C-N 121.213 -0.929 . . . . 0.29999999999999999 109.38 179.986 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' D' D ' 329' ' ' THR . . . . . 0.442 HG23 ' O ' ' D' ' 328' ' ' PHE . 19.1 p -154.1 165.05 37.44 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.248 -0.907 . . . . 0.22 109.517 179.875 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' D' D ' 330' ' ' LEU . . . . . 0.446 ' O ' ' HA ' ' B' ' 329' ' ' THR . 14.7 tp -150.69 132.56 15.08 Favored 'General case' 0 N--CA 1.487 1.413 0 O-C-N 121.029 -1.044 . . . . 0.28000000000000003 109.997 -179.463 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' D' D ' 331' ' ' GLN . . . . . . . . . . . . . 1.3 tt0 -86.21 117.14 24.84 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.234 -0.916 . . . . 0.93000000000000005 108.576 179.402 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' D' D ' 332' ' ' ILE . . . . . 0.619 HG21 ' HA ' ' D' ' 338' ' ' PHE . 63.7 mt -102.65 104.2 16.17 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.618 0 O-C-N 121.162 -0.961 . . . . 0.25 109.584 -179.923 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' D' D ' 333' ' ' ARG . . . . . 0.457 HH11 ' CG ' ' D' ' 333' ' ' ARG . 0.0 OUTLIER -70.19 146.49 50.71 Favored 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.422 -0.799 . . . . 2.9300000000000002 109.477 179.869 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' D' D ' 334' ' ' GLY . . . . . . . . . . . . . . . 80.33 130.93 0.94 Allowed Glycine 0 N--CA 1.491 2.363 0 N-CA-C 109.533 -1.427 . . . . 0.40999999999999998 109.533 -179.77 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' D' D ' 335' ' ' ARG . . . . . 0.477 ' O ' ' HB3' ' D' ' 338' ' ' PHE . 9.8 ttm180 -77.66 -36.33 51.47 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.104 -1.233 . . . . 3.0299999999999998 109.572 -179.753 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' D' D ' 336' ' ' GLU . . . . . . . . . . . . . 1.1 tt0 -57.12 -55.31 36.36 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.369 -0.832 . . . . 2.2599999999999998 109.358 -179.759 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' D' D ' 337' ' ' ARG . . . . . . . . . . . . . 18.1 mtp180 -61.48 -28.38 69.25 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.356 -0.84 . . . . 2.9199999999999999 109.695 -179.932 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' D' D ' 338' ' ' PHE . . . . . 0.619 ' HA ' HG21 ' D' ' 332' ' ' ILE . 79.5 t80 -55.74 -61.76 2.14 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.21 -0.931 . . . . 0.37 109.83 -179.482 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' D' D ' 339' ' ' GLU . . . . . . . . . . . . . 45.1 mt-10 -50.66 -31.63 16.81 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.38 -0.825 . . . . 1.99 109.945 -179.655 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' D' D ' 340' ' ' MET . . . . . . . . . . . . . 29.3 ttp -64.64 -53.86 40.96 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.093 -1.004 . . . . 0.31 110.0 -179.482 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' D' D ' 341' ' ' PHE . . . . . . . . . . . . . 46.3 m-85 -62.57 -53.41 55.1 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.216 -0.928 . . . . 0.17999999999999999 109.549 -179.74 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' D' D ' 342' ' ' ARG . . . . . . . . . . . . . 4.0 ttp180 -45.08 -38.67 5.19 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.101 -0.999 . . . . 2.4100000000000001 109.904 -179.924 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' D' D ' 343' ' ' GLU . . . . . . . . . . . . . 20.9 tt0 -59.39 -47.65 84.62 Favored 'General case' 0 N--CA 1.49 1.525 0 O-C-N 121.12 -0.988 . . . . 2.3500000000000001 109.534 -179.978 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' D' D ' 344' ' ' LEU . . . . . 0.453 ' O ' HD23 ' D' ' 348' ' ' LEU . 44.9 mt -63.18 -45.37 92.08 Favored 'General case' 0 C--N 1.301 -1.51 0 O-C-N 121.193 -0.942 . . . . 0.19 110.037 -179.703 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' D' D ' 345' ' ' ASN . . . . . 0.416 HD22 HD11 ' B' ' 330' ' ' LEU . 33.9 t-20 -52.43 -49.03 65.36 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.22 -0.925 . . . . 1.0900000000000001 109.858 -179.349 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' D' D ' 346' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -60.07 -35.63 75.59 Favored 'General case' 0 N--CA 1.488 1.436 0 O-C-N 121.077 -1.014 . . . . 1.6899999999999999 109.453 -179.961 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' D' D ' 347' ' ' ALA . . . . . 0.809 ' HB1' ' HB1' ' C' ' 347' ' ' ALA . . . -61.42 -48.97 78.78 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.259 -0.901 . . . . 0.17999999999999999 110.215 -179.677 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' D' D ' 348' ' ' LEU . . . . . 0.57 HD22 ' N ' ' D' ' 348' ' ' LEU . 4.0 mm? -62.91 -40.66 98.25 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.147 -0.971 . . . . 0.31 109.663 -179.7 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' D' D ' 349' ' ' GLU . . . . . . . . . . . . . 59.6 mt-10 -59.05 -41.64 88.39 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.3 -0.875 . . . . 1.95 110.059 -179.309 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' D' D ' 350' ' ' LEU . . . . . 0.597 HD22 ' CD2' ' C' ' 350' ' ' LEU . 8.3 tt -61.76 -41.45 97.7 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.04 -1.037 . . . . 0.42999999999999999 109.791 -179.282 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' D' D ' 351' ' ' LYS . . . . . . . . . . . . . 13.3 tttt -57.56 -47.34 82.33 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.01 -1.056 . . . . 1.3999999999999999 109.301 -179.96 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' D' D ' 352' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -55.8 -51.45 67.4 Favored 'General case' 0 C--N 1.301 -1.505 0 O-C-N 121.393 -0.817 . . . . 1.1699999999999999 109.503 179.984 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' D' D ' 353' ' ' ALA . . . . . . . . . . . . . . . -68.77 -14.88 63.31 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.153 -0.967 . . . . 0.58999999999999997 109.616 -179.806 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' D' D ' 354' ' ' GLN . . . . . . . . . . . . . 3.1 tt0 . . . . . 0 N--CA 1.494 1.746 0 O-C-N 121.334 -0.854 . . . . 1.4399999999999999 109.955 -179.51 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 326' ' ' GLU . . . . . . . . . . . . . 6.2 mm-40 . . . . . 0 N--CA 1.49 1.554 0 CA-C-O 121.257 0.551 . . . . 2.1299999999999999 109.548 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 327' ' ' TYR . . . . . 0.607 ' CE1' ' HG2' ' C' ' 333' ' ' ARG . 49.1 m-85 -149.36 108.47 3.91 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.31 -0.869 . . . . 0.47999999999999998 109.315 179.98 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 328' ' ' PHE . . . . . 0.422 ' CZ ' ' HG3' ' C' ' 335' ' ' ARG . 98.0 m-85 -113.97 -167.54 1.22 Allowed 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.261 -0.9 . . . . 0.31 109.693 -179.902 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 329' ' ' THR . . . . . . . . . . . . . 41.5 p -152.83 165.13 36.39 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.398 -0.814 . . . . 0.22 108.967 179.91 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 330' ' ' LEU . . . . . . . . . . . . . 21.4 tp -151.55 129.59 11.83 Favored 'General case' 0 N--CA 1.489 1.497 0 O-C-N 121.067 -1.021 . . . . 0.28000000000000003 110.063 -179.519 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 331' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -88.28 116.32 26.4 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.28 -0.887 . . . . 0.91000000000000003 109.02 179.422 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 332' ' ' ILE . . . . . 0.593 HD12 ' CD1' ' A' ' 338' ' ' PHE . 36.1 mt -103.71 108.64 25.0 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.641 0 O-C-N 121.107 -0.996 . . . . 0.26000000000000001 110.082 -179.588 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 333' ' ' ARG . . . . . 0.452 ' HG2' ' CE1' ' C' ' 327' ' ' TYR . 0.1 OUTLIER -73.41 144.84 46.22 Favored 'General case' 0 N--CA 1.489 1.483 0 O-C-N 121.284 -0.885 . . . . 2.9199999999999999 109.152 179.417 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 334' ' ' GLY . . . . . 0.489 ' CA ' ' HB2' ' C' ' 326' ' ' GLU . . . 82.37 128.01 1.1 Allowed Glycine 0 N--CA 1.492 2.385 0 N-CA-C 109.534 -1.426 . . . . 0.40000000000000002 109.534 -179.853 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 335' ' ' ARG . . . . . . . . . . . . . 40.3 ttp180 -79.92 -30.48 40.04 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.269 -1.136 . . . . 3.0099999999999998 110.019 -179.717 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 336' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -55.41 -68.29 0.21 Allowed 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.199 -0.938 . . . . 2.29 109.967 -179.537 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 337' ' ' ARG . . . . . . . . . . . . . 16.3 mmt180 -60.36 -28.05 67.88 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.182 -0.949 . . . . 2.9300000000000002 109.693 -179.72 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 338' ' ' PHE . . . . . 0.593 ' CD1' HD12 ' A' ' 332' ' ' ILE . 66.2 t80 -55.56 -56.35 21.31 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.141 -0.974 . . . . 0.38 109.749 -179.934 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 339' ' ' GLU . . . . . . . . . . . . . 20.2 mm-40 -51.37 -37.48 48.3 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.276 -0.89 . . . . 1.97 109.948 -179.774 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 340' ' ' MET . . . . . . . . . . . . . 33.6 ttp -64.36 -45.39 87.95 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.138 -0.977 . . . . 0.31 110.252 -179.545 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 341' ' ' PHE . . . . . . . . . . . . . 32.8 m-85 -63.04 -51.07 68.18 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.234 -0.917 . . . . 0.17999999999999999 110.313 -179.341 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 342' ' ' ARG . . . . . 0.549 ' HG2' ' NH1' ' A' ' 342' ' ' ARG . 4.5 ttt-85 -49.0 -46.2 43.53 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.187 -0.946 . . . . 2.4199999999999999 110.158 -179.295 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 343' ' ' GLU . . . . . . . . . . . . . 2.1 tt0 -58.44 -43.05 88.6 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.27 -0.894 . . . . 2.3500000000000001 110.046 -179.408 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 344' ' ' LEU . . . . . . . . . . . . . 40.3 mt -62.54 -38.41 89.9 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.111 -0.993 . . . . 0.17999999999999999 109.828 -179.745 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 345' ' ' ASN . . . . . . . . . . . . . 46.7 t-20 -56.88 -48.43 78.18 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.152 -0.967 . . . . 1.0900000000000001 109.648 -179.778 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 346' ' ' GLU . . . . . . . . . . . . . 2.9 tt0 -61.7 -33.65 74.39 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.274 -0.891 . . . . 1.6499999999999999 109.835 -179.776 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 347' ' ' ALA . . . . . 0.945 ' HB1' ' HB1' ' B' ' 347' ' ' ALA . . . -60.53 -53.76 53.59 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.204 -0.935 . . . . 0.17999999999999999 110.27 -179.601 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 348' ' ' LEU . . . . . 0.599 HD22 ' N ' ' A' ' 348' ' ' LEU . 4.1 mm? -61.51 -48.46 80.93 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.201 -0.937 . . . . 0.29999999999999999 110.166 -179.319 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 349' ' ' GLU . . . . . . . . . . . . . 64.9 mm-40 -57.86 -32.89 68.1 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.182 -0.949 . . . . 1.9399999999999999 110.126 -179.426 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 350' ' ' LEU . . . . . 0.562 HD23 ' C ' ' A' ' 350' ' ' LEU . 7.7 tt -64.39 -49.11 72.88 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.136 -0.978 . . . . 0.46000000000000002 109.821 -179.647 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 351' ' ' LYS . . . . . . . . . . . . . 68.0 tttt -59.01 -43.25 91.52 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.193 -0.942 . . . . 1.3999999999999999 109.781 -179.547 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 352' ' ' ASP . . . . . . . . . . . . . 66.7 m-20 -56.52 -50.91 70.45 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.11 -0.994 . . . . 1.1599999999999999 109.66 -179.79 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 353' ' ' ALA . . . . . . . . . . . . . . . -68.23 -14.11 62.74 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.308 -0.87 . . . . 0.63 109.803 -179.676 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 354' ' ' GLN . . . . . . . . . . . . . 61.3 tt0 . . . . . 0 N--CA 1.49 1.548 0 O-C-N 121.181 -0.949 . . . . 1.47 109.798 -179.857 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' B' B ' 326' ' ' GLU . . . . . . . . . . . . . 6.5 mm-40 . . . . . 0 N--CA 1.49 1.528 0 CA-C-O 121.285 0.564 . . . . 2.1299999999999999 109.536 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' B' B ' 327' ' ' TYR . . . . . 0.477 ' CE1' ' HG2' ' D' ' 333' ' ' ARG . 49.0 m-85 -149.33 108.69 3.96 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.264 -0.898 . . . . 0.47999999999999998 109.373 179.881 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 328' ' ' PHE . . . . . . . . . . . . . 98.0 m-85 -114.09 -167.32 1.2 Allowed 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.242 -0.911 . . . . 0.32000000000000001 109.73 -179.847 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 329' ' ' THR . . . . . . . . . . . . . 40.9 p -152.81 165.2 36.13 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.423 -0.798 . . . . 0.23000000000000001 109.041 179.876 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 330' ' ' LEU . . . . . . . . . . . . . 21.4 tp -151.81 129.66 11.68 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.038 -1.039 . . . . 0.28000000000000003 110.038 -179.647 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 331' ' ' GLN . . . . . . . . . . . . . 1.7 tp60 -88.42 116.32 26.56 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.397 -0.814 . . . . 0.91000000000000003 109.001 179.528 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 332' ' ' ILE . . . . . 0.607 HD12 ' CD1' ' B' ' 338' ' ' PHE . 35.4 mt -103.74 108.94 25.7 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.614 0 O-C-N 121.18 -0.95 . . . . 0.23999999999999999 109.988 -179.555 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 333' ' ' ARG . . . . . 0.551 ' HG2' ' CE1' ' D' ' 327' ' ' TYR . 0.1 OUTLIER -73.83 144.57 45.45 Favored 'General case' 0 N--CA 1.489 1.481 0 O-C-N 121.267 -0.896 . . . . 2.9300000000000002 109.043 179.359 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' B' B ' 334' ' ' GLY . . . . . . . . . . . . . . . 82.65 127.54 1.11 Allowed Glycine 0 N--CA 1.492 2.418 0 N-CA-C 109.491 -1.444 . . . . 0.40000000000000002 109.491 -179.821 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 335' ' ' ARG . . . . . . . . . . . . . 40.3 ttp180 -79.71 -30.32 40.94 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.333 -1.098 . . . . 3.0099999999999998 109.944 -179.654 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 336' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -55.6 -68.43 0.2 Allowed 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.128 -0.982 . . . . 2.2799999999999998 109.824 -179.533 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 337' ' ' ARG . . . . . . . . . . . . . 16.5 mmt180 -60.21 -27.88 67.54 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.192 -0.942 . . . . 2.9300000000000002 109.67 -179.614 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 338' ' ' PHE . . . . . 0.607 ' CD1' HD12 ' B' ' 332' ' ' ILE . 65.4 t80 -55.73 -56.39 21.06 Favored 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.298 -0.876 . . . . 0.37 109.672 -179.867 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 339' ' ' GLU . . . . . . . . . . . . . 21.2 mm-40 -51.42 -37.56 49.14 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.229 -0.919 . . . . 1.98 109.886 -179.77 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 340' ' ' MET . . . . . . . . . . . . . 33.6 ttp -64.25 -45.54 87.68 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.202 -0.936 . . . . 0.32000000000000001 110.171 -179.48 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 341' ' ' PHE . . . . . . . . . . . . . 32.6 m-85 -62.88 -50.85 69.26 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.202 -0.936 . . . . 0.17999999999999999 110.433 -179.331 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 342' ' ' ARG . . . . . 0.542 ' NH1' ' HG2' ' B' ' 342' ' ' ARG . 4.5 ttt-85 -49.25 -46.21 45.78 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.165 -0.959 . . . . 2.4199999999999999 110.164 -179.337 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 343' ' ' GLU . . . . . . . . . . . . . 2.0 tt0 -58.28 -43.03 87.83 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.061 -1.024 . . . . 2.3500000000000001 110.016 -179.475 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 344' ' ' LEU . . . . . . . . . . . . . 40.2 mt -62.71 -38.19 89.47 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.107 -0.995 . . . . 0.17999999999999999 109.922 -179.718 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 345' ' ' ASN . . . . . . . . . . . . . 47.0 t-20 -57.13 -48.3 79.0 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.211 -0.931 . . . . 1.0900000000000001 109.658 -179.825 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 346' ' ' GLU . . . . . . . . . . . . . 2.9 tt0 -61.66 -33.7 74.42 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.206 -0.934 . . . . 1.6599999999999999 109.812 -179.825 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 347' ' ' ALA . . . . . 0.945 ' HB1' ' HB1' ' A' ' 347' ' ' ALA . . . -60.56 -53.74 53.81 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.197 -0.939 . . . . 0.17000000000000001 110.188 -179.526 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 348' ' ' LEU . . . . . 0.594 HD22 ' N ' ' B' ' 348' ' ' LEU . 4.1 mm? -61.42 -48.59 80.49 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.221 -0.924 . . . . 0.28999999999999998 110.178 -179.287 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 349' ' ' GLU . . . . . . . . . . . . . 64.3 mm-40 -57.76 -32.91 67.94 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.188 -0.945 . . . . 1.95 110.105 -179.348 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 350' ' ' LEU . . . . . 0.566 HD23 ' C ' ' B' ' 350' ' ' LEU . 7.6 tt -64.44 -49.06 72.94 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.133 -0.979 . . . . 0.45000000000000001 109.853 -179.631 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 351' ' ' LYS . . . . . . . . . . . . . 67.3 tttt -59.06 -43.41 91.73 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.299 -0.876 . . . . 1.3799999999999999 109.77 -179.569 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 352' ' ' ASP . . . . . . . . . . . . . 66.7 m-20 -56.25 -50.99 69.75 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.147 -0.971 . . . . 1.1599999999999999 109.729 -179.902 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 353' ' ' ALA . . . . . . . . . . . . . . . -68.29 -13.98 62.66 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.217 -0.927 . . . . 0.60999999999999999 109.777 -179.621 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 354' ' ' GLN . . . . . . . . . . . . . 61.5 tt0 . . . . . 0 N--CA 1.49 1.557 0 O-C-N 121.17 -0.956 . . . . 1.45 109.775 -179.871 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' C' C ' 326' ' ' GLU . . . . . 0.489 ' HB2' ' CA ' ' A' ' 334' ' ' GLY . 6.5 mm-40 . . . . . 0 N--CA 1.489 1.516 0 N-CA-C 108.836 -0.802 . . . . 2.1699999999999999 108.836 . . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 327' ' ' TYR . . . . . 0.452 ' CE1' ' HG2' ' A' ' 333' ' ' ARG . 37.5 m-85 -149.09 102.94 3.29 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.042 -1.036 . . . . 0.47999999999999998 110.215 -179.583 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' C' C ' 328' ' ' PHE . . . . . 0.442 ' CE2' ' HB3' ' C' ' 326' ' ' GLU . 90.6 m-85 -112.98 -165.23 0.97 Allowed 'General case' 0 N--CA 1.489 1.478 0 O-C-N 121.48 -0.762 . . . . 0.33000000000000002 108.966 179.337 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' C' C ' 329' ' ' THR . . . . . 0.436 HG23 ' C ' ' C' ' 328' ' ' PHE . 54.6 p -155.48 156.45 35.27 Favored 'General case' 0 N--CA 1.489 1.492 0 O-C-N 121.085 -1.01 . . . . 0.23000000000000001 109.437 179.961 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' C' C ' 330' ' ' LEU . . . . . . . . . . . . . 18.1 tp -148.71 120.06 7.87 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.331 -0.856 . . . . 0.28000000000000003 109.596 -179.671 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 331' ' ' GLN . . . . . 0.45 ' OE1' ' HB3' ' A' ' 327' ' ' TYR . 0.1 OUTLIER -86.98 117.69 25.87 Favored 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.32 -0.863 . . . . 1.48 109.089 179.743 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' C' C ' 332' ' ' ILE . . . . . 0.417 HD12 ' CD1' ' C' ' 338' ' ' PHE . 18.8 mt -103.8 118.68 51.31 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.557 0 O-C-N 121.116 -0.99 . . . . 0.23999999999999999 109.972 -179.639 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' C' C ' 333' ' ' ARG . . . . . 0.607 ' HG2' ' CE1' ' A' ' 327' ' ' TYR . 4.1 mtp180 -73.25 143.38 47.1 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.384 -0.823 . . . . 2.7400000000000002 109.309 179.526 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' C' C ' 334' ' ' GLY . . . . . . . . . . . . . . . 86.22 130.78 2.73 Favored Glycine 0 N--CA 1.491 2.365 0 N-CA-C 109.694 -1.363 . . . . 0.34999999999999998 109.694 179.867 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 335' ' ' ARG . . . . . 0.448 ' O ' ' HB3' ' C' ' 338' ' ' PHE . 0.0 OUTLIER -80.25 -37.91 31.99 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.367 -1.078 . . . . 2.5299999999999998 109.81 -179.994 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' C' C ' 336' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -56.33 -59.0 5.59 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.222 -0.923 . . . . 2.6200000000000001 109.521 -179.83 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' C' C ' 337' ' ' ARG . . . . . 0.518 ' HD2' ' N ' ' C' ' 337' ' ' ARG . 18.6 mmm180 -60.95 -30.82 70.46 Favored 'General case' 0 N--CA 1.489 1.482 0 O-C-N 121.247 -0.908 . . . . 2.8100000000000001 109.241 179.836 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' C' C ' 338' ' ' PHE . . . . . 0.448 ' HB3' ' O ' ' C' ' 335' ' ' ARG . 91.7 t80 -55.03 -54.99 36.0 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.326 -0.859 . . . . 0.40000000000000002 109.554 179.991 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' C' C ' 339' ' ' GLU . . . . . . . . . . . . . 27.4 mt-10 -51.82 -32.81 33.14 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.313 -0.867 . . . . 2.0499999999999998 110.055 -179.787 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 340' ' ' MET . . . . . . . . . . . . . 3.3 ttt -63.66 -51.7 63.96 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.073 -1.017 . . . . 0.32000000000000001 110.067 -179.539 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 341' ' ' PHE . . . . . . . . . . . . . 65.1 m-85 -62.68 -46.48 87.96 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.161 -0.962 . . . . 0.17999999999999999 110.057 -179.506 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 342' ' ' ARG . . . . . 0.483 ' O ' ' HB3' ' C' ' 345' ' ' ASN . 14.6 ttm180 -49.81 -43.53 48.61 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.2 -0.937 . . . . 2.9100000000000001 109.965 -179.558 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' C' C ' 343' ' ' GLU . . . . . . . . . . . . . 1.3 tt0 -58.19 -48.53 80.02 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.04 -1.037 . . . . 2.1400000000000001 109.568 -179.685 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 344' ' ' LEU . . . . . . . . . . . . . 36.7 mt -61.82 -26.58 68.2 Favored 'General case' 0 N--CA 1.488 1.469 0 O-C-N 121.229 -0.919 . . . . 0.22 109.549 -179.977 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 345' ' ' ASN . . . . . 0.483 ' HB3' ' O ' ' C' ' 342' ' ' ARG . 24.0 t-20 -57.15 -62.52 1.7 Allowed 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.219 -0.926 . . . . 1.0800000000000001 109.659 -179.866 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' C' C ' 346' ' ' GLU . . . . . 0.454 ' O ' ' HB2' ' C' ' 350' ' ' LEU . 2.5 tt0 -62.04 -23.66 66.6 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.209 -0.932 . . . . 2.21 109.768 -179.692 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' C' C ' 347' ' ' ALA . . . . . 0.728 ' HB1' ' HB1' ' D' ' 347' ' ' ALA . . . -62.33 -57.04 12.81 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.194 -0.941 . . . . 0.17999999999999999 109.865 -179.84 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' C' C ' 348' ' ' LEU . . . . . 0.508 ' N ' ' CD2' ' C' ' 348' ' ' LEU . 3.6 mm? -61.58 -53.46 55.93 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.244 -0.91 . . . . 0.32000000000000001 110.032 -179.658 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' C' C ' 349' ' ' GLU . . . . . . . . . . . . . 1.5 mt-10 -56.38 -28.83 60.39 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.172 -0.955 . . . . 2.1899999999999999 109.692 -179.578 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 350' ' ' LEU . . . . . 0.699 ' CD2' HD13 ' D' ' 350' ' ' LEU . 10.3 tt -65.24 -48.78 72.11 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.341 -0.849 . . . . 0.46000000000000002 109.212 179.821 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' C' C ' 351' ' ' LYS . . . . . . . . . . . . . 31.1 tttm -58.26 -42.83 87.29 Favored 'General case' 0 N--CA 1.488 1.454 0 O-C-N 121.466 -0.771 . . . . 1.3500000000000001 109.579 -179.782 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 352' ' ' ASP . . . . . . . . . . . . . 5.2 m-20 -61.0 -43.05 99.46 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.288 -0.882 . . . . 1.1899999999999999 109.712 179.752 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 353' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.493 1.701 0 O-C-N 121.275 -0.891 . . . . 0.56999999999999995 109.855 -179.483 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' D' D ' 326' ' ' GLU . . . . . . . . . . . . . 6.6 mm-40 . . . . . 0 N--CA 1.49 1.531 0 N-CA-C 109.45 -0.574 . . . . 2.1299999999999999 109.45 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' D' D ' 327' ' ' TYR . . . . . 0.551 ' CE1' ' HG2' ' B' ' 333' ' ' ARG . 49.4 m-85 -149.25 108.81 3.99 Favored 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.295 -0.878 . . . . 0.46999999999999997 109.371 179.979 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' D' D ' 328' ' ' PHE . . . . . . . . . . . . . 97.9 m-85 -114.09 -167.15 1.17 Allowed 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.352 -0.842 . . . . 0.29999999999999999 109.687 -179.808 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' D' D ' 329' ' ' THR . . . . . . . . . . . . . 40.7 p -152.97 164.96 36.99 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.369 -0.832 . . . . 0.22 109.024 179.934 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' D' D ' 330' ' ' LEU . . . . . . . . . . . . . 21.3 tp -151.66 129.53 11.69 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.113 -0.992 . . . . 0.28000000000000003 110.016 -179.571 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' D' D ' 331' ' ' GLN . . . . . . . . . . . . . 1.7 tp60 -88.27 116.38 26.44 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.266 -0.896 . . . . 0.93000000000000005 108.97 179.506 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' D' D ' 332' ' ' ILE . . . . . 0.601 HD12 ' CD1' ' D' ' 338' ' ' PHE . 36.2 mt -103.81 109.02 25.91 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.57 0 O-C-N 121.023 -1.048 . . . . 0.25 110.071 -179.634 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' D' D ' 333' ' ' ARG . . . . . 0.477 ' HG2' ' CE1' ' B' ' 327' ' ' TYR . 0.1 OUTLIER -73.87 144.54 45.37 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.306 -0.871 . . . . 2.9300000000000002 109.142 179.442 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' D' D ' 334' ' ' GLY . . . . . . . . . . . . . . . 82.58 127.91 1.14 Allowed Glycine 0 N--CA 1.492 2.399 0 N-CA-C 109.417 -1.473 . . . . 0.40999999999999998 109.417 -179.841 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' D' D ' 335' ' ' ARG . . . . . . . . . . . . . 40.4 ttp180 -79.96 -30.29 39.8 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.239 -1.153 . . . . 3.0299999999999998 110.017 -179.722 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' D' D ' 336' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -55.48 -68.47 0.19 Allowed 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.126 -0.984 . . . . 2.2599999999999998 109.889 -179.568 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' D' D ' 337' ' ' ARG . . . . . . . . . . . . . 16.3 mmt180 -60.23 -27.9 67.57 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.24 -0.913 . . . . 2.9199999999999999 109.746 -179.787 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' D' D ' 338' ' ' PHE . . . . . 0.601 ' CD1' HD12 ' D' ' 332' ' ' ILE . 65.6 t80 -55.69 -56.41 20.81 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.174 -0.954 . . . . 0.37 109.638 -179.917 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' D' D ' 339' ' ' GLU . . . . . . . . . . . . . 21.7 mm-40 -51.45 -37.51 49.07 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.245 -0.909 . . . . 1.99 109.865 -179.764 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' D' D ' 340' ' ' MET . . . . . . . . . . . . . 33.6 ttp -64.21 -45.78 86.77 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.164 -0.96 . . . . 0.31 110.162 -179.468 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' D' D ' 341' ' ' PHE . . . . . . . . . . . . . 32.5 m-85 -62.61 -51.18 68.31 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.127 -0.983 . . . . 0.17999999999999999 110.377 -179.357 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' D' D ' 342' ' ' ARG . . . . . 0.534 ' NH1' ' HG2' ' D' ' 342' ' ' ARG . 4.7 ttt-85 -49.06 -46.12 44.0 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.13 -0.981 . . . . 2.4100000000000001 110.212 -179.314 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' D' D ' 343' ' ' GLU . . . . . . . . . . . . . 2.0 tt0 -58.4 -43.04 88.41 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.115 -0.991 . . . . 2.3500000000000001 109.921 -179.481 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' D' D ' 344' ' ' LEU . . . . . . . . . . . . . 39.1 mt -62.59 -38.37 89.87 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.163 -0.961 . . . . 0.19 109.898 -179.675 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' D' D ' 345' ' ' ASN . . . . . . . . . . . . . 46.4 t-20 -57.01 -48.4 78.56 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.231 -0.918 . . . . 1.0900000000000001 109.667 -179.838 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' D' D ' 346' ' ' GLU . . . . . . . . . . . . . 2.8 tt0 -61.53 -33.99 74.78 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.22 -0.925 . . . . 1.6899999999999999 109.753 -179.784 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' D' D ' 347' ' ' ALA . . . . . 0.728 ' HB1' ' HB1' ' C' ' 347' ' ' ALA . . . -60.27 -53.64 55.22 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.238 -0.914 . . . . 0.17999999999999999 110.331 -179.594 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' D' D ' 348' ' ' LEU . . . . . 0.59 HD22 ' N ' ' D' ' 348' ' ' LEU . 4.2 mm? -61.63 -48.63 79.99 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.187 -0.946 . . . . 0.31 110.112 -179.165 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' D' D ' 349' ' ' GLU . . . . . . . . . . . . . 64.5 mm-40 -57.8 -32.78 67.89 Favored 'General case' 0 N--CA 1.492 1.675 0 O-C-N 121.257 -0.902 . . . . 1.95 110.076 -179.296 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' D' D ' 350' ' ' LEU . . . . . 0.699 HD13 ' CD2' ' C' ' 350' ' ' LEU . 7.6 tt -64.48 -49.12 72.64 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.13 -0.981 . . . . 0.42999999999999999 109.855 -179.697 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' D' D ' 351' ' ' LYS . . . . . . . . . . . . . 66.5 tttt -58.97 -43.1 91.3 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.246 -0.909 . . . . 1.3999999999999999 109.785 -179.581 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' D' D ' 352' ' ' ASP . . . . . . . . . . . . . 66.7 m-20 -56.58 -51.05 70.1 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.286 -0.884 . . . . 1.1699999999999999 109.706 -179.848 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' D' D ' 353' ' ' ALA . . . . . . . . . . . . . . . -68.11 -14.01 62.65 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.287 -0.883 . . . . 0.58999999999999997 109.866 -179.824 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' D' D ' 354' ' ' GLN . . . . . . . . . . . . . 61.6 tt0 . . . . . 0 N--CA 1.492 1.652 0 O-C-N 121.092 -1.005 . . . . 1.4399999999999999 109.69 -179.867 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 326' ' ' GLU . . . . . . . . . . . . . 11.0 mm-40 . . . . . 0 N--CA 1.488 1.462 0 N-CA-C 109.362 -0.606 . . . . 2.1299999999999999 109.362 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 327' ' ' TYR . . . . . 0.464 ' CE2' ' HG2' ' C' ' 333' ' ' ARG . 39.5 m-85 -148.7 109.51 4.26 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.244 -0.91 . . . . 0.47999999999999998 109.732 -179.9 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 328' ' ' PHE . . . . . 0.486 ' CD1' ' N ' ' A' ' 328' ' ' PHE . 5.2 m-85 -113.7 -169.18 1.46 Allowed 'General case' 0 N--CA 1.488 1.473 0 O-C-N 121.401 -0.812 . . . . 0.31 108.969 179.75 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 329' ' ' THR . . . . . 0.426 HG23 ' O ' ' A' ' 328' ' ' PHE . 23.9 p -154.4 171.67 18.95 Favored 'General case' 0 N--CA 1.489 1.476 0 O-C-N 121.041 -1.037 . . . . 0.22 109.605 -179.763 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 330' ' ' LEU . . . . . . . . . . . . . 29.7 tp -150.49 129.88 12.93 Favored 'General case' 0 N--CA 1.488 1.456 0 O-C-N 121.307 -0.87 . . . . 0.28000000000000003 109.378 -179.913 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 331' ' ' GLN . . . . . . . . . . . . . 1.6 tp60 -87.27 113.89 23.4 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.19 -0.944 . . . . 0.91000000000000003 109.511 -179.982 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 332' ' ' ILE . . . . . 1.013 HG21 ' HA ' ' A' ' 338' ' ' PHE . 96.1 mt -103.44 99.97 9.48 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.552 0 O-C-N 121.162 -0.961 . . . . 0.26000000000000001 109.417 179.902 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 333' ' ' ARG . . . . . . . . . . . . . 25.7 mtt180 -71.85 145.29 48.69 Favored 'General case' 0 N--CA 1.489 1.49 0 O-C-N 121.2 -0.937 . . . . 2.9199999999999999 109.27 179.756 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 334' ' ' GLY . . . . . . . . . . . . . . . 82.71 121.3 0.68 Allowed Glycine 0 N--CA 1.489 2.181 0 N-CA-C 109.452 -1.459 . . . . 0.40000000000000002 109.452 -179.854 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 335' ' ' ARG . . . . . 0.544 ' HG3' ' NH1' ' A' ' 335' ' ' ARG . 1.3 ttm-85 -69.18 -29.36 67.33 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.327 -1.102 . . . . 3.0099999999999998 109.684 -179.844 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 336' ' ' GLU . . . . . . . . . . . . . 21.6 tt0 -59.31 -65.63 0.64 Allowed 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.267 -0.896 . . . . 2.29 109.906 -179.763 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 337' ' ' ARG . . . . . 0.61 ' CZ ' ' CB ' ' A' ' 337' ' ' ARG . 0.4 OUTLIER -59.0 -31.05 68.45 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.223 -0.923 . . . . 2.9300000000000002 109.289 -179.906 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 338' ' ' PHE . . . . . 1.013 ' HA ' HG21 ' A' ' 332' ' ' ILE . 54.3 t80 -54.47 -58.09 8.8 Favored 'General case' 0 N--CA 1.488 1.469 0 O-C-N 121.409 -0.807 . . . . 0.38 109.695 -179.856 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 339' ' ' GLU . . . . . . . . . . . . . 12.5 mt-10 -51.19 -34.18 30.58 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.204 -0.935 . . . . 1.97 110.146 -179.709 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 340' ' ' MET . . . . . . . . . . . . . 32.3 ttp -63.9 -51.58 63.87 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.14 -0.975 . . . . 0.31 110.27 -179.388 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 341' ' ' PHE . . . . . 0.435 ' CZ ' ' HA ' ' C' ' 345' ' ' ASN . 39.7 m-85 -62.12 -47.67 83.56 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.11 -0.994 . . . . 0.17999999999999999 110.029 -179.513 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 342' ' ' ARG . . . . . . . . . . . . . 31.4 ttt180 -48.05 -41.83 26.9 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.246 -0.909 . . . . 2.4199999999999999 109.95 -179.563 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 343' ' ' GLU . . . . . . . . . . . . . 3.2 tt0 -58.72 -48.27 81.74 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.08 -1.013 . . . . 2.3500000000000001 109.738 -179.643 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 344' ' ' LEU . . . . . . . . . . . . . 80.9 mt -62.29 -31.2 71.75 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.142 -0.974 . . . . 0.17999999999999999 109.618 -179.853 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 345' ' ' ASN . . . . . . . . . . . . . 17.5 t-20 -57.16 -60.56 3.43 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.296 -0.878 . . . . 1.0900000000000001 109.802 -179.67 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 346' ' ' GLU . . . . . 0.422 ' O ' ' HB2' ' A' ' 350' ' ' LEU . 24.9 tt0 -62.35 -25.25 67.8 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.316 -0.865 . . . . 1.6499999999999999 110.15 -179.684 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 347' ' ' ALA . . . . . 0.593 ' HB1' ' HB1' ' B' ' 347' ' ' ALA . . . -60.33 -59.91 4.65 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.195 -0.941 . . . . 0.17999999999999999 110.17 -179.568 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 348' ' ' LEU . . . . . 0.594 HD22 ' N ' ' A' ' 348' ' ' LEU . 3.8 mm? -61.34 -49.03 78.6 Favored 'General case' 0 N--CA 1.493 1.711 0 O-C-N 121.274 -0.891 . . . . 0.29999999999999999 109.901 -179.523 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 349' ' ' GLU . . . . . . . . . . . . . 4.5 mm-40 -57.43 -27.62 62.57 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.223 -0.923 . . . . 1.9399999999999999 109.798 -179.565 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 350' ' ' LEU . . . . . 0.836 HD23 ' O ' ' A' ' 350' ' ' LEU . 2.9 tt -64.49 -43.59 93.66 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.244 -0.91 . . . . 0.46000000000000002 109.293 -179.984 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 351' ' ' LYS . . . . . . . . . . . . . 33.3 tttt -59.4 -52.94 63.44 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.41 -0.806 . . . . 1.3999999999999999 109.868 -179.788 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 352' ' ' ASP . . . . . . . . . . . . . 66.9 m-20 -57.17 -38.54 73.74 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.246 -0.909 . . . . 1.1599999999999999 109.966 -179.594 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 353' ' ' ALA . . . . . . . . . . . . . . . -67.08 -24.67 65.98 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.104 -0.997 . . . . 0.63 109.886 -179.539 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 354' ' ' GLN . . . . . . . . . . . . . 14.5 tt0 . . . . . 0 N--CA 1.491 1.588 0 O-C-N 121.091 -1.005 . . . . 1.47 109.586 -179.854 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' B' B ' 326' ' ' GLU . . . . . . . . . . . . . 10.4 mm-40 . . . . . 0 N--CA 1.489 1.502 0 N-CA-C 109.349 -0.611 . . . . 2.1299999999999999 109.349 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' B' B ' 327' ' ' TYR . . . . . 0.44 ' CE2' ' HG2' ' D' ' 333' ' ' ARG . 39.8 m-85 -148.62 109.82 4.36 Favored 'General case' 0 N--CA 1.488 1.474 0 O-C-N 121.302 -0.874 . . . . 0.47999999999999998 109.767 179.987 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 328' ' ' PHE . . . . . 0.485 ' CD1' ' N ' ' B' ' 328' ' ' PHE . 5.5 m-85 -113.73 -168.89 1.41 Allowed 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.293 -0.879 . . . . 0.32000000000000001 109.057 179.725 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 329' ' ' THR . . . . . 0.484 ' HA ' ' O ' ' D' ' 330' ' ' LEU . 23.5 p -154.46 171.49 19.28 Favored 'General case' 0 N--CA 1.488 1.466 0 O-C-N 121.08 -1.013 . . . . 0.23000000000000001 109.682 -179.947 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 330' ' ' LEU . . . . . 0.446 ' O ' ' HA ' ' D' ' 329' ' ' THR . 30.1 tp -150.41 129.67 12.82 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.34 -0.85 . . . . 0.28000000000000003 109.388 -179.95 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 331' ' ' GLN . . . . . . . . . . . . . 1.7 tp60 -87.06 113.86 23.18 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.192 -0.942 . . . . 0.91000000000000003 109.575 179.917 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 332' ' ' ILE . . . . . 1.018 HG21 ' HA ' ' B' ' 338' ' ' PHE . 96.2 mt -103.31 99.94 9.41 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.581 0 O-C-N 121.142 -0.974 . . . . 0.23999999999999999 109.385 179.889 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 333' ' ' ARG . . . . . . . . . . . . . 25.9 mtt180 -71.94 145.59 48.34 Favored 'General case' 0 N--CA 1.489 1.482 0 O-C-N 121.263 -0.898 . . . . 2.9300000000000002 109.203 179.79 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 334' ' ' GLY . . . . . . . . . . . . . . . 82.58 121.15 0.66 Allowed Glycine 0 N--CA 1.49 2.238 0 N-CA-C 109.424 -1.47 . . . . 0.40000000000000002 109.424 -179.903 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 335' ' ' ARG . . . . . 0.559 ' NH1' ' HG3' ' B' ' 335' ' ' ARG . 1.3 ttm-85 -69.02 -29.57 67.76 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.341 -1.094 . . . . 3.0099999999999998 109.678 -179.879 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 336' ' ' GLU . . . . . . . . . . . . . 21.3 tt0 -59.2 -65.68 0.63 Allowed 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.275 -0.891 . . . . 2.2799999999999998 109.871 -179.786 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 337' ' ' ARG . . . . . 0.609 ' CB ' ' CZ ' ' B' ' 337' ' ' ARG . 0.4 OUTLIER -59.11 -30.84 68.41 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.155 -0.966 . . . . 2.9300000000000002 109.326 -179.884 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' B' B ' 338' ' ' PHE . . . . . 1.018 ' HA ' HG21 ' B' ' 332' ' ' ILE . 53.5 t80 -54.65 -58.06 9.0 Favored 'General case' 0 N--CA 1.488 1.444 0 O-C-N 121.303 -0.873 . . . . 0.37 109.583 -179.797 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 339' ' ' GLU . . . . . . . . . . . . . 12.6 mt-10 -51.27 -34.08 31.22 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.154 -0.966 . . . . 1.98 110.124 -179.691 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 340' ' ' MET . . . . . . . . . . . . . 32.4 ttp -63.88 -51.75 63.11 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.108 -0.995 . . . . 0.32000000000000001 110.234 -179.397 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 341' ' ' PHE . . . . . . . . . . . . . 39.5 m-85 -61.96 -47.55 84.34 Favored 'General case' 0 N--CA 1.493 1.675 0 O-C-N 121.108 -0.995 . . . . 0.17999999999999999 110.089 -179.45 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 342' ' ' ARG . . . . . . . . . . . . . 31.5 ttt180 -48.16 -41.77 27.77 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.28 -0.888 . . . . 2.4199999999999999 110.006 -179.543 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 343' ' ' GLU . . . . . . . . . . . . . 3.2 tt0 -58.73 -48.15 82.17 Favored 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.14 -0.975 . . . . 2.3500000000000001 109.781 -179.649 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 344' ' ' LEU . . . . . . . . . . . . . 80.5 mt -62.46 -31.21 71.9 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.151 -0.968 . . . . 0.17999999999999999 109.624 -179.859 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 345' ' ' ASN . . . . . . . . . . . . . 17.7 t-20 -56.98 -60.73 3.14 Favored 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.163 -0.96 . . . . 1.0900000000000001 109.786 -179.812 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 346' ' ' GLU . . . . . 0.428 ' O ' ' HB2' ' B' ' 350' ' ' LEU . 24.8 tt0 -62.24 -25.27 67.73 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.304 -0.873 . . . . 1.6599999999999999 110.152 -179.646 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 347' ' ' ALA . . . . . 0.593 ' HB1' ' HB1' ' A' ' 347' ' ' ALA . . . -60.29 -59.97 4.57 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.087 -1.008 . . . . 0.17000000000000001 110.17 -179.534 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 348' ' ' LEU . . . . . 0.592 HD22 ' N ' ' B' ' 348' ' ' LEU . 3.7 mm? -61.34 -49.02 78.66 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.262 -0.899 . . . . 0.28999999999999998 109.994 -179.498 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 349' ' ' GLU . . . . . . . . . . . . . 4.5 mm-40 -57.27 -27.94 62.54 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.165 -0.96 . . . . 1.95 109.784 -179.594 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 350' ' ' LEU . . . . . 0.833 HD23 ' O ' ' B' ' 350' ' ' LEU . 2.8 tt -64.28 -43.5 94.61 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.259 -0.901 . . . . 0.45000000000000001 109.311 -179.989 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 351' ' ' LYS . . . . . . . . . . . . . 33.4 tttt -59.52 -53.13 61.66 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.305 -0.872 . . . . 1.3799999999999999 109.833 -179.692 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 352' ' ' ASP . . . . . . . . . . . . . 65.9 m-20 -56.97 -38.63 73.27 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.262 -0.899 . . . . 1.1599999999999999 109.979 -179.733 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 353' ' ' ALA . . . . . . . . . . . . . . . -66.94 -24.86 66.12 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.209 -0.932 . . . . 0.60999999999999999 109.876 -179.54 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 354' ' ' GLN . . . . . . . . . . . . . 13.9 tt0 . . . . . 0 N--CA 1.492 1.643 0 O-C-N 121.168 -0.958 . . . . 1.45 109.549 -179.889 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' C' C ' 326' ' ' GLU . . . . . . . . . . . . . 66.3 mm-40 . . . . . 0 N--CA 1.487 1.41 0 CA-C-O 121.445 0.64 . . . . 2.1699999999999999 109.48 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' C' C ' 327' ' ' TYR . . . . . . . . . . . . . 36.2 m-85 -147.47 105.93 3.79 Favored 'General case' 0 C--N 1.302 -1.484 0 O-C-N 121.441 -0.787 . . . . 0.47999999999999998 109.226 179.661 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 328' ' ' PHE . . . . . 0.408 ' C ' HG23 ' C' ' 329' ' ' THR . 43.3 m-85 -113.35 -171.81 1.95 Allowed 'General case' 0 C--N 1.302 -1.461 0 O-C-N 121.297 -0.877 . . . . 0.33000000000000002 108.91 179.902 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' C' C ' 329' ' ' THR . . . . . 0.408 HG23 ' C ' ' C' ' 328' ' ' PHE . 19.0 p -152.5 -175.66 5.38 Favored 'General case' 0 C--N 1.302 -1.461 0 O-C-N 121.091 -1.006 . . . . 0.23000000000000001 109.645 -179.973 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' C' C ' 330' ' ' LEU . . . . . . . . . . . . . 28.1 tp -153.37 128.99 10.03 Favored 'General case' 0 N--CA 1.489 1.492 0 O-C-N 121.331 -0.855 . . . . 0.28000000000000003 109.557 -179.65 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 331' ' ' GLN . . . . . . . . . . . . . 8.2 tp-100 -89.08 106.49 18.47 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.253 -0.904 . . . . 1.48 109.418 179.759 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 332' ' ' ILE . . . . . . . . . . . . . 68.3 mt -103.55 108.53 24.69 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.557 0 O-C-N 121.193 -0.942 . . . . 0.23999999999999999 109.813 -179.96 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 333' ' ' ARG . . . . . 0.464 ' HG2' ' CE2' ' A' ' 327' ' ' TYR . 2.1 mpt_? -74.13 156.54 37.27 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.267 -0.895 . . . . 2.7400000000000002 109.685 179.935 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' C' C ' 334' ' ' GLY . . . . . . . . . . . . . . . 76.93 132.73 0.52 Allowed Glycine 0 N--CA 1.492 2.4 0 N-CA-C 109.9 -1.28 . . . . 0.34999999999999998 109.9 179.709 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 335' ' ' ARG . . . . . . . . . . . . . 26.4 ttp180 -77.9 -32.83 52.0 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.3 -1.118 . . . . 2.5299999999999998 109.595 179.947 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 336' ' ' GLU . . . . . . . . . . . . . 1.6 mt-10 -57.05 -59.72 4.65 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.291 -0.88 . . . . 2.6200000000000001 109.67 -179.707 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 337' ' ' ARG . . . . . 0.549 ' HG2' ' NH1' ' C' ' 337' ' ' ARG . 0.1 OUTLIER -61.23 -35.22 76.63 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.217 -0.927 . . . . 2.8100000000000001 109.667 -179.742 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' C' C ' 338' ' ' PHE . . . . . . . . . . . . . 51.5 t80 -54.32 -54.86 34.6 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.185 -0.947 . . . . 0.40000000000000002 109.598 -179.714 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 339' ' ' GLU . . . . . . . . . . . . . 6.9 mt-10 -53.12 -33.39 52.07 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.165 -0.959 . . . . 2.0499999999999998 109.942 -179.922 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 340' ' ' MET . . . . . . . . . . . . . 25.7 ttp -65.01 -55.35 19.52 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.239 -0.913 . . . . 0.32000000000000001 110.366 -179.402 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 341' ' ' PHE . . . . . . . . . . . . . 49.7 m-85 -61.39 -35.23 76.93 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.111 -0.993 . . . . 0.17999999999999999 110.082 -179.231 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 342' ' ' ARG . . . . . . . . . . . . . 10.7 ttt180 -53.33 -49.44 67.06 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.227 -0.92 . . . . 2.9100000000000001 110.13 -179.807 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 343' ' ' GLU . . . . . . . . . . . . . 2.3 tt0 -59.28 -47.11 86.59 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.214 -0.929 . . . . 2.1400000000000001 110.289 -179.33 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 344' ' ' LEU . . . . . . . . . . . . . 85.2 mt -60.33 -30.97 69.86 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.065 -1.022 . . . . 0.22 109.641 -179.457 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 345' ' ' ASN . . . . . 0.435 ' HA ' ' CZ ' ' A' ' 341' ' ' PHE . 1.9 t30 -59.15 -58.84 6.85 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.266 -0.896 . . . . 1.0800000000000001 109.928 -179.873 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' C' C ' 346' ' ' GLU . . . . . . . . . . . . . 8.8 tp10 -61.85 -25.5 67.57 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.356 -0.84 . . . . 2.21 110.321 -179.351 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 347' ' ' ALA . . . . . 0.5 ' HB1' ' HB1' ' D' ' 347' ' ' ALA . . . -58.52 -62.46 1.84 Allowed 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.045 -1.035 . . . . 0.17999999999999999 110.26 -179.355 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' C' C ' 348' ' ' LEU . . . . . 0.632 ' N ' HD22 ' C' ' 348' ' ' LEU . 3.4 mm? -61.34 -42.44 98.69 Favored 'General case' 0 N--CA 1.494 1.761 0 O-C-N 121.181 -0.949 . . . . 0.32000000000000001 110.014 -179.274 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' C' C ' 349' ' ' GLU . . . . . . . . . . . . . 34.7 mt-10 -57.25 -31.29 65.41 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.109 -0.994 . . . . 2.1899999999999999 109.709 -179.697 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 350' ' ' LEU . . . . . 0.831 ' O ' HD23 ' C' ' 350' ' ' LEU . 5.8 tt -62.87 -43.59 98.38 Favored 'General case' 0 N--CA 1.488 1.453 0 O-C-N 121.106 -0.996 . . . . 0.46000000000000002 109.604 179.993 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' C' C ' 351' ' ' LYS . . . . . . . . . . . . . 6.0 tttp -58.79 -44.77 90.79 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.288 -0.883 . . . . 1.3500000000000001 109.831 -179.808 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 352' ' ' ASP . . . . . . . . . . . . . 81.6 m-20 -54.99 -44.64 74.64 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.083 -1.011 . . . . 1.1899999999999999 109.945 -179.753 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 353' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 1.536 0 O-C-N 121.1 -1.0 . . . . 0.56999999999999995 109.84 -179.607 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' D' D ' 326' ' ' GLU . . . . . . . . . . . . . 11.1 mm-40 . . . . . 0 N--CA 1.488 1.445 0 N-CA-C 109.37 -0.604 . . . . 2.1299999999999999 109.37 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' D' D ' 327' ' ' TYR . . . . . . . . . . . . . 40.1 m-85 -148.55 110.02 4.43 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.225 -0.922 . . . . 0.46999999999999997 109.721 -179.985 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' D' D ' 328' ' ' PHE . . . . . 0.478 ' N ' ' CD1' ' D' ' 328' ' ' PHE . 5.4 m-85 -113.96 -168.9 1.42 Allowed 'General case' 0 N--CA 1.489 1.483 0 O-C-N 121.345 -0.847 . . . . 0.29999999999999999 109.064 179.679 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' D' D ' 329' ' ' THR . . . . . 0.446 ' HA ' ' O ' ' B' ' 330' ' ' LEU . 23.8 p -154.45 171.75 18.86 Favored 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.216 -0.928 . . . . 0.22 109.613 -179.88 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' D' D ' 330' ' ' LEU . . . . . 0.484 ' O ' ' HA ' ' B' ' 329' ' ' THR . 29.8 tp -150.65 129.53 12.48 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.299 -0.876 . . . . 0.28000000000000003 109.369 -179.943 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' D' D ' 331' ' ' GLN . . . . . . . . . . . . . 1.6 tp60 -87.0 113.92 23.17 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.259 -0.901 . . . . 0.93000000000000005 109.578 179.958 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' D' D ' 332' ' ' ILE . . . . . 1.0 HG21 ' HA ' ' D' ' 338' ' ' PHE . 96.2 mt -103.29 100.03 9.6 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.522 0 O-C-N 121.223 -0.923 . . . . 0.25 109.421 179.882 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' D' D ' 333' ' ' ARG . . . . . 0.44 ' HG2' ' CE2' ' B' ' 327' ' ' TYR . 26.2 mtt180 -71.88 145.61 48.43 Favored 'General case' 0 N--CA 1.488 1.427 0 O-C-N 121.253 -0.905 . . . . 2.9300000000000002 109.225 179.761 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' D' D ' 334' ' ' GLY . . . . . . . . . . . . . . . 82.75 121.21 0.68 Allowed Glycine 0 N--CA 1.49 2.253 0 N-CA-C 109.518 -1.433 . . . . 0.40999999999999998 109.518 -179.93 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' D' D ' 335' ' ' ARG . . . . . 0.546 ' HG3' ' NH1' ' D' ' 335' ' ' ARG . 1.3 ttm-85 -69.02 -29.98 68.27 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.324 -1.103 . . . . 3.0299999999999998 109.613 -179.94 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' D' D ' 336' ' ' GLU . . . . . . . . . . . . . 21.3 tt0 -58.93 -65.57 0.64 Allowed 'General case' 0 N--CA 1.491 1.625 0 O-C-N 121.239 -0.913 . . . . 2.2599999999999998 109.95 -179.728 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' D' D ' 337' ' ' ARG . . . . . 0.588 ' CB ' ' CZ ' ' D' ' 337' ' ' ARG . 0.4 OUTLIER -59.22 -30.77 68.48 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.172 -0.955 . . . . 2.9199999999999999 109.355 -179.877 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' D' D ' 338' ' ' PHE . . . . . 1.0 ' HA ' HG21 ' D' ' 332' ' ' ILE . 54.0 t80 -54.61 -58.01 9.19 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.389 -0.819 . . . . 0.37 109.635 -179.951 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' D' D ' 339' ' ' GLU . . . . . . . . . . . . . 12.6 mt-10 -51.37 -34.2 33.17 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.207 -0.933 . . . . 1.99 110.093 -179.636 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' D' D ' 340' ' ' MET . . . . . . . . . . . . . 32.3 ttp -63.79 -51.53 64.38 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.077 -1.015 . . . . 0.31 110.327 -179.5 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' D' D ' 341' ' ' PHE . . . . . . . . . . . . . 39.2 m-85 -62.17 -47.67 83.48 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.128 -0.982 . . . . 0.17999999999999999 110.043 -179.438 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' D' D ' 342' ' ' ARG . . . . . . . . . . . . . 31.1 ttt180 -47.89 -41.98 25.73 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.286 -0.883 . . . . 2.4100000000000001 110.042 -179.606 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' D' D ' 343' ' ' GLU . . . . . . . . . . . . . 3.2 tt0 -58.72 -48.07 82.42 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.156 -0.965 . . . . 2.3500000000000001 109.729 -179.556 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' D' D ' 344' ' ' LEU . . . . . . . . . . . . . 80.2 mt -62.49 -31.29 72.01 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.244 -0.91 . . . . 0.19 109.624 -179.772 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' D' D ' 345' ' ' ASN . . . . . . . . . . . . . 17.4 t-20 -56.91 -60.42 3.6 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.279 -0.888 . . . . 1.0900000000000001 109.798 -179.775 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' D' D ' 346' ' ' GLU . . . . . 0.43 ' O ' ' HB2' ' D' ' 350' ' ' LEU . 24.8 tt0 -62.69 -25.4 68.13 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.179 -0.95 . . . . 1.6899999999999999 110.077 -179.55 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' D' D ' 347' ' ' ALA . . . . . 0.5 ' HB1' ' HB1' ' C' ' 347' ' ' ALA . . . -60.18 -59.87 4.72 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.173 -0.954 . . . . 0.17999999999999999 110.06 -179.518 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' D' D ' 348' ' ' LEU . . . . . 0.603 HD22 ' N ' ' D' ' 348' ' ' LEU . 3.8 mm? -61.44 -49.11 78.16 Favored 'General case' 0 N--CA 1.493 1.722 0 O-C-N 121.248 -0.907 . . . . 0.31 110.02 -179.48 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' D' D ' 349' ' ' GLU . . . . . . . . . . . . . 4.5 mm-40 -57.21 -27.77 62.27 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.186 -0.946 . . . . 1.95 109.77 -179.602 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' D' D ' 350' ' ' LEU . . . . . 0.818 HD23 ' O ' ' D' ' 350' ' ' LEU . 2.7 tt -64.59 -43.52 93.57 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.142 -0.974 . . . . 0.42999999999999999 109.268 -179.979 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' D' D ' 351' ' ' LYS . . . . . . . . . . . . . 32.9 tttt -59.28 -53.14 61.59 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.3 -0.875 . . . . 1.3999999999999999 109.913 -179.84 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' D' D ' 352' ' ' ASP . . . . . . . . . . . . . 66.6 m-20 -56.96 -38.65 73.27 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.146 -0.971 . . . . 1.1699999999999999 110.006 -179.745 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' D' D ' 353' ' ' ALA . . . . . . . . . . . . . . . -66.89 -24.73 66.14 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.144 -0.972 . . . . 0.58999999999999997 109.917 -179.555 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' D' D ' 354' ' ' GLN . . . . . . . . . . . . . 14.4 tt0 . . . . . 0 N--CA 1.49 1.556 0 O-C-N 121.205 -0.934 . . . . 1.4399999999999999 109.621 -179.885 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 326' ' ' GLU . . . . . . . . . . . . . 35.5 mm-40 . . . . . 0 N--CA 1.492 1.63 0 N-CA-C 109.241 -0.651 . . . . 2.1299999999999999 109.241 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 327' ' ' TYR . . . . . 0.462 ' CE1' ' HG2' ' C' ' 333' ' ' ARG . 49.7 m-85 -150.17 111.75 4.48 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.235 -0.916 . . . . 0.47999999999999998 109.617 -179.892 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 328' ' ' PHE . . . . . 0.439 ' O ' HG23 ' A' ' 329' ' ' THR . 46.2 m-85 -112.56 -170.07 1.6 Allowed 'General case' 0 N--CA 1.488 1.465 0 O-C-N 121.358 -0.839 . . . . 0.31 109.425 179.934 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 329' ' ' THR . . . . . 0.485 ' HA ' ' O ' ' C' ' 330' ' ' LEU . 9.1 p -153.38 175.62 12.93 Favored 'General case' 0 N--CA 1.487 1.416 0 O-C-N 121.203 -0.936 . . . . 0.22 109.404 -179.899 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 330' ' ' LEU . . . . . 0.488 ' O ' ' HA ' ' C' ' 329' ' ' THR . 29.2 tp -151.49 133.46 15.06 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.192 -0.942 . . . . 0.28000000000000003 109.665 -179.698 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 331' ' ' GLN . . . . . . . . . . . . . 1.9 tp60 -85.64 110.42 19.26 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.365 -0.834 . . . . 0.91000000000000003 109.222 179.784 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 332' ' ' ILE . . . . . 0.859 HG21 ' HA ' ' A' ' 338' ' ' PHE . 83.0 mt -103.11 103.99 15.94 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.659 0 O-C-N 121.251 -0.906 . . . . 0.26000000000000001 109.404 -179.772 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 333' ' ' ARG . . . . . 0.468 ' HG2' ' CE1' ' C' ' 327' ' ' TYR . 85.4 mtt180 -73.34 143.88 46.73 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.178 -0.951 . . . . 2.9199999999999999 109.424 179.891 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 334' ' ' GLY . . . . . . . . . . . . . . . 88.99 131.94 4.24 Favored Glycine 0 N--CA 1.49 2.279 0 N-CA-C 109.636 -1.386 . . . . 0.40000000000000002 109.636 179.932 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 335' ' ' ARG . . . . . . . . . . . . . 58.7 ttt180 -80.23 -41.19 25.58 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.304 -1.115 . . . . 3.0099999999999998 109.76 -179.92 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 336' ' ' GLU . . . . . . . . . . . . . 2.4 tt0 -58.49 -59.25 5.66 Favored 'General case' 0 N--CA 1.489 1.492 0 O-C-N 121.179 -0.951 . . . . 2.29 109.685 -179.754 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 337' ' ' ARG . . . . . 0.492 ' NH2' HD12 ' C' ' 348' ' ' LEU . 1.0 OUTLIER -59.43 -33.29 71.06 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.235 -0.916 . . . . 2.9300000000000002 109.422 179.993 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 338' ' ' PHE . . . . . 0.859 ' HA ' HG21 ' A' ' 332' ' ' ILE . 43.6 t80 -55.51 -56.74 16.8 Favored 'General case' 0 N--CA 1.488 1.425 0 O-C-N 121.219 -0.926 . . . . 0.38 109.456 179.95 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 339' ' ' GLU . . . . . . . . . . . . . 43.4 mt-10 -51.29 -30.9 19.51 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.23 -0.919 . . . . 1.97 109.925 179.979 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 340' ' ' MET . . . . . . . . . . . . . 6.1 ttp -63.34 -53.15 57.05 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.128 -0.983 . . . . 0.31 109.919 -179.505 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 341' ' ' PHE . . . . . . . . . . . . . 40.6 m-85 -62.03 -43.65 98.39 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.208 -0.933 . . . . 0.17999999999999999 109.719 -179.918 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 342' ' ' ARG . . . . . 0.456 ' CG ' ' NH1' ' A' ' 342' ' ' ARG . 0.0 OUTLIER -49.58 -41.06 40.79 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.178 -0.951 . . . . 2.4199999999999999 109.562 -179.924 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 343' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -59.68 -47.54 85.21 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.28 -0.887 . . . . 2.3500000000000001 109.638 -179.816 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 344' ' ' LEU . . . . . . . . . . . . . 53.2 mt -62.24 -31.68 72.27 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.237 -0.914 . . . . 0.17999999999999999 109.566 -179.81 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 345' ' ' ASN . . . . . . . . . . . . . 10.4 t-20 -57.11 -57.26 13.35 Favored 'General case' 0 N--CA 1.488 1.467 0 O-C-N 121.257 -0.902 . . . . 1.0900000000000001 109.772 -179.95 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 346' ' ' GLU . . . . . . . . . . . . . 64.9 tt0 -61.74 -26.47 68.08 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.311 -0.868 . . . . 1.6499999999999999 109.68 -179.851 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 347' ' ' ALA . . . . . 0.572 ' HB1' ' HB1' ' B' ' 347' ' ' ALA . . . -61.82 -61.18 2.69 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.229 -0.919 . . . . 0.17999999999999999 110.064 -179.59 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 348' ' ' LEU . . . . . 0.564 HD22 ' N ' ' A' ' 348' ' ' LEU . 4.1 mm? -59.79 -44.84 93.75 Favored 'General case' 0 N--CA 1.493 1.725 0 O-C-N 121.137 -0.977 . . . . 0.29999999999999999 109.825 -179.519 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 349' ' ' GLU . . . . . . . . . . . . . 92.8 mt-10 -57.95 -32.47 67.85 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.196 -0.94 . . . . 1.9399999999999999 109.901 -179.571 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 350' ' ' LEU . . . . . 0.625 HD22 HD13 ' B' ' 350' ' ' LEU . 5.9 tt -64.03 -45.55 88.38 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.24 -0.913 . . . . 0.46000000000000002 109.274 -179.894 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 351' ' ' LYS . . . . . . . . . . . . . 85.9 tttt -60.26 -41.57 93.52 Favored 'General case' 0 C--N 1.303 -1.454 0 O-C-N 121.436 -0.79 . . . . 1.3999999999999999 109.319 179.991 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 352' ' ' ASP . . . . . . . . . . . . . 21.1 m-20 -57.83 -40.91 81.14 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.406 -0.809 . . . . 1.1599999999999999 109.841 179.922 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 353' ' ' ALA . . . . . . . . . . . . . . . -66.99 -21.2 65.97 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.293 -0.879 . . . . 0.63 109.798 -179.602 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 354' ' ' GLN . . . . . . . . . . . . . 5.6 tt0 . . . . . 0 C--N 1.302 -1.459 0 O-C-N 121.04 -1.038 . . . . 1.47 109.0 179.729 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' B' B ' 326' ' ' GLU . . . . . . . . . . . . . 37.5 mm-40 . . . . . 0 N--CA 1.49 1.554 0 N-CA-C 109.224 -0.658 . . . . 2.1299999999999999 109.224 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' B' B ' 327' ' ' TYR . . . . . . . . . . . . . 50.4 m-85 -149.85 112.12 4.67 Favored 'General case' 0 N--CA 1.488 1.469 0 O-C-N 121.205 -0.934 . . . . 0.47999999999999998 109.489 179.91 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 328' ' ' PHE . . . . . 0.431 ' O ' HG23 ' B' ' 329' ' ' THR . 47.6 m-85 -112.73 -170.21 1.62 Allowed 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.401 -0.812 . . . . 0.32000000000000001 109.216 179.879 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 329' ' ' THR . . . . . 0.431 HG23 ' O ' ' B' ' 328' ' ' PHE . 9.3 p -153.41 175.51 13.06 Favored 'General case' 0 N--CA 1.489 1.485 0 O-C-N 121.282 -0.886 . . . . 0.23000000000000001 109.315 -179.89 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 330' ' ' LEU . . . . . 0.46 ' O ' ' HA ' ' D' ' 329' ' ' THR . 27.1 tp -151.21 133.92 15.65 Favored 'General case' 0 N--CA 1.488 1.442 0 O-C-N 121.167 -0.958 . . . . 0.28000000000000003 109.644 -179.761 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 331' ' ' GLN . . . . . . . . . . . . . 1.9 tp60 -85.79 110.18 19.18 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.416 -0.803 . . . . 0.91000000000000003 109.158 179.839 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 332' ' ' ILE . . . . . 0.852 HG21 ' HA ' ' B' ' 338' ' ' PHE . 83.5 mt -103.07 103.29 14.87 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.668 0 O-C-N 121.249 -0.907 . . . . 0.23999999999999999 109.72 -179.737 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 333' ' ' ARG . . . . . 0.425 ' HG2' ' CD1' ' D' ' 327' ' ' TYR . 85.0 mtt180 -72.72 143.95 47.84 Favored 'General case' 0 N--CA 1.489 1.481 0 O-C-N 121.252 -0.905 . . . . 2.9300000000000002 109.492 179.834 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 334' ' ' GLY . . . . . . . . . . . . . . . 89.11 132.13 4.36 Favored Glycine 0 N--CA 1.492 2.377 0 N-CA-C 109.561 -1.415 . . . . 0.40000000000000002 109.561 -179.95 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 335' ' ' ARG . . . . . . . . . . . . . 58.4 ttt180 -80.31 -41.7 24.39 Favored 'General case' 0 N--CA 1.489 1.481 0 O-C-N 121.221 -1.164 . . . . 3.0099999999999998 109.53 -179.99 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 336' ' ' GLU . . . . . . . . . . . . . 2.5 tt0 -58.0 -59.68 4.9 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.27 -0.894 . . . . 2.2799999999999998 109.685 -179.823 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 337' ' ' ARG . . . . . 0.609 ' CZ ' HD12 ' D' ' 348' ' ' LEU . 1.0 OUTLIER -58.86 -33.59 70.63 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.148 -0.97 . . . . 2.9300000000000002 109.395 -179.872 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' B' B ' 338' ' ' PHE . . . . . 0.852 ' HA ' HG21 ' B' ' 332' ' ' ILE . 45.8 t80 -55.14 -56.72 16.75 Favored 'General case' 0 N--CA 1.487 1.397 0 O-C-N 121.324 -0.86 . . . . 0.37 109.623 179.963 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 339' ' ' GLU . . . . . . . . . . . . . 44.7 mt-10 -51.58 -30.46 20.98 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.205 -0.934 . . . . 1.98 109.984 -179.98 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 340' ' ' MET . . . . . . . . . . . . . 5.8 ttp -63.55 -53.71 47.51 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.177 -0.952 . . . . 0.32000000000000001 109.784 -179.461 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 341' ' ' PHE . . . . . . . . . . . . . 39.8 m-85 -61.76 -43.84 98.06 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.282 -0.886 . . . . 0.17999999999999999 109.637 -179.812 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 342' ' ' ARG . . . . . 0.449 ' CG ' HH11 ' B' ' 342' ' ' ARG . 0.1 OUTLIER -49.02 -41.7 35.62 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.258 -0.901 . . . . 2.4199999999999999 109.711 -179.948 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' B' B ' 343' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -58.98 -48.69 80.66 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.266 -0.896 . . . . 2.3500000000000001 109.599 -179.987 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 344' ' ' LEU . . . . . . . . . . . . . 59.6 mt -61.12 -31.18 70.89 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.253 -0.904 . . . . 0.17999999999999999 109.807 -179.753 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 345' ' ' ASN . . . . . . . . . . . . . 10.5 t-20 -57.95 -56.91 15.92 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.192 -0.943 . . . . 1.0900000000000001 109.681 -179.833 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 346' ' ' GLU . . . . . . . . . . . . . 62.4 tt0 -62.02 -26.38 68.2 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.226 -0.921 . . . . 1.6599999999999999 109.572 -179.768 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 347' ' ' ALA . . . . . 0.572 ' HB1' ' HB1' ' A' ' 347' ' ' ALA . . . -61.86 -60.62 3.38 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.192 -0.943 . . . . 0.17000000000000001 110.202 -179.687 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 348' ' ' LEU . . . . . 0.954 HD12 ' NH2' ' D' ' 337' ' ' ARG . 4.2 mm? -60.27 -45.16 94.27 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.045 -1.034 . . . . 0.28999999999999998 109.683 -179.441 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 349' ' ' GLU . . . . . . . . . . . . . 93.2 mt-10 -57.34 -33.36 67.67 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.386 -0.821 . . . . 1.95 109.863 -179.649 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 350' ' ' LEU . . . . . 0.625 HD13 HD22 ' A' ' 350' ' ' LEU . 5.9 tt -63.13 -46.63 86.36 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.122 -0.986 . . . . 0.45000000000000001 109.167 179.988 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 351' ' ' LYS . . . . . . . . . . . . . 87.5 tttt -59.23 -41.41 88.64 Favored 'General case' 0 N--CA 1.488 1.462 0 O-C-N 121.244 -0.91 . . . . 1.3799999999999999 109.455 179.856 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 352' ' ' ASP . . . . . . . . . . . . . 21.1 m-20 -58.11 -40.99 82.59 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.095 -1.003 . . . . 1.1599999999999999 110.06 -179.874 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 353' ' ' ALA . . . . . . . . . . . . . . . -66.48 -21.98 66.19 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.251 -0.905 . . . . 0.60999999999999999 109.66 -179.64 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 354' ' ' GLN . . . . . . . . . . . . . 5.5 tt0 . . . . . 0 N--CA 1.492 1.627 0 O-C-N 121.205 -0.934 . . . . 1.45 109.241 179.853 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' C' C ' 326' ' ' GLU . . . . . . . . . . . . . 45.0 mt-10 . . . . . 0 N--CA 1.491 1.595 0 CA-C-O 121.308 0.575 . . . . 2.1699999999999999 109.763 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' C' C ' 327' ' ' TYR . . . . . 0.468 ' CE1' ' HG2' ' A' ' 333' ' ' ARG . 59.1 m-85 -150.77 108.04 3.61 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.39 -0.819 . . . . 0.47999999999999998 109.507 -179.905 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' C' C ' 328' ' ' PHE . . . . . 0.411 ' C ' HG23 ' C' ' 329' ' ' THR . 67.3 m-85 -104.12 -164.02 1.02 Allowed 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.201 -0.937 . . . . 0.33000000000000002 109.825 -179.885 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' C' C ' 329' ' ' THR . . . . . 0.488 ' HA ' ' O ' ' A' ' 330' ' ' LEU . 56.1 p -156.28 177.8 11.03 Favored 'General case' 0 N--CA 1.491 1.589 0 N-CA-C 108.997 -0.742 . . . . 0.23000000000000001 108.997 179.748 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' C' C ' 330' ' ' LEU . . . . . 0.485 ' O ' ' HA ' ' A' ' 329' ' ' THR . 39.3 tp -153.48 132.09 12.23 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 120.949 -1.095 . . . . 0.28000000000000003 109.492 179.823 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' C' C ' 331' ' ' GLN . . . . . . . . . . . . . 1.1 tp60 -87.56 114.04 23.81 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.133 -0.979 . . . . 1.48 109.547 179.791 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 332' ' ' ILE . . . . . 0.762 HG21 ' HA ' ' C' ' 338' ' ' PHE . 48.5 mt -103.91 108.28 24.23 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.526 0 O-C-N 121.197 -0.939 . . . . 0.23999999999999999 109.728 -179.933 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' C' C ' 333' ' ' ARG . . . . . 0.462 ' HG2' ' CE1' ' A' ' 327' ' ' TYR . 5.1 mtp180 -72.89 144.98 47.18 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.006 -1.058 . . . . 2.7400000000000002 109.488 179.848 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' C' C ' 334' ' ' GLY . . . . . . . . . . . . . . . 73.05 130.92 0.15 Allowed Glycine 0 N--CA 1.491 2.322 0 N-CA-C 109.93 -1.268 . . . . 0.34999999999999998 109.93 179.794 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 335' ' ' ARG . . . . . 0.49 ' O ' ' HB3' ' C' ' 338' ' ' PHE . 2.4 ttp180 -73.45 -27.77 61.6 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.238 -1.154 . . . . 2.5299999999999998 109.667 179.922 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' C' C ' 336' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -57.08 -58.82 6.52 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 120.961 -1.087 . . . . 2.6200000000000001 109.158 -179.987 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' C' C ' 337' ' ' ARG . . . . . 0.555 ' NH1' ' HG3' ' C' ' 337' ' ' ARG . 0.5 OUTLIER -60.95 -30.83 70.47 Favored 'General case' 0 N--CA 1.488 1.474 0 O-C-N 121.296 -0.877 . . . . 2.8100000000000001 108.776 179.618 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' C' C ' 338' ' ' PHE . . . . . 0.762 ' HA ' HG21 ' C' ' 332' ' ' ILE . 82.6 t80 -54.89 -58.66 6.68 Favored 'General case' 0 C--N 1.304 -1.378 0 O-C-N 121.345 -0.847 . . . . 0.40000000000000002 109.646 -179.835 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' C' C ' 339' ' ' GLU . . . . . . . . . . . . . 41.2 mt-10 -50.97 -32.63 21.62 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.07 -1.018 . . . . 2.0499999999999998 109.989 -179.657 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 340' ' ' MET . . . . . . . . . . . . . 29.8 ttp -65.37 -56.24 13.71 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.242 -0.911 . . . . 0.32000000000000001 110.208 -179.472 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 341' ' ' PHE . . . . . . . . . . . . . 63.9 m-85 -61.44 -53.51 55.53 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.091 -1.006 . . . . 0.17999999999999999 110.155 -179.416 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 342' ' ' ARG . . . . . 0.438 ' NH1' ' CG ' ' C' ' 342' ' ' ARG . 0.0 OUTLIER -44.8 -41.15 6.73 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.255 -0.903 . . . . 2.9100000000000001 110.051 -179.265 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' C' C ' 343' ' ' GLU . . . . . . . . . . . . . 36.6 tt0 -57.89 -51.42 69.67 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.162 -0.961 . . . . 2.1400000000000001 109.77 -179.91 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 344' ' ' LEU . . . . . . . . . . . . . 55.8 mt -62.73 -26.87 68.9 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.329 -0.857 . . . . 0.22 109.7 179.983 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 345' ' ' ASN . . . . . . . . . . . . . 13.2 t-20 -58.0 -58.54 7.96 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.281 -0.887 . . . . 1.0800000000000001 109.501 -179.957 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 346' ' ' GLU . . . . . . . . . . . . . 10.0 tp10 -62.2 -28.88 69.99 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.456 -0.778 . . . . 2.21 109.722 -179.667 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 347' ' ' ALA . . . . . 0.675 ' HB1' ' HB1' ' D' ' 347' ' ' ALA . . . -60.7 -57.79 11.21 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.103 -0.998 . . . . 0.17999999999999999 109.984 -179.72 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' C' C ' 348' ' ' LEU . . . . . 0.526 ' N ' HD22 ' C' ' 348' ' ' LEU . 3.5 mm? -62.5 -45.8 91.35 Favored 'General case' 0 N--CA 1.494 1.761 0 O-C-N 121.096 -1.002 . . . . 0.32000000000000001 110.044 -179.494 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' C' C ' 349' ' ' GLU . . . . . . . . . . . . . 1.3 mm-40 -55.02 -36.02 65.04 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.276 -0.89 . . . . 2.1899999999999999 109.886 -179.223 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 350' ' ' LEU . . . . . 0.598 HD22 HD13 ' D' ' 350' ' ' LEU . 7.0 tt -63.46 -46.88 84.22 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.355 -0.841 . . . . 0.46000000000000002 109.894 -179.632 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' C' C ' 351' ' ' LYS . . . . . . . . . . . . . 22.8 tttt -58.32 -40.24 81.55 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.355 -0.841 . . . . 1.3500000000000001 109.672 -179.66 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 352' ' ' ASP . . . . . . . . . . . . . 52.0 m-20 -57.12 -51.69 68.29 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.361 -0.837 . . . . 1.1899999999999999 109.925 179.993 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 353' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 1.538 0 O-C-N 121.154 -0.966 . . . . 0.56999999999999995 109.923 -179.233 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' D' D ' 326' ' ' GLU . . . . . . . . . . . . . 38.1 mm-40 . . . . . 0 N--CA 1.491 1.575 0 N-CA-C 109.237 -0.653 . . . . 2.1299999999999999 109.237 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' D' D ' 327' ' ' TYR . . . . . 0.425 ' CD1' ' HG2' ' B' ' 333' ' ' ARG . 49.0 m-85 -149.67 111.92 4.67 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.22 -0.925 . . . . 0.46999999999999997 109.553 179.977 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' D' D ' 328' ' ' PHE . . . . . 0.422 ' O ' HG23 ' D' ' 329' ' ' THR . 50.6 m-85 -112.12 -170.12 1.6 Allowed 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.265 -0.897 . . . . 0.29999999999999999 109.206 179.856 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' D' D ' 329' ' ' THR . . . . . 0.46 ' HA ' ' O ' ' B' ' 330' ' ' LEU . 9.8 p -153.2 175.7 12.76 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.231 -0.918 . . . . 0.22 109.147 -179.85 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' D' D ' 330' ' ' LEU . . . . . . . . . . . . . 26.0 tp -151.63 134.03 15.35 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.116 -0.99 . . . . 0.28000000000000003 109.631 -179.762 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' D' D ' 331' ' ' GLN . . . . . . . . . . . . . 1.9 tp60 -85.81 110.28 19.26 Favored 'General case' 0 N--CA 1.488 1.454 0 O-C-N 121.248 -0.907 . . . . 0.93000000000000005 109.31 179.88 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' D' D ' 332' ' ' ILE . . . . . 0.853 HG21 ' HA ' ' D' ' 338' ' ' PHE . 86.1 mt -102.85 103.37 14.97 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.573 0 O-C-N 121.226 -0.921 . . . . 0.25 109.541 -179.819 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' D' D ' 333' ' ' ARG . . . . . . . . . . . . . 84.9 mtt180 -73.09 143.31 47.44 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.25 -0.906 . . . . 2.9300000000000002 109.498 179.81 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' D' D ' 334' ' ' GLY . . . . . . . . . . . . . . . 89.16 131.65 4.22 Favored Glycine 0 N--CA 1.49 2.278 0 N-CA-C 109.49 -1.444 . . . . 0.40999999999999998 109.49 -179.907 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' D' D ' 335' ' ' ARG . . . . . . . . . . . . . 55.9 ttt180 -79.77 -41.71 26.01 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.352 -1.087 . . . . 3.0299999999999998 109.835 -179.672 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' D' D ' 336' ' ' GLU . . . . . . . . . . . . . 2.8 tt0 -58.26 -58.73 7.19 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.25 -0.906 . . . . 2.2599999999999998 109.736 -179.724 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' D' D ' 337' ' ' ARG . . . . . 0.954 ' NH2' HD12 ' B' ' 348' ' ' LEU . 0.9 OUTLIER -59.75 -33.25 71.42 Favored 'General case' 0 N--CA 1.489 1.478 0 O-C-N 121.28 -0.887 . . . . 2.9199999999999999 109.354 -179.965 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' D' D ' 338' ' ' PHE . . . . . 0.853 ' HA ' HG21 ' D' ' 332' ' ' ILE . 45.7 t80 -55.5 -57.03 13.57 Favored 'General case' 0 N--CA 1.489 1.478 0 O-C-N 121.22 -0.925 . . . . 0.37 109.435 179.978 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' D' D ' 339' ' ' GLU . . . . . . . . . . . . . 45.3 mt-10 -51.25 -31.37 20.69 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.229 -0.919 . . . . 1.99 109.726 -179.856 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' D' D ' 340' ' ' MET . . . . . . . . . . . . . 5.3 ttp -62.59 -53.96 46.8 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.223 -0.923 . . . . 0.31 109.859 -179.576 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' D' D ' 341' ' ' PHE . . . . . . . . . . . . . 40.2 m-85 -61.74 -43.38 98.97 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.145 -0.972 . . . . 0.17999999999999999 109.692 -179.727 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' D' D ' 342' ' ' ARG . . . . . 0.441 ' CG ' HH11 ' D' ' 342' ' ' ARG . 0.1 OUTLIER -49.51 -41.13 40.14 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.268 -0.895 . . . . 2.4100000000000001 109.608 -179.789 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' D' D ' 343' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -59.36 -48.0 83.3 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.293 -0.88 . . . . 2.3500000000000001 109.647 -179.862 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' D' D ' 344' ' ' LEU . . . . . . . . . . . . . 57.4 mt -61.99 -30.94 71.28 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.171 -0.956 . . . . 0.19 109.815 -179.777 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' D' D ' 345' ' ' ASN . . . . . . . . . . . . . 10.6 t-20 -57.91 -57.4 12.98 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.157 -0.964 . . . . 1.0900000000000001 109.559 -179.913 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' D' D ' 346' ' ' GLU . . . . . . . . . . . . . 60.3 tt0 -61.55 -26.63 68.07 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.104 -0.997 . . . . 1.6899999999999999 109.543 -179.854 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' D' D ' 347' ' ' ALA . . . . . 0.675 ' HB1' ' HB1' ' C' ' 347' ' ' ALA . . . -60.94 -61.58 2.48 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.137 -0.977 . . . . 0.17999999999999999 110.136 -179.784 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' D' D ' 348' ' ' LEU . . . . . 0.609 HD12 ' CZ ' ' B' ' 337' ' ' ARG . 4.2 mm? -60.03 -44.13 94.83 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.164 -0.96 . . . . 0.31 109.946 -179.495 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' D' D ' 349' ' ' GLU . . . . . . . . . . . . . 92.8 mt-10 -58.08 -33.1 68.7 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.067 -1.02 . . . . 1.95 109.851 -179.542 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' D' D ' 350' ' ' LEU . . . . . 0.598 HD13 HD22 ' C' ' 350' ' ' LEU . 5.9 tt -63.52 -45.99 88.08 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.201 -0.937 . . . . 0.42999999999999999 109.352 -179.975 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' D' D ' 351' ' ' LYS . . . . . . . . . . . . . 88.1 tttt -59.68 -41.61 91.08 Favored 'General case' 0 N--CA 1.488 1.456 0 O-C-N 121.298 -0.876 . . . . 1.3999999999999999 109.383 179.957 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' D' D ' 352' ' ' ASP . . . . . . . . . . . . . 20.9 m-20 -58.17 -40.42 81.41 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.399 -0.813 . . . . 1.1699999999999999 109.881 179.955 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' D' D ' 353' ' ' ALA . . . . . . . . . . . . . . . -67.56 -20.86 65.45 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.203 -0.936 . . . . 0.58999999999999997 109.602 -179.39 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' D' D ' 354' ' ' GLN . . . . . . . . . . . . . 5.6 tt0 . . . . . 0 N--CA 1.49 1.55 0 O-C-N 121.1 -1.0 . . . . 1.4399999999999999 109.169 179.708 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 326' ' ' GLU . . . . . . . . . . . . . 2.9 mm-40 . . . . . 0 N--CA 1.49 1.566 0 N-CA-C 109.343 -0.614 . . . . 2.1299999999999999 109.343 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 327' ' ' TYR . . . . . . . . . . . . . 44.0 m-85 -149.61 112.21 4.76 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.24 -0.912 . . . . 0.47999999999999998 109.643 179.994 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 328' ' ' PHE . . . . . 0.496 ' CE2' ' HB2' ' C' ' 335' ' ' ARG . 95.9 m-85 -114.26 -168.07 1.31 Allowed 'General case' 0 N--CA 1.488 1.465 0 O-C-N 121.236 -0.915 . . . . 0.31 109.316 179.957 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 329' ' ' THR . . . . . . . . . . . . . 40.2 p -152.77 162.14 41.65 Favored 'General case' 0 N--CA 1.489 1.482 0 O-C-N 121.284 -0.885 . . . . 0.22 109.575 179.927 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 330' ' ' LEU . . . . . 0.54 HD21 ' HB2' ' C' ' 345' ' ' ASN . 18.4 tp -150.58 130.52 13.38 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.375 -0.828 . . . . 0.28000000000000003 109.433 -179.958 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 331' ' ' GLN . . . . . 0.418 ' HG3' ' O ' ' C' ' 328' ' ' PHE . 1.5 tt0 -86.81 118.38 26.17 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.265 -0.897 . . . . 0.91000000000000003 109.439 179.903 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 332' ' ' ILE . . . . . 0.584 HD12 ' CD1' ' A' ' 338' ' ' PHE . 9.9 mt -103.46 110.6 30.39 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.527 0 O-C-N 121.286 -0.884 . . . . 0.26000000000000001 109.673 179.988 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 333' ' ' ARG . . . . . 0.572 ' HG2' ' CE2' ' C' ' 327' ' ' TYR . 44.7 mtt180 -72.92 149.31 43.52 Favored 'General case' 0 C--N 1.303 -1.448 0 O-C-N 121.373 -0.83 . . . . 2.9199999999999999 109.238 179.728 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 334' ' ' GLY . . . . . . . . . . . . . . . 85.65 129.65 2.29 Favored Glycine 0 N--CA 1.49 2.251 0 N-CA-C 109.619 -1.392 . . . . 0.40000000000000002 109.619 -179.982 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 335' ' ' ARG . . . . . 0.44 ' O ' ' HB3' ' A' ' 338' ' ' PHE . 31.5 ttp180 -78.92 -44.52 22.45 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.361 -1.082 . . . . 3.0099999999999998 109.758 -179.92 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 336' ' ' GLU . . . . . . . . . . . . . 1.3 tt0 -58.7 -57.34 13.45 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.231 -0.918 . . . . 2.29 109.717 -179.743 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 337' ' ' ARG . . . . . 0.455 ' NH1' ' CG ' ' A' ' 337' ' ' ARG . 0.0 OUTLIER -59.21 -31.3 68.91 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.278 -0.889 . . . . 2.9300000000000002 109.523 -179.83 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 338' ' ' PHE . . . . . 0.584 ' CD1' HD12 ' A' ' 332' ' ' ILE . 60.2 t80 -54.74 -55.86 25.42 Favored 'General case' 0 N--CA 1.489 1.48 0 O-C-N 121.114 -0.991 . . . . 0.38 109.442 179.993 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 339' ' ' GLU . . . . . . . . . . . . . 13.7 mt-10 -51.41 -35.31 38.58 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.196 -0.94 . . . . 1.97 109.903 -179.798 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 340' ' ' MET . . . . . . . . . . . . . 26.2 ttp -63.11 -50.04 72.06 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.222 -0.923 . . . . 0.31 110.068 -179.474 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 341' ' ' PHE . . . . . 0.482 ' HZ ' HD23 ' C' ' 348' ' ' LEU . 41.1 m-85 -61.21 -46.16 91.6 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.12 -0.988 . . . . 0.17999999999999999 109.561 -179.806 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 342' ' ' ARG . . . . . 0.47 ' CG ' ' NH1' ' A' ' 342' ' ' ARG . 0.0 OUTLIER -51.03 -37.55 45.95 Favored 'General case' 0 C--N 1.301 -1.506 0 O-C-N 121.278 -0.889 . . . . 2.4199999999999999 109.627 -179.933 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 343' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -59.49 -51.7 68.74 Favored 'General case' 0 N--CA 1.489 1.483 0 O-C-N 121.257 -0.902 . . . . 2.3500000000000001 109.694 -179.488 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 344' ' ' LEU . . . . . 0.941 HD22 HD22 ' B' ' 344' ' ' LEU . 53.6 mt -60.9 -33.78 73.65 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.308 -0.87 . . . . 0.17999999999999999 109.375 179.984 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 345' ' ' ASN . . . . . 0.666 ' HB2' HD21 ' C' ' 330' ' ' LEU . 28.5 t-20 -57.95 -56.31 23.6 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.233 -0.917 . . . . 1.0900000000000001 109.802 -179.984 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 346' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -61.39 -32.79 72.73 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.278 -0.889 . . . . 1.6499999999999999 110.034 -179.56 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 347' ' ' ALA . . . . . 0.627 ' HB1' ' HB1' ' B' ' 347' ' ' ALA . . . -58.75 -55.1 39.41 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.061 -1.024 . . . . 0.17999999999999999 109.948 -179.773 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 348' ' ' LEU . . . . . 0.536 HD22 ' N ' ' A' ' 348' ' ' LEU . 4.1 mm? -60.61 -46.45 90.21 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.125 -0.985 . . . . 0.29999999999999999 109.594 -179.717 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 349' ' ' GLU . . . . . 0.491 ' HG2' ' NH1' ' C' ' 333' ' ' ARG . 1.7 mt-10 -58.11 -29.87 65.83 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.128 -0.982 . . . . 1.9399999999999999 110.02 -179.648 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 350' ' ' LEU . . . . . 0.629 HD23 ' C ' ' A' ' 350' ' ' LEU . 6.4 tt -64.09 -48.98 74.06 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.028 -1.045 . . . . 0.46000000000000002 109.173 179.774 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 351' ' ' LYS . . . . . . . . . . . . . 19.3 tttt -58.98 -41.79 88.45 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.421 -0.799 . . . . 1.3999999999999999 109.447 179.833 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 352' ' ' ASP . . . . . . . . . . . . . 15.1 m-20 -56.7 -39.23 73.48 Favored 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.399 -0.813 . . . . 1.1599999999999999 109.537 -179.947 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 353' ' ' ALA . . . . . . . . . . . . . . . -66.73 -32.63 74.05 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.294 -0.879 . . . . 0.63 109.611 -179.875 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 354' ' ' GLN . . . . . . . . . . . . . 7.2 tt0 . . . . . 0 C--N 1.303 -1.451 0 O-C-N 121.23 -0.919 . . . . 1.47 109.629 -179.989 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' B' B ' 326' ' ' GLU . . . . . . . . . . . . . 3.0 mm-40 . . . . . 0 N--CA 1.49 1.537 0 N-CA-C 109.372 -0.603 . . . . 2.1299999999999999 109.372 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' B' B ' 327' ' ' TYR . . . . . 0.562 ' CE1' ' HG2' ' D' ' 333' ' ' ARG . 42.7 m-85 -149.1 111.57 4.73 Favored 'General case' 0 N--CA 1.488 1.458 0 O-C-N 121.254 -0.904 . . . . 0.47999999999999998 109.62 -179.834 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 328' ' ' PHE . . . . . 0.542 ' CE2' ' HA ' ' D' ' 335' ' ' ARG . 95.3 m-85 -113.72 -167.65 1.23 Allowed 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.245 -0.909 . . . . 0.32000000000000001 109.415 179.904 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 329' ' ' THR . . . . . . . . . . . . . 38.9 p -153.5 161.35 42.33 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.174 -0.954 . . . . 0.23000000000000001 109.601 -179.642 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 330' ' ' LEU . . . . . 0.625 HD21 ' HB2' ' D' ' 345' ' ' ASN . 16.3 tp -150.41 131.46 14.36 Favored 'General case' 0 N--CA 1.488 1.432 0 O-C-N 121.235 -0.916 . . . . 0.28000000000000003 109.249 179.932 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 331' ' ' GLN . . . . . . . . . . . . . 1.5 tt0 -87.25 118.58 26.77 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.368 -0.832 . . . . 0.91000000000000003 109.495 -179.917 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 332' ' ' ILE . . . . . 0.576 HD12 ' CD1' ' B' ' 338' ' ' PHE . 10.8 mt -103.59 110.14 29.13 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.496 0 O-C-N 121.166 -0.959 . . . . 0.23999999999999999 109.7 -179.798 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 333' ' ' ARG . . . . . 0.499 ' HG2' ' CE1' ' D' ' 327' ' ' TYR . 46.6 mtt180 -72.65 148.81 44.42 Favored 'General case' 0 N--CA 1.487 1.381 0 O-C-N 121.19 -0.944 . . . . 2.9300000000000002 109.323 179.585 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 334' ' ' GLY . . . . . . . . . . . . . . . 86.17 129.4 2.43 Favored Glycine 0 N--CA 1.49 2.277 0 N-CA-C 109.553 -1.419 . . . . 0.40000000000000002 109.553 179.848 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 335' ' ' ARG . . . . . 0.463 ' O ' ' HB3' ' B' ' 338' ' ' PHE . 31.8 ttp180 -78.5 -45.11 22.78 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.242 -1.152 . . . . 3.0099999999999998 110.016 -179.844 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 336' ' ' GLU . . . . . . . . . . . . . 1.3 tt0 -58.45 -56.86 16.66 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.153 -0.967 . . . . 2.2799999999999998 109.651 -179.706 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 337' ' ' ARG . . . . . 0.434 ' CG ' HH11 ' B' ' 337' ' ' ARG . 0.0 OUTLIER -59.09 -31.4 68.87 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.294 -0.879 . . . . 2.9300000000000002 109.544 -179.793 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' B' B ' 338' ' ' PHE . . . . . 0.576 ' CD1' HD12 ' B' ' 332' ' ' ILE . 60.9 t80 -55.02 -55.82 26.62 Favored 'General case' 0 N--CA 1.488 1.441 0 O-C-N 121.33 -0.856 . . . . 0.37 109.417 179.971 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 339' ' ' GLU . . . . . . . . . . . . . 15.4 mt-10 -51.74 -34.96 41.53 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.333 -0.855 . . . . 1.98 109.789 -179.882 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 340' ' ' MET . . . . . . . . . . . . . 28.8 ttp -63.2 -50.57 69.78 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.105 -0.997 . . . . 0.32000000000000001 109.909 -179.641 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 341' ' ' PHE . . . . . 0.458 ' HB2' HD13 ' B' ' 332' ' ' ILE . 42.7 m-85 -60.62 -46.32 90.72 Favored 'General case' 0 N--CA 1.494 1.725 0 O-C-N 121.079 -1.013 . . . . 0.17999999999999999 109.842 -179.906 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 342' ' ' ARG . . . . . 0.465 ' CG ' ' NH1' ' B' ' 342' ' ' ARG . 0.0 OUTLIER -50.86 -38.07 47.13 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.219 -0.926 . . . . 2.4199999999999999 109.651 -179.862 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' B' B ' 343' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -58.8 -51.83 68.32 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.239 -0.913 . . . . 2.3500000000000001 109.76 -179.823 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 344' ' ' LEU . . . . . 0.941 HD22 HD22 ' A' ' 344' ' ' LEU . 52.6 mt -61.39 -32.94 72.88 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.182 -0.949 . . . . 0.17999999999999999 109.53 -179.839 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 345' ' ' ASN . . . . . 0.517 ' HB2' HD21 ' D' ' 330' ' ' LEU . 28.8 t-20 -58.48 -56.58 20.23 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.301 -0.874 . . . . 1.0900000000000001 109.573 -179.996 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 346' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -61.31 -32.12 71.97 Favored 'General case' 0 C--N 1.301 -1.54 0 O-C-N 121.417 -0.802 . . . . 1.6599999999999999 110.086 -179.52 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 347' ' ' ALA . . . . . 0.627 ' HB1' ' HB1' ' A' ' 347' ' ' ALA . . . -59.15 -55.18 38.32 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.246 -0.909 . . . . 0.17000000000000001 109.914 -179.577 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 348' ' ' LEU . . . . . 0.528 HD22 ' N ' ' B' ' 348' ' ' LEU . 4.1 mm? -60.61 -45.71 93.0 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.252 -0.905 . . . . 0.28999999999999998 109.856 -179.717 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 349' ' ' GLU . . . . . . . . . . . . . 1.8 mt-10 -58.74 -29.84 67.04 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.137 -0.977 . . . . 1.95 109.762 -179.482 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 350' ' ' LEU . . . . . 0.602 HD23 ' C ' ' B' ' 350' ' ' LEU . 6.4 tt -64.11 -48.87 74.42 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.26 -0.9 . . . . 0.45000000000000001 109.159 179.651 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 351' ' ' LYS . . . . . . . . . . . . . 19.4 tttt -59.54 -41.67 90.59 Favored 'General case' 0 C--N 1.302 -1.462 0 O-C-N 121.348 -0.845 . . . . 1.3799999999999999 109.437 179.966 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 352' ' ' ASP . . . . . . . . . . . . . 16.7 m-20 -56.55 -39.13 72.91 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.217 -0.927 . . . . 1.1599999999999999 109.515 179.8 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 353' ' ' ALA . . . . . . . . . . . . . . . -66.76 -33.31 75.35 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.253 -0.904 . . . . 0.60999999999999999 109.759 -179.91 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 354' ' ' GLN . . . . . . . . . . . . . 7.4 tt0 . . . . . 0 N--CA 1.489 1.484 0 O-C-N 121.239 -0.913 . . . . 1.45 109.491 179.927 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' C' C ' 326' ' ' GLU . . . . . . . . . . . . . 16.1 mm-40 . . . . . 0 N--CA 1.488 1.458 0 CA-C-O 121.227 0.537 . . . . 2.1699999999999999 109.56 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' C' C ' 327' ' ' TYR . . . . . 0.572 ' CE2' ' HG2' ' A' ' 333' ' ' ARG . 46.4 m-85 -148.89 111.85 4.87 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.269 -0.895 . . . . 0.47999999999999998 109.799 -179.978 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' C' C ' 328' ' ' PHE . . . . . 0.449 ' O ' HG23 ' C' ' 329' ' ' THR . 93.5 m-85 -111.12 -167.03 1.13 Allowed 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.236 -0.915 . . . . 0.33000000000000002 109.538 -179.924 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' C' C ' 329' ' ' THR . . . . . 0.449 HG23 ' O ' ' C' ' 328' ' ' PHE . 10.8 p -154.11 167.53 29.53 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.283 -0.886 . . . . 0.23000000000000001 109.705 -179.434 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' C' C ' 330' ' ' LEU . . . . . 0.666 HD21 ' HB2' ' A' ' 345' ' ' ASN . 20.2 tp -152.5 132.06 13.04 Favored 'General case' 0 N--CA 1.489 1.525 0 O-C-N 121.15 -0.969 . . . . 0.28000000000000003 109.89 179.886 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' C' C ' 331' ' ' GLN . . . . . . . . . . . . . 1.2 tt0 -89.23 116.96 27.85 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.337 -0.852 . . . . 1.48 109.428 179.79 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 332' ' ' ILE . . . . . 0.565 HG21 ' HA ' ' C' ' 338' ' ' PHE . 59.9 mt -103.85 115.96 46.74 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.783 0 O-C-N 121.151 -0.968 . . . . 0.23999999999999999 109.805 -179.892 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' C' C ' 333' ' ' ARG . . . . . 0.491 ' NH1' ' HG2' ' A' ' 349' ' ' GLU . 0.1 OUTLIER -75.06 144.87 42.77 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.258 -0.901 . . . . 2.7400000000000002 109.727 179.684 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' C' C ' 334' ' ' GLY . . . . . . . . . . . . . . . 82.53 123.7 0.79 Allowed Glycine 0 N--CA 1.491 2.36 0 C-N-CA 120.005 -1.093 . . . . 0.34999999999999998 110.472 179.307 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 335' ' ' ARG . . . . . 0.504 ' NH1' ' HG2' ' C' ' 335' ' ' ARG . 0.4 OUTLIER -73.4 -31.19 63.73 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.372 -1.075 . . . . 2.5299999999999998 109.034 179.438 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' C' C ' 336' ' ' GLU . . . . . 0.459 ' OE1' ' HG3' ' C' ' 337' ' ' ARG . 14.1 tm-20 -59.29 -63.57 1.26 Allowed 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.277 -0.889 . . . . 2.6200000000000001 109.052 179.747 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' C' C ' 337' ' ' ARG . . . . . 0.459 ' HG3' ' OE1' ' C' ' 336' ' ' GLU . 4.0 mtt180 -60.75 -26.21 67.05 Favored 'General case' 0 N--CA 1.487 1.422 0 O-C-N 121.308 -0.87 . . . . 2.8100000000000001 109.358 179.65 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' C' C ' 338' ' ' PHE . . . . . 0.565 ' HA ' HG21 ' C' ' 332' ' ' ILE . 86.4 t80 -54.86 -62.2 1.81 Allowed 'General case' 0 C--N 1.305 -1.344 0 O-C-N 121.279 -0.888 . . . . 0.40000000000000002 109.379 -179.97 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' C' C ' 339' ' ' GLU . . . . . . . . . . . . . 34.2 mt-10 -51.1 -31.58 19.71 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.227 -0.921 . . . . 2.0499999999999998 110.032 -179.587 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 340' ' ' MET . . . . . 0.434 ' HB3' ' O ' ' C' ' 337' ' ' ARG . 7.1 ttp -63.93 -53.54 48.77 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.213 -0.929 . . . . 0.32000000000000001 109.841 -179.756 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' C' C ' 341' ' ' PHE . . . . . 0.442 ' HB2' HD13 ' C' ' 332' ' ' ILE . 33.5 m-85 -61.19 -42.53 98.75 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.194 -0.941 . . . . 0.17999999999999999 109.815 -179.661 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' C' C ' 342' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -46.6 -43.57 17.45 Favored 'General case' 0 C--N 1.301 -1.519 0 O-C-N 121.187 -0.946 . . . . 2.9100000000000001 109.496 -179.823 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' C' C ' 343' ' ' GLU . . . . . . . . . . . . . 15.8 tp10 -61.45 -40.28 93.9 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 120.988 -1.07 . . . . 2.1400000000000001 109.635 179.884 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 344' ' ' LEU . . . . . 0.553 ' CD2' HD22 ' D' ' 344' ' ' LEU . 43.6 mt -63.31 -52.93 59.89 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.156 -0.965 . . . . 0.22 109.77 -179.756 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' C' C ' 345' ' ' ASN . . . . . 0.54 ' HB2' HD21 ' A' ' 330' ' ' LEU . 0.8 OUTLIER -53.86 -44.91 70.76 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.277 -0.889 . . . . 1.0800000000000001 109.656 -179.759 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' C' C ' 346' ' ' GLU . . . . . . . . . . . . . 3.2 tp10 -62.17 -37.58 85.81 Favored 'General case' 0 N--CA 1.488 1.435 0 O-C-N 121.209 -0.932 . . . . 2.21 109.823 -179.93 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 347' ' ' ALA . . . . . 0.721 ' HB1' ' HB1' ' D' ' 347' ' ' ALA . . . -59.35 -47.59 84.86 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.184 -0.948 . . . . 0.17999999999999999 109.516 -179.662 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' C' C ' 348' ' ' LEU . . . . . 0.541 ' N ' HD22 ' C' ' 348' ' ' LEU . 3.9 mm? -63.66 -42.72 98.05 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.258 -0.901 . . . . 0.32000000000000001 109.706 179.933 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' C' C ' 349' ' ' GLU . . . . . 0.404 ' OE1' ' CZ ' ' A' ' 333' ' ' ARG . 5.4 mm-40 -57.54 -39.14 75.95 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.046 -1.034 . . . . 2.1899999999999999 109.341 179.996 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' C' C ' 350' ' ' LEU . . . . . 0.626 HD22 HD13 ' D' ' 350' ' ' LEU . 6.4 tt -61.31 -43.71 98.42 Favored 'General case' 0 N--CA 1.488 1.458 0 O-C-N 121.539 -0.726 . . . . 0.46000000000000002 109.323 -179.992 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' C' C ' 351' ' ' LYS . . . . . . . . . . . . . 8.9 tttp -60.96 -41.91 97.25 Favored 'General case' 0 C--N 1.304 -1.395 0 O-C-N 121.116 -0.99 . . . . 1.3500000000000001 109.085 179.867 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 352' ' ' ASP . . . . . . . . . . . . . 77.2 m-20 -52.76 -58.15 7.81 Favored 'General case' 0 N--CA 1.488 1.449 0 O-C-N 121.382 -0.824 . . . . 1.1899999999999999 109.239 179.898 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 353' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 1.478 0 O-C-N 121.276 -0.89 . . . . 0.56999999999999995 109.457 -179.956 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' D' D ' 326' ' ' GLU . . . . . . . . . . . . . 3.3 mm-40 . . . . . 0 N--CA 1.49 1.561 0 N-CA-C 109.348 -0.612 . . . . 2.1299999999999999 109.348 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' D' D ' 327' ' ' TYR . . . . . 0.499 ' CE1' ' HG2' ' B' ' 333' ' ' ARG . 43.3 m-85 -149.75 111.37 4.51 Favored 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.012 -1.055 . . . . 0.46999999999999997 109.436 179.959 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' D' D ' 328' ' ' PHE . . . . . 0.453 ' CE2' ' HA ' ' B' ' 335' ' ' ARG . 97.1 m-85 -113.4 -167.67 1.23 Allowed 'General case' 0 N--CA 1.488 1.472 0 O-C-N 121.375 -0.828 . . . . 0.29999999999999999 109.184 -179.791 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' D' D ' 329' ' ' THR . . . . . . . . . . . . . 37.9 p -153.55 161.68 41.98 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.209 -0.932 . . . . 0.22 109.464 -179.957 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' D' D ' 330' ' ' LEU . . . . . 0.517 HD21 ' HB2' ' B' ' 345' ' ' ASN . 17.7 tp -150.48 130.89 13.78 Favored 'General case' 0 N--CA 1.488 1.474 0 O-C-N 121.464 -0.773 . . . . 0.28000000000000003 109.473 -179.9 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' D' D ' 331' ' ' GLN . . . . . 0.435 ' HG3' ' O ' ' B' ' 328' ' ' PHE . 1.6 tt0 -86.69 119.87 27.38 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.017 -1.052 . . . . 0.93000000000000005 109.325 179.835 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' D' D ' 332' ' ' ILE . . . . . 0.574 HD12 ' CD1' ' D' ' 338' ' ' PHE . 12.4 mt -104.4 109.58 27.86 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.564 0 O-C-N 121.094 -1.004 . . . . 0.25 109.636 -179.894 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' D' D ' 333' ' ' ARG . . . . . 0.562 ' HG2' ' CE1' ' B' ' 327' ' ' TYR . 46.1 mtt180 -72.28 149.97 44.01 Favored 'General case' 0 C--N 1.302 -1.465 0 O-C-N 121.106 -0.996 . . . . 2.9300000000000002 109.209 179.827 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' D' D ' 334' ' ' GLY . . . . . . . . . . . . . . . 85.53 129.63 2.25 Favored Glycine 0 N--CA 1.493 2.486 0 N-CA-C 109.645 -1.382 . . . . 0.40999999999999998 109.645 -179.911 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' D' D ' 335' ' ' ARG . . . . . 0.542 ' HA ' ' CE2' ' B' ' 328' ' ' PHE . 32.2 ttp180 -78.82 -45.96 19.75 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.007 -1.29 . . . . 3.0299999999999998 109.647 179.898 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' D' D ' 336' ' ' GLU . . . . . . . . . . . . . 1.3 tt0 -57.65 -56.63 19.48 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.101 -0.999 . . . . 2.2599999999999998 109.665 -179.821 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' D' D ' 337' ' ' ARG . . . . . 0.422 ' CG ' ' NH1' ' D' ' 337' ' ' ARG . 0.0 OUTLIER -59.32 -31.2 68.94 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.159 -0.963 . . . . 2.9199999999999999 109.669 -179.769 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' D' D ' 338' ' ' PHE . . . . . 0.574 ' CD1' HD12 ' D' ' 332' ' ' ILE . 61.2 t80 -55.26 -54.98 36.69 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.292 -0.88 . . . . 0.37 109.532 179.923 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' D' D ' 339' ' ' GLU . . . . . . . . . . . . . 17.1 mt-10 -52.36 -34.62 48.47 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.197 -0.94 . . . . 1.99 109.756 -179.687 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' D' D ' 340' ' ' MET . . . . . . . . . . . . . 31.1 ttp -63.52 -49.92 71.61 Favored 'General case' 0 N--CA 1.488 1.466 0 O-C-N 121.23 -0.919 . . . . 0.31 109.966 -179.616 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' D' D ' 341' ' ' PHE . . . . . 0.456 ' HB2' HD13 ' D' ' 332' ' ' ILE . 42.1 m-85 -61.37 -47.05 87.63 Favored 'General case' 0 N--CA 1.488 1.467 0 O-C-N 121.108 -0.995 . . . . 0.17999999999999999 109.551 -179.687 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' D' D ' 342' ' ' ARG . . . . . 0.459 ' CG ' ' NH1' ' D' ' 342' ' ' ARG . 0.0 OUTLIER -50.24 -37.87 37.78 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.175 -0.953 . . . . 2.4100000000000001 109.86 -179.876 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' D' D ' 343' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -59.07 -51.58 69.42 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.303 -0.873 . . . . 2.3500000000000001 109.673 -179.701 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' D' D ' 344' ' ' LEU . . . . . 0.553 HD22 ' CD2' ' C' ' 344' ' ' LEU . 56.1 mt -61.52 -33.03 73.12 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.191 -0.943 . . . . 0.19 109.455 179.959 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' D' D ' 345' ' ' ASN . . . . . 0.625 ' HB2' HD21 ' B' ' 330' ' ' LEU . 29.3 t-20 -58.38 -56.29 24.01 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.258 -0.901 . . . . 1.0900000000000001 109.718 179.932 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' D' D ' 346' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -61.63 -32.61 72.76 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.421 -0.8 . . . . 1.6899999999999999 109.92 -179.634 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' D' D ' 347' ' ' ALA . . . . . 0.721 ' HB1' ' HB1' ' C' ' 347' ' ' ALA . . . -58.4 -55.22 37.86 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.053 -1.029 . . . . 0.17999999999999999 109.827 -179.701 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' D' D ' 348' ' ' LEU . . . . . 0.531 HD22 ' N ' ' D' ' 348' ' ' LEU . 4.2 mm? -61.02 -46.47 90.62 Favored 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.17 -0.956 . . . . 0.31 109.844 -179.46 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' D' D ' 349' ' ' GLU . . . . . 0.42 ' OE2' ' ND2' ' D' ' 345' ' ' ASN . 1.8 mt-10 -57.85 -29.89 65.36 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.184 -0.947 . . . . 1.95 109.736 -179.582 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' D' D ' 350' ' ' LEU . . . . . 0.626 HD13 HD22 ' C' ' 350' ' ' LEU . 6.3 tt -63.88 -49.37 72.97 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.099 -1.001 . . . . 0.42999999999999999 109.292 179.853 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' D' D ' 351' ' ' LYS . . . . . . . . . . . . . 19.8 tttt -59.19 -42.14 90.15 Favored 'General case' 0 C--N 1.303 -1.449 0 O-C-N 121.47 -0.769 . . . . 1.3999999999999999 109.403 179.78 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' D' D ' 352' ' ' ASP . . . . . . . . . . . . . 17.8 m-20 -56.1 -38.85 71.3 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.396 -0.815 . . . . 1.1699999999999999 109.562 179.601 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' D' D ' 353' ' ' ALA . . . . . . . . . . . . . . . -67.19 -33.49 75.5 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.116 -0.99 . . . . 0.58999999999999997 109.608 -179.909 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' D' D ' 354' ' ' GLN . . . . . . . . . . . . . 7.6 tt0 . . . . . 0 N--CA 1.488 1.475 0 O-C-N 121.131 -0.98 . . . . 1.4399999999999999 109.497 -179.934 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 326' ' ' GLU . . . . . . . . . . . . . 3.0 mt-10 . . . . . 0 N--CA 1.488 1.454 0 N-CA-C 109.07 -0.715 . . . . 2.1299999999999999 109.07 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 327' ' ' TYR . . . . . . . . . . . . . 47.3 m-85 -148.83 111.4 4.75 Favored 'General case' 0 N--CA 1.489 1.476 0 O-C-N 121.256 -0.902 . . . . 0.47999999999999998 109.527 -179.835 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 328' ' ' PHE . . . . . 0.411 ' CE2' ' HA ' ' C' ' 335' ' ' ARG . 86.4 m-85 -113.87 -168.47 1.35 Allowed 'General case' 0 N--CA 1.488 1.451 0 O-C-N 121.347 -0.845 . . . . 0.31 109.532 -179.808 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 329' ' ' THR . . . . . 0.459 ' HA ' ' O ' ' C' ' 330' ' ' LEU . 24.4 p -153.56 165.21 36.61 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.346 -0.846 . . . . 0.22 109.078 179.94 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 330' ' ' LEU . . . . . 0.587 HD21 HD22 ' C' ' 345' ' ' ASN . 14.7 tp -151.47 131.33 13.29 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.045 -1.034 . . . . 0.28000000000000003 109.877 -179.803 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 331' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -87.55 120.77 29.19 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.279 -0.888 . . . . 0.91000000000000003 109.165 179.615 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 332' ' ' ILE . . . . . 0.647 HD12 ' CD1' ' A' ' 338' ' ' PHE . 59.6 mt -103.56 111.1 32.0 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.548 0 O-C-N 121.235 -0.916 . . . . 0.26000000000000001 109.664 -179.794 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 333' ' ' ARG . . . . . 0.443 ' CG ' ' NH1' ' A' ' 333' ' ' ARG . 0.0 OUTLIER -72.59 139.56 47.51 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.403 -0.811 . . . . 2.9199999999999999 109.35 179.83 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 334' ' ' GLY . . . . . . . . . . . . . . . 85.76 136.6 4.09 Favored Glycine 0 N--CA 1.49 2.251 0 N-CA-C 109.697 -1.361 . . . . 0.40000000000000002 109.697 179.878 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 335' ' ' ARG . . . . . 0.492 ' HG3' ' NH1' ' A' ' 335' ' ' ARG . 0.3 OUTLIER -80.11 -36.17 35.74 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.405 -1.056 . . . . 3.0099999999999998 109.582 -179.921 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 336' ' ' GLU . . . . . . . . . . . . . 52.2 tt0 -58.58 -57.24 13.84 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.238 -0.914 . . . . 2.29 110.052 -179.634 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 337' ' ' ARG . . . . . 0.552 ' HG3' ' NH1' ' A' ' 337' ' ' ARG . 0.6 OUTLIER -60.0 -30.36 69.09 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.117 -0.989 . . . . 2.9300000000000002 109.815 -179.625 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 338' ' ' PHE . . . . . 0.647 ' CD1' HD12 ' A' ' 332' ' ' ILE . 88.8 t80 -54.34 -62.99 1.29 Allowed 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.214 -0.929 . . . . 0.38 109.756 -179.73 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 339' ' ' GLU . . . . . . . . . . . . . 80.9 mt-10 -51.88 -31.46 28.22 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.211 -0.93 . . . . 1.97 110.205 -179.667 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 340' ' ' MET . . . . . . . . . . . . . 28.0 ttp -63.8 -53.62 47.94 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.134 -0.979 . . . . 0.31 110.121 -179.432 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 341' ' ' PHE . . . . . . . . . . . . . 39.2 m-85 -62.25 -48.59 79.26 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.171 -0.955 . . . . 0.17999999999999999 110.023 -179.533 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 342' ' ' ARG . . . . . . . . . . . . . 70.3 ttt180 -48.85 -38.38 22.17 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.161 -0.962 . . . . 2.4199999999999999 109.858 -179.71 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 343' ' ' GLU . . . . . . . . . . . . . 42.5 tt0 -59.42 -49.45 77.77 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.157 -0.964 . . . . 2.3500000000000001 109.896 -179.705 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 344' ' ' LEU . . . . . 0.458 HD22 ' CD2' ' B' ' 344' ' ' LEU . 42.2 mt -61.32 -37.96 85.14 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.092 -1.005 . . . . 0.17999999999999999 109.714 -179.597 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 345' ' ' ASN . . . . . 0.446 ' HA ' ' CZ ' ' C' ' 341' ' ' PHE . 60.6 t-20 -57.01 -50.37 72.94 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.165 -0.959 . . . . 1.0900000000000001 109.675 -179.936 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 346' ' ' GLU . . . . . . . . . . . . . 2.7 tt0 -60.71 -34.44 74.38 Favored 'General case' 0 N--CA 1.489 1.49 0 O-C-N 121.263 -0.898 . . . . 1.6499999999999999 109.894 -179.755 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 347' ' ' ALA . . . . . 0.878 ' HB1' ' HB1' ' B' ' 347' ' ' ALA . . . -60.84 -51.65 68.42 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.128 -0.982 . . . . 0.17999999999999999 110.047 -179.771 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 348' ' ' LEU . . . . . 0.541 HD22 ' N ' ' A' ' 348' ' ' LEU . 3.9 mm? -61.41 -44.84 96.44 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.165 -0.96 . . . . 0.29999999999999999 110.003 -179.508 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 349' ' ' GLU . . . . . . . . . . . . . 39.3 mt-10 -58.02 -40.58 81.17 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.27 -0.894 . . . . 1.9399999999999999 110.337 -179.281 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 350' ' ' LEU . . . . . 0.614 HD23 ' C ' ' A' ' 350' ' ' LEU . 8.5 tt -63.59 -48.37 77.67 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.16 -0.963 . . . . 0.46000000000000002 109.977 -179.317 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 351' ' ' LYS . . . . . . . . . . . . . 25.3 tttt -55.43 -41.84 73.35 Favored 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.259 -0.901 . . . . 1.3999999999999999 109.329 -179.548 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 352' ' ' ASP . . . . . . . . . . . . . 23.0 m-20 -59.36 -48.32 82.07 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.38 -0.825 . . . . 1.1599999999999999 109.778 179.902 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 353' ' ' ALA . . . . . . . . . . . . . . . -67.49 -9.5 42.82 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.29 -0.881 . . . . 0.63 110.177 -179.419 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 354' ' ' GLN . . . . . . . . . . . . . 2.3 tt0 . . . . . 0 N--CA 1.49 1.56 0 O-C-N 121.051 -1.03 . . . . 1.47 109.628 -179.945 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' B' B ' 326' ' ' GLU . . . . . . . . . . . . . 2.9 mt-10 . . . . . 0 N--CA 1.488 1.465 0 N-CA-C 109.093 -0.706 . . . . 2.1299999999999999 109.093 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' B' B ' 327' ' ' TYR . . . . . . . . . . . . . 47.0 m-85 -148.85 111.41 4.75 Favored 'General case' 0 N--CA 1.488 1.44 0 O-C-N 121.203 -0.935 . . . . 0.47999999999999998 109.531 -179.858 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 328' ' ' PHE . . . . . 0.415 ' CE2' ' HA ' ' D' ' 335' ' ' ARG . 86.3 m-85 -114.01 -168.58 1.37 Allowed 'General case' 0 N--CA 1.489 1.48 0 O-C-N 121.336 -0.852 . . . . 0.32000000000000001 109.53 -179.845 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 329' ' ' THR . . . . . 0.415 ' HA ' ' O ' ' D' ' 330' ' ' LEU . 23.9 p -153.48 165.23 36.51 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.32 -0.862 . . . . 0.23000000000000001 109.146 179.989 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 330' ' ' LEU . . . . . 0.537 HD21 HD22 ' D' ' 345' ' ' ASN . 14.8 tp -151.49 131.26 13.2 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.093 -1.004 . . . . 0.28000000000000003 109.927 -179.739 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 331' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -87.48 120.65 28.99 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.225 -0.922 . . . . 0.91000000000000003 109.166 179.63 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 332' ' ' ILE . . . . . 0.643 HD12 ' CD1' ' B' ' 338' ' ' PHE . 59.7 mt -103.52 111.1 31.96 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.526 0 O-C-N 121.15 -0.969 . . . . 0.23999999999999999 109.722 -179.804 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 333' ' ' ARG . . . . . 0.452 HH11 ' CG ' ' B' ' 333' ' ' ARG . 0.0 OUTLIER -72.53 139.56 47.64 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.254 -0.903 . . . . 2.9300000000000002 109.411 179.852 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' B' B ' 334' ' ' GLY . . . . . . . . . . . . . . . 85.87 136.37 4.08 Favored Glycine 0 N--CA 1.49 2.295 0 N-CA-C 109.655 -1.378 . . . . 0.40000000000000002 109.655 179.861 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 335' ' ' ARG . . . . . 0.5 ' NH1' ' HG3' ' B' ' 335' ' ' ARG . 0.3 OUTLIER -80.03 -36.15 36.2 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.253 -1.145 . . . . 3.0099999999999998 109.579 -179.975 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' B' B ' 336' ' ' GLU . . . . . . . . . . . . . 52.5 tt0 -58.56 -57.21 13.97 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.309 -0.87 . . . . 2.2799999999999998 110.05 -179.719 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 337' ' ' ARG . . . . . 0.54 ' NH1' ' HG3' ' B' ' 337' ' ' ARG . 0.6 OUTLIER -60.04 -30.37 69.14 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.11 -0.994 . . . . 2.9300000000000002 109.826 -179.548 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' B' B ' 338' ' ' PHE . . . . . 0.643 ' CD1' HD12 ' B' ' 332' ' ' ILE . 88.9 t80 -54.4 -62.86 1.38 Allowed 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.222 -0.924 . . . . 0.37 109.833 -179.751 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 339' ' ' GLU . . . . . . . . . . . . . 81.6 mt-10 -51.97 -31.38 28.92 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.235 -0.916 . . . . 1.98 110.178 -179.666 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 340' ' ' MET . . . . . . . . . . . . . 28.3 ttp -63.73 -53.73 46.56 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.091 -1.005 . . . . 0.32000000000000001 110.139 -179.491 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 341' ' ' PHE . . . . . . . . . . . . . 39.3 m-85 -62.19 -48.66 79.05 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.167 -0.958 . . . . 0.17999999999999999 109.978 -179.48 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 342' ' ' ARG . . . . . . . . . . . . . 70.4 ttt180 -48.72 -38.28 21.1 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.2 -0.937 . . . . 2.4199999999999999 109.964 -179.734 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 343' ' ' GLU . . . . . . . . . . . . . 43.0 tt0 -59.63 -49.3 78.3 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.194 -0.941 . . . . 2.3500000000000001 109.967 -179.713 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 344' ' ' LEU . . . . . 0.458 ' CD2' HD22 ' A' ' 344' ' ' LEU . 42.6 mt -61.31 -38.03 85.36 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.205 -0.934 . . . . 0.17999999999999999 109.747 -179.717 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 345' ' ' ASN . . . . . 0.522 HD22 HD21 ' D' ' 330' ' ' LEU . 60.6 t-20 -57.07 -50.15 73.65 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.245 -0.909 . . . . 1.0900000000000001 109.621 -179.879 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 346' ' ' GLU . . . . . . . . . . . . . 2.7 tt0 -60.87 -34.41 74.58 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.224 -0.922 . . . . 1.6599999999999999 109.826 -179.709 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 347' ' ' ALA . . . . . 0.878 ' HB1' ' HB1' ' A' ' 347' ' ' ALA . . . -60.9 -51.56 68.77 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.153 -0.967 . . . . 0.17000000000000001 110.087 -179.693 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 348' ' ' LEU . . . . . 0.541 HD22 ' N ' ' B' ' 348' ' ' LEU . 3.9 mm? -61.41 -44.94 96.27 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.211 -0.931 . . . . 0.28999999999999998 110.049 -179.561 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 349' ' ' GLU . . . . . . . . . . . . . 39.5 mt-10 -58.08 -40.28 80.69 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.224 -0.922 . . . . 1.95 110.378 -179.343 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 350' ' ' LEU . . . . . 0.61 HD23 ' C ' ' B' ' 350' ' ' LEU . 8.5 tt -63.79 -48.21 77.81 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.256 -0.902 . . . . 0.45000000000000001 110.067 -179.411 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 351' ' ' LYS . . . . . . . . . . . . . 25.8 tttt -55.61 -41.83 74.02 Favored 'General case' 0 N--CA 1.488 1.441 0 O-C-N 121.198 -0.939 . . . . 1.3799999999999999 109.27 -179.513 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 352' ' ' ASP . . . . . 0.504 ' OD2' ' NH2' ' D' ' 337' ' ' ARG . 23.3 m-20 -59.27 -48.43 81.66 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.282 -0.886 . . . . 1.1599999999999999 109.828 179.797 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 353' ' ' ALA . . . . . . . . . . . . . . . -67.46 -9.7 44.46 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.241 -0.912 . . . . 0.60999999999999999 110.116 -179.469 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 354' ' ' GLN . . . . . . . . . . . . . 2.3 tt0 . . . . . 0 N--CA 1.489 1.524 0 O-C-N 121.046 -1.034 . . . . 1.45 109.536 -179.824 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' C' C ' 326' ' ' GLU . . . . . 0.452 ' OE1' ' HB2' ' A' ' 335' ' ' ARG . 1.3 mp0 . . . . . 0 N--CA 1.489 1.501 0 CA-C-O 121.294 0.569 . . . . 2.1699999999999999 109.48 . . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 327' ' ' TYR . . . . . . . . . . . . . 51.6 m-85 -149.66 115.03 5.5 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.33 -0.856 . . . . 0.47999999999999998 109.394 -179.916 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 328' ' ' PHE . . . . . 0.464 ' CE1' ' HA ' ' A' ' 335' ' ' ARG . 84.4 m-85 -113.36 -169.77 1.56 Allowed 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.319 -0.863 . . . . 0.33000000000000002 109.562 -179.934 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' C' C ' 329' ' ' THR . . . . . 0.454 ' HA ' ' O ' ' A' ' 330' ' ' LEU . 16.3 p -153.54 162.48 41.22 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.265 -0.897 . . . . 0.23000000000000001 109.463 -179.873 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' C' C ' 330' ' ' LEU . . . . . 0.459 ' O ' ' HA ' ' A' ' 329' ' ' THR . 14.3 tp -150.26 129.78 13.04 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.206 -0.934 . . . . 0.28000000000000003 109.782 -179.725 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' C' C ' 331' ' ' GLN . . . . . . . . . . . . . 4.1 tt0 -89.22 119.4 29.68 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.263 -0.898 . . . . 1.48 109.387 179.568 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 332' ' ' ILE . . . . . 0.474 HG21 ' HA ' ' C' ' 338' ' ' PHE . 21.5 mt -103.67 115.58 45.88 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.576 0 O-C-N 121.101 -1.0 . . . . 0.23999999999999999 109.654 179.811 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' C' C ' 333' ' ' ARG . . . . . 0.565 ' CZ ' ' HB2' ' C' ' 333' ' ' ARG . 5.6 mtm-85 -73.45 151.58 41.05 Favored 'General case' 0 N--CA 1.489 1.493 0 O-C-N 121.348 -0.845 . . . . 2.7400000000000002 109.375 179.788 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' C' C ' 334' ' ' GLY . . . . . . . . . . . . . . . 71.83 129.99 0.1 OUTLIER Glycine 0 N--CA 1.491 2.305 0 N-CA-C 109.737 -1.345 . . . . 0.34999999999999998 109.737 179.798 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 335' ' ' ARG . . . . . 0.454 ' CG ' ' NH1' ' C' ' 335' ' ' ARG . 0.2 OUTLIER -73.98 -31.26 62.9 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.273 -1.133 . . . . 2.5299999999999998 109.358 179.847 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' C' C ' 336' ' ' GLU . . . . . . . . . . . . . 1.7 mp0 -59.22 -57.85 11.21 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.293 -0.88 . . . . 2.6200000000000001 110.216 -179.768 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 337' ' ' ARG . . . . . 0.524 ' HG2' ' NH1' ' C' ' 337' ' ' ARG . 0.0 OUTLIER -59.03 -32.97 70.21 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.241 -0.912 . . . . 2.8100000000000001 109.735 -179.471 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' C' C ' 338' ' ' PHE . . . . . 0.474 ' HA ' HG21 ' C' ' 332' ' ' ILE . 80.8 t80 -54.05 -49.53 68.77 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.224 -0.923 . . . . 0.40000000000000002 109.576 -179.884 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' C' C ' 339' ' ' GLU . . . . . . . . . . . . . 14.5 mt-10 -54.99 -36.67 65.64 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.07 -1.019 . . . . 2.0499999999999998 110.307 -179.849 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 340' ' ' MET . . . . . . . . . . . . . 19.0 ttp -64.6 -57.7 8.38 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.131 -0.981 . . . . 0.32000000000000001 110.861 -178.984 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 341' ' ' PHE . . . . . 0.446 ' CZ ' ' HA ' ' A' ' 345' ' ' ASN . 59.1 m-85 -59.74 -51.44 69.75 Favored 'General case' 0 N--CA 1.493 1.713 0 O-C-N 121.091 -1.005 . . . . 0.17999999999999999 110.246 -178.956 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' C' C ' 342' ' ' ARG . . . . . 0.46 HH11 ' CG ' ' C' ' 342' ' ' ARG . 0.2 OUTLIER -47.21 -45.85 23.58 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.25 -0.906 . . . . 2.9100000000000001 110.217 -179.374 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' C' C ' 343' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -58.84 -43.19 90.66 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.213 -0.929 . . . . 2.1400000000000001 109.968 -179.496 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' C' C ' 344' ' ' LEU . . . . . 0.472 ' CD2' HD22 ' D' ' 344' ' ' LEU . 25.6 mt -62.28 -40.66 96.97 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.093 -1.004 . . . . 0.22 109.823 -179.583 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' C' C ' 345' ' ' ASN . . . . . 0.587 HD22 HD21 ' A' ' 330' ' ' LEU . 51.2 t-20 -55.26 -51.79 65.51 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.238 -0.914 . . . . 1.0800000000000001 109.98 -179.596 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' C' C ' 346' ' ' GLU . . . . . . . . . . . . . 63.1 tt0 -60.14 -31.68 70.31 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.108 -0.995 . . . . 2.21 109.742 -179.602 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 347' ' ' ALA . . . . . 0.793 ' HB1' ' HB1' ' D' ' 347' ' ' ALA . . . -62.7 -48.05 80.95 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.112 -0.993 . . . . 0.17999999999999999 109.879 -179.998 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' C' C ' 348' ' ' LEU . . . . . 0.538 ' N ' HD22 ' C' ' 348' ' ' LEU . 4.3 mm? -62.16 -53.84 49.64 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.209 -0.932 . . . . 0.32000000000000001 110.108 -179.637 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' C' C ' 349' ' ' GLU . . . . . . . . . . . . . 6.6 mm-40 -57.65 -34.06 68.96 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.256 -0.902 . . . . 2.1899999999999999 110.231 -179.097 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 350' ' ' LEU . . . . . 0.725 HD21 HD13 ' D' ' 350' ' ' LEU . 4.2 tt -63.49 -44.04 95.51 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.099 -1.001 . . . . 0.46000000000000002 109.282 -179.817 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' C' C ' 351' ' ' LYS . . . . . 0.541 ' N ' HD23 ' C' ' 350' ' ' LEU . 41.6 tttp -59.9 -34.43 73.18 Favored 'General case' 0 N--CA 1.488 1.454 0 O-C-N 121.342 -0.849 . . . . 1.3500000000000001 109.445 -179.923 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' C' C ' 352' ' ' ASP . . . . . . . . . . . . . 3.2 m-20 -56.52 -45.49 81.09 Favored 'General case' 0 N--CA 1.489 1.499 0 O-C-N 121.241 -0.912 . . . . 1.1899999999999999 109.663 179.978 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 353' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 1.588 0 O-C-N 121.184 -0.947 . . . . 0.56999999999999995 109.333 -179.971 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' D' D ' 326' ' ' GLU . . . . . . . . . . . . . 3.0 mt-10 . . . . . 0 N--CA 1.488 1.441 0 N-CA-C 109.07 -0.715 . . . . 2.1299999999999999 109.07 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' D' D ' 327' ' ' TYR . . . . . . . . . . . . . 47.1 m-85 -148.79 111.53 4.8 Favored 'General case' 0 C--N 1.303 -1.427 0 O-C-N 121.173 -0.954 . . . . 0.46999999999999997 109.469 -179.818 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' D' D ' 328' ' ' PHE . . . . . 0.413 ' CE2' ' HA ' ' B' ' 335' ' ' ARG . 86.2 m-85 -114.08 -168.64 1.38 Allowed 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.292 -0.88 . . . . 0.29999999999999999 109.561 -179.842 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' D' D ' 329' ' ' THR . . . . . 0.425 ' HA ' ' O ' ' B' ' 330' ' ' LEU . 23.8 p -153.46 165.07 36.98 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.294 -0.879 . . . . 0.22 109.174 179.931 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' D' D ' 330' ' ' LEU . . . . . 0.522 HD21 HD22 ' B' ' 345' ' ' ASN . 14.9 tp -151.43 131.23 13.23 Favored 'General case' 0 N--CA 1.489 1.476 0 O-C-N 121.134 -0.978 . . . . 0.28000000000000003 109.869 -179.768 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' D' D ' 331' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -87.39 120.75 29.0 Favored 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.341 -0.849 . . . . 0.93000000000000005 109.234 179.54 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' D' D ' 332' ' ' ILE . . . . . 0.65 HD12 ' CD1' ' D' ' 338' ' ' PHE . 59.5 mt -103.46 111.26 32.51 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.574 0 O-C-N 121.149 -0.97 . . . . 0.25 109.656 -179.778 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' D' D ' 333' ' ' ARG . . . . . 0.433 ' NH1' ' CG ' ' D' ' 333' ' ' ARG . 0.0 OUTLIER -72.77 139.67 47.24 Favored 'General case' 0 N--CA 1.489 1.49 0 O-C-N 121.334 -0.854 . . . . 2.9300000000000002 109.454 179.778 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' D' D ' 334' ' ' GLY . . . . . . . . . . . . . . . 85.76 136.62 4.1 Favored Glycine 0 N--CA 1.49 2.283 0 N-CA-C 109.658 -1.377 . . . . 0.40999999999999998 109.658 179.925 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' D' D ' 335' ' ' ARG . . . . . 0.5 ' HG3' ' NH1' ' D' ' 335' ' ' ARG . 0.3 OUTLIER -80.13 -36.08 35.8 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.31 -1.112 . . . . 3.0299999999999998 109.623 -179.951 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' D' D ' 336' ' ' GLU . . . . . . . . . . . . . 53.1 tt0 -58.72 -57.14 14.32 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.223 -0.923 . . . . 2.2599999999999998 110.057 -179.666 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' D' D ' 337' ' ' ARG . . . . . 0.546 ' HG3' ' NH1' ' D' ' 337' ' ' ARG . 0.6 OUTLIER -60.07 -30.27 69.11 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.188 -0.945 . . . . 2.9199999999999999 109.862 -179.608 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' D' D ' 338' ' ' PHE . . . . . 0.65 ' CD1' HD12 ' D' ' 332' ' ' ILE . 88.7 t80 -54.43 -62.89 1.36 Allowed 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.209 -0.932 . . . . 0.37 109.769 -179.756 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' D' D ' 339' ' ' GLU . . . . . . . . . . . . . 81.7 mt-10 -51.99 -31.32 28.93 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.279 -0.888 . . . . 1.99 110.155 -179.632 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' D' D ' 340' ' ' MET . . . . . . . . . . . . . 28.2 ttp -63.9 -53.6 47.95 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.101 -0.999 . . . . 0.31 110.098 -179.426 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' D' D ' 341' ' ' PHE . . . . . 0.423 ' CZ ' ' HA ' ' B' ' 345' ' ' ASN . 39.8 m-85 -62.17 -48.83 78.3 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.183 -0.948 . . . . 0.17999999999999999 109.977 -179.532 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' D' D ' 342' ' ' ARG . . . . . . . . . . . . . 70.6 ttt180 -48.6 -38.47 20.87 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.185 -0.947 . . . . 2.4100000000000001 109.827 -179.73 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' D' D ' 343' ' ' GLU . . . . . . . . . . . . . 43.7 tt0 -59.51 -49.29 78.37 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.218 -0.926 . . . . 2.3500000000000001 109.927 -179.609 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' D' D ' 344' ' ' LEU . . . . . 0.472 HD22 ' CD2' ' C' ' 344' ' ' LEU . 43.1 mt -61.26 -38.08 85.46 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.256 -0.902 . . . . 0.19 109.738 -179.659 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' D' D ' 345' ' ' ASN . . . . . 0.537 HD22 HD21 ' B' ' 330' ' ' LEU . 60.6 t-20 -57.09 -50.35 73.06 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.178 -0.951 . . . . 1.0900000000000001 109.61 -179.787 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' D' D ' 346' ' ' GLU . . . . . . . . . . . . . 2.6 tt0 -60.56 -34.52 74.28 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.295 -0.878 . . . . 1.6899999999999999 109.892 -179.774 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' D' D ' 347' ' ' ALA . . . . . 0.793 ' HB1' ' HB1' ' C' ' 347' ' ' ALA . . . -60.85 -51.48 69.12 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.243 -0.911 . . . . 0.17999999999999999 110.07 -179.645 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' D' D ' 348' ' ' LEU . . . . . 0.548 HD22 ' N ' ' D' ' 348' ' ' LEU . 3.9 mm? -61.48 -45.05 95.88 Favored 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.158 -0.964 . . . . 0.31 109.948 -179.446 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' D' D ' 349' ' ' GLU . . . . . . . . . . . . . 39.2 mt-10 -57.91 -40.34 80.12 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.275 -0.891 . . . . 1.95 110.351 -179.327 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' D' D ' 350' ' ' LEU . . . . . 0.725 HD13 HD21 ' C' ' 350' ' ' LEU . 8.6 tt -63.73 -48.11 78.35 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.087 -1.008 . . . . 0.42999999999999999 110.144 -179.369 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' D' D ' 351' ' ' LYS . . . . . . . . . . . . . 25.8 tttt -55.73 -41.8 74.41 Favored 'General case' 0 N--CA 1.488 1.451 0 O-C-N 121.244 -0.91 . . . . 1.3999999999999999 109.291 -179.665 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' D' D ' 352' ' ' ASP . . . . . 0.433 ' OD2' ' NH2' ' B' ' 337' ' ' ARG . 23.5 m-20 -59.36 -48.35 81.96 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.294 -0.879 . . . . 1.1699999999999999 109.806 179.802 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' D' D ' 353' ' ' ALA . . . . . . . . . . . . . . . -67.57 -9.56 43.85 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.22 -0.925 . . . . 0.58999999999999997 110.101 -179.43 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' D' D ' 354' ' ' GLN . . . . . . . . . . . . . 2.3 tt0 . . . . . 0 N--CA 1.49 1.566 0 O-C-N 121.063 -1.023 . . . . 1.4399999999999999 109.532 -179.807 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 326' ' ' GLU . . . . . . . . . . . . . 4.0 mm-40 . . . . . 0 N--CA 1.489 1.518 0 N-CA-C 109.378 -0.601 . . . . 2.1299999999999999 109.378 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 327' ' ' TYR . . . . . 0.54 ' CE2' ' HG2' ' C' ' 333' ' ' ARG . 40.9 m-85 -148.35 111.05 4.76 Favored 'General case' 0 C--N 1.302 -1.464 0 O-C-N 121.412 -0.805 . . . . 0.47999999999999998 109.553 179.725 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 328' ' ' PHE . . . . . 0.437 ' O ' ' OE1' ' C' ' 331' ' ' GLN . 59.5 m-85 -113.08 -172.75 2.12 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.431 -0.793 . . . . 0.31 109.291 -179.936 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 329' ' ' THR . . . . . . . . . . . . . 60.0 p -152.92 171.74 17.85 Favored 'General case' 0 C--N 1.302 -1.461 0 O-C-N 121.196 -0.94 . . . . 0.22 108.895 179.847 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 330' ' ' LEU . . . . . . . . . . . . . 24.1 tp -151.86 130.17 12.05 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.378 -0.826 . . . . 0.28000000000000003 109.71 -179.721 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 331' ' ' GLN . . . . . . . . . . . . . 1.5 tp60 -87.18 111.96 21.5 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.25 -0.906 . . . . 0.91000000000000003 109.679 179.932 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 332' ' ' ILE . . . . . 0.597 HG21 ' HA ' ' A' ' 338' ' ' PHE . 63.6 mt -103.2 103.1 14.59 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.587 0 O-C-N 121.107 -0.996 . . . . 0.26000000000000001 109.291 179.891 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 333' ' ' ARG . . . . . 0.6 ' HG2' ' CE2' ' C' ' 327' ' ' TYR . 0.0 OUTLIER -72.45 147.58 45.98 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.253 -0.904 . . . . 2.9199999999999999 109.41 -179.879 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 334' ' ' GLY . . . . . . . . . . . . . . . 82.0 130.59 1.3 Allowed Glycine 0 N--CA 1.493 2.436 0 N-CA-C 109.452 -1.459 . . . . 0.40000000000000002 109.452 -179.961 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 335' ' ' ARG . . . . . 0.433 ' HA ' ' CE2' ' C' ' 328' ' ' PHE . 0.2 OUTLIER -76.44 -31.42 57.85 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.133 -1.216 . . . . 3.0099999999999998 110.022 -179.938 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 336' ' ' GLU . . . . . . . . . . . . . 4.8 tp10 -57.45 -62.88 1.47 Allowed 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.048 -1.033 . . . . 2.29 109.667 -179.627 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 337' ' ' ARG . . . . . 0.429 HH11 ' HG3' ' A' ' 337' ' ' ARG . 8.3 mtm-85 -59.99 -31.43 69.91 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.249 -0.907 . . . . 2.9300000000000002 109.508 -179.765 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 338' ' ' PHE . . . . . 0.597 ' HA ' HG21 ' A' ' 332' ' ' ILE . 73.1 t80 -56.35 -56.02 26.23 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.304 -0.872 . . . . 0.38 109.851 -179.97 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 339' ' ' GLU . . . . . . . . . . . . . 93.6 mt-10 -52.74 -37.17 58.87 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.151 -0.968 . . . . 1.97 110.446 -179.568 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 340' ' ' MET . . . . . 0.443 ' SD ' ' OE1' ' D' ' 343' ' ' GLU . 28.2 ttp -63.76 -47.99 78.74 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.024 -1.047 . . . . 0.31 110.162 -179.238 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 341' ' ' PHE . . . . . . . . . . . . . 52.4 m-85 -62.43 -40.41 96.48 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.148 -0.97 . . . . 0.17999999999999999 109.684 -179.515 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 342' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -51.12 -43.68 61.19 Favored 'General case' 0 N--CA 1.488 1.47 0 O-C-N 121.399 -0.813 . . . . 2.4199999999999999 109.823 -179.939 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 343' ' ' GLU . . . . . 0.559 ' OE2' HD11 ' B' ' 348' ' ' LEU . 1.8 tt0 -57.94 -46.84 84.43 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.374 -0.829 . . . . 2.3500000000000001 109.706 -179.646 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 344' ' ' LEU . . . . . . . . . . . . . 41.4 mt -61.59 -33.71 74.36 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.176 -0.953 . . . . 0.17999999999999999 109.247 179.906 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 345' ' ' ASN . . . . . 0.421 ' O ' ' HG3' ' A' ' 349' ' ' GLU . 13.3 t-20 -57.96 -55.68 31.77 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.558 -0.714 . . . . 1.0900000000000001 109.517 179.979 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 346' ' ' GLU . . . . . . . . . . . . . 65.2 tt0 -63.63 -29.28 70.54 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.224 -0.922 . . . . 1.6499999999999999 110.205 -179.756 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 347' ' ' ALA . . . . . 0.85 ' HB1' ' HB1' ' B' ' 347' ' ' ALA . . . -60.85 -61.44 2.58 Favored 'General case' 0 N--CA 1.494 1.759 0 O-C-N 120.983 -1.073 . . . . 0.17999999999999999 109.983 -179.613 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 348' ' ' LEU . . . . . 0.587 HD22 ' N ' ' A' ' 348' ' ' LEU . 3.9 mm? -61.74 -40.47 95.2 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.256 -0.903 . . . . 0.29999999999999999 109.546 -179.789 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 349' ' ' GLU . . . . . 0.421 ' HG3' ' O ' ' A' ' 345' ' ' ASN . 93.4 mt-10 -58.56 -34.13 70.69 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.244 -0.91 . . . . 1.9399999999999999 110.15 -179.446 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 350' ' ' LEU . . . . . 0.804 HD23 ' O ' ' A' ' 350' ' ' LEU . 4.1 tt -65.35 -47.08 77.71 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.179 -0.951 . . . . 0.46000000000000002 109.661 -179.833 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 351' ' ' LYS . . . . . . . . . . . . . 14.4 tttm -58.96 -41.77 88.27 Favored 'General case' 0 N--CA 1.489 1.497 0 O-C-N 121.166 -0.959 . . . . 1.3999999999999999 109.845 -179.453 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 352' ' ' ASP . . . . . . . . . . . . . 48.2 m-20 -53.45 -40.29 65.12 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.035 -1.041 . . . . 1.1599999999999999 109.505 -179.837 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 353' ' ' ALA . . . . . . . . . . . . . . . -67.5 -31.45 71.59 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.161 -0.962 . . . . 0.63 109.727 -179.888 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 354' ' ' GLN . . . . . . . . . . . . . 3.7 tt0 . . . . . 0 N--CA 1.493 1.696 0 O-C-N 121.255 -0.903 . . . . 1.47 109.818 -179.767 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' B' B ' 326' ' ' GLU . . . . . . . . . . . . . 3.4 mm-40 . . . . . 0 N--CA 1.49 1.535 0 N-CA-C 109.354 -0.61 . . . . 2.1299999999999999 109.354 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' B' B ' 327' ' ' TYR . . . . . 0.541 ' CE2' ' HG2' ' D' ' 333' ' ' ARG . 42.0 m-85 -148.13 111.51 4.96 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.373 -0.829 . . . . 0.47999999999999998 109.446 179.637 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 328' ' ' PHE . . . . . . . . . . . . . 62.8 m-85 -113.08 -173.37 2.24 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.362 -0.836 . . . . 0.32000000000000001 109.243 -179.904 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 329' ' ' THR . . . . . 0.498 ' HA ' ' O ' ' D' ' 330' ' ' LEU . 77.2 p -152.12 170.77 19.14 Favored 'General case' 0 C--N 1.302 -1.479 0 O-C-N 121.348 -0.845 . . . . 0.23000000000000001 109.099 179.824 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 330' ' ' LEU . . . . . 0.457 ' O ' ' HA ' ' D' ' 329' ' ' THR . 28.3 tp -151.13 130.31 12.71 Favored 'General case' 0 C--N 1.303 -1.449 0 O-C-N 121.025 -1.047 . . . . 0.28000000000000003 109.71 -179.661 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 331' ' ' GLN . . . . . . . . . . . . . 1.5 tp60 -87.48 112.28 22.04 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.384 -0.823 . . . . 0.91000000000000003 109.641 -179.891 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 332' ' ' ILE . . . . . 0.607 HG21 ' HA ' ' B' ' 338' ' ' PHE . 63.6 mt -103.49 103.23 14.83 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.478 0 O-C-N 121.118 -0.989 . . . . 0.23999999999999999 109.195 179.834 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 333' ' ' ARG . . . . . 0.535 ' NH1' ' HG2' ' B' ' 333' ' ' ARG . 0.0 OUTLIER -72.69 146.56 46.43 Favored 'General case' 0 N--CA 1.488 1.475 0 O-C-N 121.178 -0.951 . . . . 2.9300000000000002 109.472 -179.924 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' B' B ' 334' ' ' GLY . . . . . . . . . . . . . . . 82.88 130.81 1.57 Allowed Glycine 0 N--CA 1.492 2.428 0 N-CA-C 109.583 -1.407 . . . . 0.40000000000000002 109.583 179.995 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 335' ' ' ARG . . . . . 0.423 HH11 ' HG3' ' B' ' 335' ' ' ARG . 0.2 OUTLIER -76.37 -31.54 58.09 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.35 -1.088 . . . . 3.0099999999999998 109.773 -179.657 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' B' B ' 336' ' ' GLU . . . . . . . . . . . . . 4.8 tp10 -57.01 -63.37 1.23 Allowed 'General case' 0 N--CA 1.488 1.454 0 O-C-N 121.092 -1.005 . . . . 2.2799999999999998 109.881 -179.743 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 337' ' ' ARG . . . . . 0.416 HH11 ' HG3' ' B' ' 337' ' ' ARG . 9.1 mtm-85 -60.1 -31.42 70.02 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.233 -0.917 . . . . 2.9300000000000002 109.686 -179.712 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 338' ' ' PHE . . . . . 0.607 ' HA ' HG21 ' B' ' 332' ' ' ILE . 72.4 t80 -56.37 -55.72 30.06 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.218 -0.926 . . . . 0.37 109.826 -179.903 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 339' ' ' GLU . . . . . . . . . . . . . 94.1 mt-10 -52.96 -37.33 61.05 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.256 -0.903 . . . . 1.98 110.426 -179.265 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 340' ' ' MET . . . . . . . . . . . . . 29.3 ttp -63.57 -47.88 79.7 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.133 -0.98 . . . . 0.32000000000000001 110.041 -179.404 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 341' ' ' PHE . . . . . . . . . . . . . 50.9 m-85 -62.03 -40.95 97.47 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 120.963 -1.086 . . . . 0.17999999999999999 109.818 -179.762 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 342' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -50.7 -43.29 57.66 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.287 -0.883 . . . . 2.4199999999999999 109.904 -179.859 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 343' ' ' GLU . . . . . . . . . . . . . 1.7 tt0 -58.42 -46.5 86.36 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.303 -0.873 . . . . 2.3500000000000001 109.665 -179.518 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 344' ' ' LEU . . . . . . . . . . . . . 39.5 mt -61.57 -33.55 74.07 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.324 -0.86 . . . . 0.17999999999999999 109.07 179.966 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 345' ' ' ASN . . . . . . . . . . . . . 13.0 t-20 -57.88 -56.62 19.61 Favored 'General case' 0 N--CA 1.49 1.525 0 O-C-N 121.413 -0.805 . . . . 1.0900000000000001 109.686 179.999 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 346' ' ' GLU . . . . . . . . . . . . . 61.9 tt0 -63.31 -29.06 70.45 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.239 -0.913 . . . . 1.6599999999999999 110.199 -179.783 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 347' ' ' ALA . . . . . 0.85 ' HB1' ' HB1' ' A' ' 347' ' ' ALA . . . -60.76 -62.07 2.13 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 120.86 -1.15 . . . . 0.17000000000000001 109.922 -179.622 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 348' ' ' LEU . . . . . 0.599 HD22 ' N ' ' B' ' 348' ' ' LEU . 3.9 mm? -61.2 -40.25 93.24 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.076 -1.015 . . . . 0.28999999999999998 109.764 -179.651 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 349' ' ' GLU . . . . . . . . . . . . . 96.9 mt-10 -59.01 -33.97 71.33 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.295 -0.878 . . . . 1.95 110.077 -179.453 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 350' ' ' LEU . . . . . 0.8 HD23 ' O ' ' B' ' 350' ' ' LEU . 4.0 tt -65.2 -47.09 78.11 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.278 -0.889 . . . . 0.45000000000000001 109.641 -179.78 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 351' ' ' LYS . . . . . . . . . . . . . 16.2 tttm -58.77 -41.75 87.34 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.303 -0.873 . . . . 1.3799999999999999 109.788 -179.666 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 352' ' ' ASP . . . . . . . . . . . . . 45.5 m-20 -54.22 -40.1 67.35 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.163 -0.961 . . . . 1.1599999999999999 109.513 -179.667 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 353' ' ' ALA . . . . . . . . . . . . . . . -67.02 -31.66 72.35 Favored 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.266 -0.897 . . . . 0.60999999999999999 109.501 179.928 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 354' ' ' GLN . . . . . . . . . . . . . 3.2 tt0 . . . . . 0 N--CA 1.488 1.455 0 O-C-N 121.159 -0.963 . . . . 1.45 109.891 -179.906 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' C' C ' 326' ' ' GLU . . . . . 0.481 ' O ' ' CD1' ' C' ' 327' ' ' TYR . 1.7 mm-40 . . . . . 0 N--CA 1.494 1.741 0 CA-C-O 121.42 0.629 . . . . 2.1699999999999999 109.645 . . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 327' ' ' TYR . . . . . 0.6 ' CE2' ' HG2' ' A' ' 333' ' ' ARG . 37.4 m-85 -150.41 113.61 4.87 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.341 -0.849 . . . . 0.47999999999999998 109.678 179.745 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' C' C ' 328' ' ' PHE . . . . . 0.433 ' CE2' ' HA ' ' A' ' 335' ' ' ARG . 96.3 m-85 -113.62 -170.39 1.69 Allowed 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.317 -0.864 . . . . 0.33000000000000002 109.356 179.695 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' C' C ' 329' ' ' THR . . . . . 0.415 HG23 ' O ' ' C' ' 328' ' ' PHE . 12.8 p -153.31 167.17 30.28 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.168 -0.957 . . . . 0.23000000000000001 109.71 -179.748 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' C' C ' 330' ' ' LEU . . . . . . . . . . . . . 56.9 tp -148.57 130.35 15.11 Favored 'General case' 0 N--CA 1.488 1.452 0 O-C-N 121.148 -0.97 . . . . 0.28000000000000003 109.518 -179.97 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 331' ' ' GLN . . . . . 0.437 ' OE1' ' O ' ' A' ' 328' ' ' PHE . 7.4 tp-100 -87.32 111.24 20.87 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.383 -0.823 . . . . 1.48 109.538 -179.922 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' C' C ' 332' ' ' ILE . . . . . 0.664 HG21 ' HA ' ' C' ' 338' ' ' PHE . 31.1 mt -103.7 101.43 12.23 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.624 0 O-C-N 121.009 -1.057 . . . . 0.23999999999999999 109.615 179.858 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' C' C ' 333' ' ' ARG . . . . . 0.54 ' HG2' ' CE2' ' A' ' 327' ' ' TYR . 0.0 OUTLIER -73.67 137.23 43.98 Favored 'General case' 0 N--CA 1.489 1.476 0 O-C-N 121.151 -0.968 . . . . 2.7400000000000002 109.113 179.539 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' C' C ' 334' ' ' GLY . . . . . . . . . . . . . . . 96.33 128.62 5.79 Favored Glycine 0 N--CA 1.488 2.131 0 N-CA-C 109.571 -1.412 . . . . 0.34999999999999998 109.571 -179.985 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 335' ' ' ARG . . . . . 0.436 ' HD3' ' CZ ' ' A' ' 328' ' ' PHE . 3.6 ttp180 -75.87 -36.59 59.49 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.363 -1.081 . . . . 2.5299999999999998 109.309 -179.983 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' C' C ' 336' ' ' GLU . . . . . . . . . . . . . 1.3 mt-10 -58.95 -60.28 4.11 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.218 -0.926 . . . . 2.6200000000000001 109.875 -179.748 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 337' ' ' ARG . . . . . 0.478 ' HA ' ' NE ' ' C' ' 337' ' ' ARG . 10.5 mmm180 -60.04 -35.23 74.66 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.187 -0.946 . . . . 2.8100000000000001 109.678 -179.731 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' C' C ' 338' ' ' PHE . . . . . 0.664 ' HA ' HG21 ' C' ' 332' ' ' ILE . 16.8 t80 -56.44 -48.66 76.56 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.242 -0.911 . . . . 0.40000000000000002 109.803 -179.816 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' C' C ' 339' ' ' GLU . . . . . . . . . . . . . 2.2 mt-10 -53.57 -37.52 63.01 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.056 -1.027 . . . . 2.0499999999999998 110.44 -179.237 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 340' ' ' MET . . . . . . . . . . . . . 32.5 ttp -63.75 -47.32 81.49 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.062 -1.024 . . . . 0.32000000000000001 109.84 -179.485 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 341' ' ' PHE . . . . . . . . . . . . . 56.8 m-85 -61.75 -45.05 95.59 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.1 -1.0 . . . . 0.17999999999999999 109.982 -179.523 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 342' ' ' ARG . . . . . 0.436 HH11 ' CG ' ' C' ' 342' ' ' ARG . 0.0 OUTLIER -50.09 -42.34 50.03 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.255 -0.903 . . . . 2.9100000000000001 109.962 -179.842 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' C' C ' 343' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -59.98 -51.71 68.5 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.262 -0.899 . . . . 2.1400000000000001 110.173 -179.522 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' C' C ' 344' ' ' LEU . . . . . . . . . . . . . 42.1 mt -60.18 -30.99 69.71 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.128 -0.983 . . . . 0.22 109.68 -179.559 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 345' ' ' ASN . . . . . . . . . . . . . 14.3 t-20 -57.84 -56.61 19.69 Favored 'General case' 0 N--CA 1.488 1.428 0 O-C-N 121.242 -0.911 . . . . 1.0800000000000001 109.442 179.93 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 346' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -62.05 -29.27 70.18 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.399 -0.813 . . . . 2.21 109.92 -179.898 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' C' C ' 347' ' ' ALA . . . . . 0.717 ' HB1' ' HB1' ' D' ' 347' ' ' ALA . . . -61.1 -60.33 3.94 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.206 -0.934 . . . . 0.17999999999999999 110.104 -179.695 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' C' C ' 348' ' ' LEU . . . . . 0.547 ' N ' HD22 ' C' ' 348' ' ' LEU . 4.1 mm? -59.4 -48.54 81.26 Favored 'General case' 0 N--CA 1.495 1.795 0 O-C-N 121.017 -1.052 . . . . 0.32000000000000001 109.872 -179.561 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' C' C ' 349' ' ' GLU . . . . . . . . . . . . . 5.3 mm-40 -57.85 -28.66 64.32 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.196 -0.94 . . . . 2.1899999999999999 109.354 -179.845 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 350' ' ' LEU . . . . . 1.041 HD22 HD13 ' D' ' 350' ' ' LEU . 5.2 tt -64.1 -46.53 83.82 Favored 'General case' 0 N--CA 1.489 1.501 0 O-C-N 121.207 -0.933 . . . . 0.46000000000000002 108.928 179.689 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' C' C ' 351' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -59.56 -45.55 91.5 Favored 'General case' 0 N--CA 1.487 1.379 0 O-C-N 121.576 -0.703 . . . . 1.3500000000000001 109.132 179.83 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' C' C ' 352' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -56.86 -32.5 65.89 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.477 -0.764 . . . . 1.1899999999999999 109.417 179.729 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 353' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 1.547 0 O-C-N 121.27 -0.893 . . . . 0.56999999999999995 109.328 -179.992 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' D' D ' 326' ' ' GLU . . . . . . . . . . . . . 3.1 mm-40 . . . . . 0 N--CA 1.489 1.505 0 N-CA-C 109.428 -0.582 . . . . 2.1299999999999999 109.428 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' D' D ' 327' ' ' TYR . . . . . 0.453 ' CE2' ' HG2' ' B' ' 333' ' ' ARG . 42.6 m-85 -148.54 112.09 5.03 Favored 'General case' 0 N--CA 1.488 1.453 0 O-C-N 121.409 -0.807 . . . . 0.46999999999999997 109.267 179.675 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' D' D ' 328' ' ' PHE . . . . . . . . . . . . . 58.0 m-85 -113.6 -173.25 2.23 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.533 -0.73 . . . . 0.29999999999999999 109.281 -179.901 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' D' D ' 329' ' ' THR . . . . . 0.457 ' HA ' ' O ' ' B' ' 330' ' ' LEU . 76.5 p -152.28 170.57 19.72 Favored 'General case' 0 N--CA 1.488 1.472 0 O-C-N 121.276 -0.89 . . . . 0.22 109.004 -179.938 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' D' D ' 330' ' ' LEU . . . . . 0.498 ' O ' ' HA ' ' B' ' 329' ' ' THR . 32.2 tp -150.65 130.65 13.41 Favored 'General case' 0 C--N 1.302 -1.463 0 O-C-N 121.068 -1.02 . . . . 0.28000000000000003 109.522 -179.901 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' D' D ' 331' ' ' GLN . . . . . . . . . . . . . 1.5 tp60 -87.83 112.27 22.29 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.263 -0.898 . . . . 0.93000000000000005 109.545 179.968 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' D' D ' 332' ' ' ILE . . . . . 0.611 HG21 ' HA ' ' D' ' 338' ' ' PHE . 64.4 mt -103.33 102.85 14.25 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.45 0 O-C-N 121.217 -0.927 . . . . 0.25 109.415 179.835 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' D' D ' 333' ' ' ARG . . . . . 0.541 ' HG2' ' CE2' ' B' ' 327' ' ' TYR . 0.0 OUTLIER -72.33 144.42 48.31 Favored 'General case' 0 N--CA 1.488 1.463 0 O-C-N 121.361 -0.837 . . . . 2.9300000000000002 109.724 -179.981 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' D' D ' 334' ' ' GLY . . . . . . . . . . . . . . . 84.75 130.98 2.21 Favored Glycine 0 N--CA 1.492 2.398 0 N-CA-C 109.605 -1.398 . . . . 0.40999999999999998 109.605 179.933 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' D' D ' 335' ' ' ARG . . . . . 0.445 HH11 ' HG3' ' D' ' 335' ' ' ARG . 0.2 OUTLIER -76.47 -31.79 57.99 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.291 -1.123 . . . . 3.0299999999999998 109.873 -179.93 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' D' D ' 336' ' ' GLU . . . . . . . . . . . . . 4.5 tp10 -57.13 -62.95 1.4 Allowed 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.107 -0.996 . . . . 2.2599999999999998 109.651 -179.635 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' D' D ' 337' ' ' ARG . . . . . 0.418 HH11 ' HG3' ' D' ' 337' ' ' ARG . 7.9 mtm-85 -60.23 -31.93 70.64 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.353 -0.842 . . . . 2.9199999999999999 109.732 -179.824 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' D' D ' 338' ' ' PHE . . . . . 0.611 ' HA ' HG21 ' D' ' 332' ' ' ILE . 72.2 t80 -56.47 -55.74 29.92 Favored 'General case' 0 C--N 1.302 -1.459 0 O-C-N 121.132 -0.98 . . . . 0.37 109.992 -179.858 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' D' D ' 339' ' ' GLU . . . . . . . . . . . . . 96.5 mt-10 -52.16 -37.97 56.18 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.291 -0.881 . . . . 1.99 110.335 -179.399 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' D' D ' 340' ' ' MET . . . . . 0.457 ' SD ' ' OE1' ' A' ' 343' ' ' GLU . 28.3 ttp -62.84 -47.95 81.18 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.208 -0.932 . . . . 0.31 110.199 -179.292 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' D' D ' 341' ' ' PHE . . . . . . . . . . . . . 50.3 m-85 -62.69 -40.75 98.1 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.195 -0.941 . . . . 0.17999999999999999 109.747 -179.755 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' D' D ' 342' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -50.86 -43.38 59.4 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.219 -0.925 . . . . 2.4100000000000001 109.926 -179.882 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' D' D ' 343' ' ' GLU . . . . . 0.479 ' OE2' HD11 ' C' ' 348' ' ' LEU . 1.6 tt0 -58.14 -46.87 84.9 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.378 -0.826 . . . . 2.3500000000000001 109.672 -179.618 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' D' D ' 344' ' ' LEU . . . . . . . . . . . . . 34.5 mt -61.35 -33.15 73.16 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.14 -0.975 . . . . 0.19 109.176 179.96 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' D' D ' 345' ' ' ASN . . . . . . . . . . . . . 12.2 t-20 -57.99 -56.31 23.62 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.449 -0.782 . . . . 1.0900000000000001 109.723 179.972 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' D' D ' 346' ' ' GLU . . . . . . . . . . . . . 56.8 tt0 -63.63 -28.6 70.03 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.163 -0.96 . . . . 1.6899999999999999 110.161 -179.518 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' D' D ' 347' ' ' ALA . . . . . 0.717 ' HB1' ' HB1' ' C' ' 347' ' ' ALA . . . -61.16 -61.65 2.41 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.051 -1.031 . . . . 0.17999999999999999 109.846 -179.674 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' D' D ' 348' ' ' LEU . . . . . 0.589 HD22 ' N ' ' D' ' 348' ' ' LEU . 3.9 mm? -61.74 -40.9 96.73 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.17 -0.956 . . . . 0.31 109.896 -179.695 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' D' D ' 349' ' ' GLU . . . . . . . . . . . . . 96.8 mt-10 -58.49 -34.39 70.87 Favored 'General case' 0 N--CA 1.495 1.787 0 O-C-N 121.281 -0.887 . . . . 1.95 109.895 -179.737 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' D' D ' 350' ' ' LEU . . . . . 1.041 HD13 HD22 ' C' ' 350' ' ' LEU . 3.8 tt -64.75 -46.84 80.48 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.229 -0.919 . . . . 0.42999999999999999 109.672 -179.688 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' D' D ' 351' ' ' LYS . . . . . . . . . . . . . 18.6 tttm -59.08 -41.97 89.3 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.317 -0.864 . . . . 1.3999999999999999 109.987 -179.641 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' D' D ' 352' ' ' ASP . . . . . . . . . . . . . 38.3 m-20 -53.83 -39.67 65.77 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.155 -0.966 . . . . 1.1699999999999999 109.42 179.921 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' D' D ' 353' ' ' ALA . . . . . . . . . . . . . . . -67.24 -31.97 72.69 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.217 -0.927 . . . . 0.58999999999999997 109.586 -179.995 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' D' D ' 354' ' ' GLN . . . . . . . . . . . . . 3.5 tt0 . . . . . 0 N--CA 1.488 1.463 0 O-C-N 121.209 -0.932 . . . . 1.4399999999999999 109.667 -179.862 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 326' ' ' GLU . . . . . . . . . . . . . 2.8 mt-10 . . . . . 0 N--CA 1.488 1.454 0 CA-C-O 121.385 0.612 . . . . 2.1299999999999999 109.397 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 327' ' ' TYR . . . . . 0.535 ' CE1' ' HG2' ' C' ' 333' ' ' ARG . 41.0 m-85 -150.54 112.68 4.6 Favored 'General case' 0 C--N 1.303 -1.449 0 O-C-N 121.071 -1.018 . . . . 0.47999999999999998 109.56 179.753 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 328' ' ' PHE . . . . . 0.416 ' HB2' ' CD1' ' C' ' 338' ' ' PHE . 69.6 m-85 -112.99 -171.53 1.88 Allowed 'General case' 0 N--CA 1.488 1.475 0 O-C-N 121.386 -0.821 . . . . 0.31 109.083 179.952 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 329' ' ' THR . . . . . . . . . . . . . 35.3 p -152.39 168.88 24.04 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.254 -0.904 . . . . 0.22 109.387 179.908 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 330' ' ' LEU . . . . . 0.463 ' O ' ' HA ' ' C' ' 329' ' ' THR . 23.3 tp -152.15 132.54 13.75 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.207 -0.933 . . . . 0.28000000000000003 109.679 -179.71 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 331' ' ' GLN . . . . . 0.42 ' OE1' ' O ' ' C' ' 328' ' ' PHE . 9.2 tp-100 -87.05 114.09 23.36 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.15 -0.969 . . . . 0.91000000000000003 109.325 179.692 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 332' ' ' ILE . . . . . 0.758 HG21 ' HA ' ' A' ' 338' ' ' PHE . 57.9 mt -103.96 103.9 15.92 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.59 0 O-C-N 121.22 -0.925 . . . . 0.26000000000000001 109.97 -179.572 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 333' ' ' ARG . . . . . 0.488 ' HG3' ' CD2' ' C' ' 327' ' ' TYR . 5.5 mpt_? -74.19 150.96 40.1 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.191 -0.943 . . . . 2.9199999999999999 109.508 179.477 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 334' ' ' GLY . . . . . . . . . . . . . . . 74.39 131.25 0.22 Allowed Glycine 0 N--CA 1.491 2.349 0 N-CA-C 109.902 -1.279 . . . . 0.40000000000000002 109.902 179.519 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 335' ' ' ARG . . . . . 0.494 ' NH1' ' HG2' ' A' ' 335' ' ' ARG . 1.9 ttt-85 -79.39 -27.96 41.86 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.47 -1.018 . . . . 3.0099999999999998 109.585 179.976 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 336' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -58.13 -66.95 0.4 Allowed 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.344 -0.847 . . . . 2.29 109.781 -179.953 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 337' ' ' ARG . . . . . 0.48 ' NH2' ' OD1' ' C' ' 352' ' ' ASP . 3.0 mtt180 -60.17 -29.57 68.77 Favored 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.091 -1.006 . . . . 2.9300000000000002 109.456 -179.817 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 338' ' ' PHE . . . . . 0.758 ' HA ' HG21 ' A' ' 332' ' ' ILE . 54.9 t80 -55.56 -60.09 3.92 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.129 -0.982 . . . . 0.38 109.802 -179.901 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 339' ' ' GLU . . . . . . . . . . . . . 1.6 mm-40 -50.41 -34.88 26.06 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.291 -0.881 . . . . 1.97 109.701 -179.609 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 340' ' ' MET . . . . . . . . . . . . . 41.8 ttp -63.3 -48.4 78.23 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.155 -0.966 . . . . 0.31 109.751 -179.83 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 341' ' ' PHE . . . . . . . . . . . . . 44.6 m-85 -62.21 -53.15 59.39 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.213 -0.929 . . . . 0.17999999999999999 109.704 -179.956 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 342' ' ' ARG . . . . . 0.458 ' CG ' ' NH1' ' A' ' 342' ' ' ARG . 0.0 OUTLIER -45.68 -41.27 10.24 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.351 -0.843 . . . . 2.4199999999999999 109.832 -179.881 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 343' ' ' GLU . . . . . . . . . . . . . 8.8 tp10 -59.37 -46.65 88.07 Favored 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.2 -0.937 . . . . 2.3500000000000001 109.661 -179.816 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 344' ' ' LEU . . . . . 0.681 HD22 HD22 ' B' ' 344' ' ' LEU . 56.9 mt -62.06 -44.49 96.58 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.153 -0.967 . . . . 0.17999999999999999 110.112 -179.586 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 345' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -55.68 -43.15 76.09 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.176 -0.953 . . . . 1.0900000000000001 109.626 -179.625 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 346' ' ' GLU . . . . . . . . . . . . . 43.4 tt0 -61.13 -38.69 87.25 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.085 -1.009 . . . . 1.6499999999999999 109.362 -179.921 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 347' ' ' ALA . . . . . 1.003 ' HB1' ' HB1' ' B' ' 347' ' ' ALA . . . -60.03 -50.27 74.39 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.305 -0.872 . . . . 0.17999999999999999 109.898 -179.758 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 348' ' ' LEU . . . . . 0.559 HD22 ' N ' ' A' ' 348' ' ' LEU . 3.9 mm? -61.05 -47.3 86.99 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.235 -0.916 . . . . 0.29999999999999999 110.065 -179.413 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 349' ' ' GLU . . . . . . . . . . . . . 1.6 mm-40 -57.54 -36.27 71.4 Favored 'General case' 0 N--CA 1.489 1.485 0 O-C-N 121.213 -0.929 . . . . 1.9399999999999999 109.821 -179.347 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 350' ' ' LEU . . . . . 0.696 HD13 HD22 ' B' ' 350' ' ' LEU . 5.2 tt -62.07 -44.71 96.09 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.13 -0.981 . . . . 0.46000000000000002 109.073 -179.992 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 351' ' ' LYS . . . . . . . . . . . . . 26.1 tttp -58.21 -44.83 88.35 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.31 -0.869 . . . . 1.3999999999999999 109.239 179.762 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 352' ' ' ASP . . . . . . . . . . . . . 5.4 m-20 -56.46 -41.16 76.03 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.256 -0.903 . . . . 1.1599999999999999 109.461 179.893 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 353' ' ' ALA . . . . . . . . . . . . . . . -67.45 -32.83 73.95 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.35 -0.844 . . . . 0.63 109.32 -179.963 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 354' ' ' GLN . . . . . . . . . . . . . 44.9 tt0 . . . . . 0 N--CA 1.489 1.489 0 O-C-N 121.179 -0.951 . . . . 1.47 109.167 179.693 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' B' B ' 326' ' ' GLU . . . . . . . . . . . . . 2.7 mt-10 . . . . . 0 N--CA 1.489 1.489 0 CA-C-O 121.247 0.546 . . . . 2.1299999999999999 109.631 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' B' B ' 327' ' ' TYR . . . . . . . . . . . . . 41.3 m-85 -149.91 112.65 4.78 Favored 'General case' 0 N--CA 1.489 1.491 0 O-C-N 121.089 -1.007 . . . . 0.47999999999999998 109.635 179.751 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 328' ' ' PHE . . . . . 0.446 ' O ' ' OE1' ' D' ' 331' ' ' GLN . 67.7 m-85 -113.57 -172.75 2.13 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.439 -0.788 . . . . 0.32000000000000001 109.244 179.879 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 329' ' ' THR . . . . . . . . . . . . . 37.1 p -151.81 168.95 23.48 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.134 -0.979 . . . . 0.23000000000000001 109.515 -179.799 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 330' ' ' LEU . . . . . . . . . . . . . 20.8 tp -152.29 132.66 13.71 Favored 'General case' 0 C--N 1.304 -1.398 0 O-C-N 121.039 -1.038 . . . . 0.28000000000000003 109.532 -179.726 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 331' ' ' GLN . . . . . . . . . . . . . 9.0 tp-100 -87.03 114.01 23.27 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.33 -0.856 . . . . 0.91000000000000003 109.354 179.727 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 332' ' ' ILE . . . . . 0.753 HG21 ' HA ' ' B' ' 338' ' ' PHE . 57.4 mt -103.94 103.54 15.37 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.633 0 O-C-N 121.151 -0.968 . . . . 0.23999999999999999 110.11 -179.598 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 333' ' ' ARG . . . . . 0.494 ' CG ' ' CE1' ' D' ' 327' ' ' TYR . 5.7 mpt_? -73.65 150.8 41.07 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.193 -0.942 . . . . 2.9300000000000002 109.399 179.798 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 334' ' ' GLY . . . . . . . . . . . . . . . 74.8 131.07 0.24 Allowed Glycine 0 N--CA 1.49 2.264 0 N-CA-C 109.857 -1.297 . . . . 0.40000000000000002 109.857 179.417 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 335' ' ' ARG . . . . . 0.507 ' NH1' ' HG2' ' B' ' 335' ' ' ARG . 1.9 ttt-85 -79.46 -27.48 41.6 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.442 -1.034 . . . . 3.0099999999999998 109.605 -179.976 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 336' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -58.42 -66.84 0.42 Allowed 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.341 -0.849 . . . . 2.2799999999999998 109.63 -179.902 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 337' ' ' ARG . . . . . . . . . . . . . 3.0 mtt180 -60.23 -29.4 68.73 Favored 'General case' 0 N--CA 1.489 1.492 0 O-C-N 121.202 -0.936 . . . . 2.9300000000000002 109.653 -179.841 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 338' ' ' PHE . . . . . 0.753 ' HA ' HG21 ' B' ' 332' ' ' ILE . 58.5 t80 -55.53 -60.0 4.04 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.257 -0.902 . . . . 0.37 109.872 -179.877 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 339' ' ' GLU . . . . . . . . . . . . . 1.9 mm-40 -50.66 -35.16 29.38 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.347 -0.845 . . . . 1.98 109.687 -179.615 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 340' ' ' MET . . . . . . . . . . . . . 43.4 ttp -63.19 -48.49 78.14 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.164 -0.96 . . . . 0.32000000000000001 109.722 -179.702 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 341' ' ' PHE . . . . . . . . . . . . . 45.4 m-85 -62.56 -52.31 63.91 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.124 -0.985 . . . . 0.17999999999999999 109.81 179.933 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 342' ' ' ARG . . . . . 0.439 ' CG ' HH11 ' B' ' 342' ' ' ARG . 0.0 OUTLIER -46.26 -40.98 12.4 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.266 -0.896 . . . . 2.4199999999999999 109.693 -179.803 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' B' B ' 343' ' ' GLU . . . . . . . . . . . . . 8.9 tp10 -59.52 -46.47 88.75 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.255 -0.903 . . . . 2.3500000000000001 109.611 -179.816 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 344' ' ' LEU . . . . . 0.681 HD22 HD22 ' A' ' 344' ' ' LEU . 57.7 mt -62.18 -44.88 95.62 Favored 'General case' 0 N--CA 1.49 1.525 0 O-C-N 121.177 -0.952 . . . . 0.17999999999999999 110.219 -179.608 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 345' ' ' ASN . . . . . 0.535 HD22 HD11 ' D' ' 330' ' ' LEU . 43.1 t-20 -55.59 -42.64 75.08 Favored 'General case' 0 N--CA 1.489 1.476 0 O-C-N 121.177 -0.952 . . . . 1.0900000000000001 109.694 -179.532 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 346' ' ' GLU . . . . . . . . . . . . . 40.9 tt0 -61.06 -39.02 88.28 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.251 -0.905 . . . . 1.6599999999999999 109.391 -179.894 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 347' ' ' ALA . . . . . 1.003 ' HB1' ' HB1' ' A' ' 347' ' ' ALA . . . -60.21 -50.17 74.71 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.324 -0.86 . . . . 0.17000000000000001 109.964 -179.857 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 348' ' ' LEU . . . . . 0.56 HD22 ' N ' ' B' ' 348' ' ' LEU . 3.9 mm? -60.81 -47.53 85.91 Favored 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.285 -0.884 . . . . 0.28999999999999998 109.973 -179.369 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 349' ' ' GLU . . . . . . . . . . . . . 1.5 mm-40 -57.65 -35.56 70.69 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.222 -0.923 . . . . 1.95 109.983 -179.574 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 350' ' ' LEU . . . . . 0.696 HD22 HD13 ' A' ' 350' ' ' LEU . 5.2 tt -62.67 -44.69 95.6 Favored 'General case' 0 N--CA 1.489 1.505 0 O-C-N 120.968 -1.083 . . . . 0.45000000000000001 108.999 179.799 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 351' ' ' LYS . . . . . . . . . . . . . 28.2 tttp -58.82 -44.69 90.9 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.195 -0.941 . . . . 1.3799999999999999 109.428 179.647 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 352' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 -56.44 -41.85 77.15 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.261 -0.899 . . . . 1.1599999999999999 109.286 179.659 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 353' ' ' ALA . . . . . . . . . . . . . . . -66.63 -32.77 74.31 Favored 'General case' 0 N--CA 1.494 1.749 0 O-C-N 121.27 -0.894 . . . . 0.60999999999999999 109.47 179.656 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 354' ' ' GLN . . . . . . . . . . . . . 45.7 tt0 . . . . . 0 C--N 1.304 -1.387 0 O-C-N 121.222 -0.924 . . . . 1.45 109.38 179.951 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' C' C ' 326' ' ' GLU . . . . . . . . . . . . . 11.6 mm-40 . . . . . 0 N--CA 1.49 1.572 0 CA-C-O 121.248 0.547 . . . . 2.1699999999999999 109.578 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' C' C ' 327' ' ' TYR . . . . . 0.488 ' CD2' ' HG3' ' A' ' 333' ' ' ARG . 59.5 m-85 -150.85 103.21 3.05 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.176 -0.953 . . . . 0.47999999999999998 109.698 -179.877 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' C' C ' 328' ' ' PHE . . . . . 0.439 ' C ' HG23 ' C' ' 329' ' ' THR . 38.3 m-85 -102.13 -169.13 1.63 Allowed 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.294 -0.879 . . . . 0.33000000000000002 109.432 -179.984 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' C' C ' 329' ' ' THR . . . . . 0.463 ' HA ' ' O ' ' A' ' 330' ' ' LEU . 68.1 p -154.41 170.4 21.46 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.107 -0.996 . . . . 0.23000000000000001 109.259 179.991 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' C' C ' 330' ' ' LEU . . . . . . . . . . . . . 22.6 tp -151.31 124.76 8.91 Favored 'General case' 0 N--CA 1.489 1.495 0 O-C-N 121.272 -0.893 . . . . 0.28000000000000003 109.746 -179.692 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' C' C ' 331' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -87.24 112.49 22.07 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.289 -0.882 . . . . 1.48 109.189 179.522 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' C' C ' 332' ' ' ILE . . . . . 0.541 HG21 ' HA ' ' C' ' 338' ' ' PHE . 94.2 mt -103.84 111.12 32.28 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.528 0 O-C-N 121.105 -0.997 . . . . 0.23999999999999999 109.632 -179.895 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' C' C ' 333' ' ' ARG . . . . . 0.535 ' HG2' ' CE1' ' A' ' 327' ' ' TYR . 61.2 mtm180 -74.24 141.78 45.36 Favored 'General case' 0 C--N 1.301 -1.503 0 O-C-N 121.458 -0.776 . . . . 2.7400000000000002 109.517 179.718 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' C' C ' 334' ' ' GLY . . . . . . . . . . . . . . . 86.73 132.85 3.43 Favored Glycine 0 N--CA 1.492 2.381 0 N-CA-C 109.667 -1.373 . . . . 0.34999999999999998 109.667 179.921 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' C' C ' 335' ' ' ARG . . . . . . . . . . . . . 6.6 ttm180 -78.28 -27.21 47.36 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.264 -1.139 . . . . 2.5299999999999998 109.437 179.889 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' C' C ' 336' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -58.02 -70.76 0.13 Allowed 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.411 -0.805 . . . . 2.6200000000000001 110.126 -179.864 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' C' C ' 337' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -57.98 -30.66 66.21 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.328 -0.857 . . . . 2.8100000000000001 109.677 -179.372 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' C' C ' 338' ' ' PHE . . . . . 0.541 ' HA ' HG21 ' C' ' 332' ' ' ILE . 77.8 t80 -53.38 -60.39 3.36 Favored 'General case' 0 C--N 1.303 -1.438 0 O-C-N 121.167 -0.958 . . . . 0.40000000000000002 109.545 -179.797 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' C' C ' 339' ' ' GLU . . . . . . . . . . . . . 51.5 mt-10 -51.22 -32.41 23.94 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.391 -0.818 . . . . 2.0499999999999998 109.954 -179.64 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' C' C ' 340' ' ' MET . . . . . . . . . . . . . 59.2 ttp -64.16 -51.12 65.38 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.222 -0.923 . . . . 0.32000000000000001 109.643 -179.944 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' C' C ' 341' ' ' PHE . . . . . . . . . . . . . 49.3 m-85 -62.08 -49.86 74.25 Favored 'General case' 0 N--CA 1.489 1.495 0 O-C-N 121.184 -0.948 . . . . 0.17999999999999999 110.022 -179.597 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' C' C ' 342' ' ' ARG . . . . . 0.419 ' O ' ' HB3' ' C' ' 345' ' ' ASN . 22.7 tpt180 -49.32 -37.41 24.21 Favored 'General case' 0 N--CA 1.488 1.451 0 O-C-N 121.09 -1.006 . . . . 2.9100000000000001 109.552 -179.879 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' C' C ' 343' ' ' GLU . . . . . . . . . . . . . 1.1 tp10 -59.18 -52.33 66.16 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.233 -0.917 . . . . 2.1400000000000001 109.566 179.868 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' C' C ' 344' ' ' LEU . . . . . 0.626 HD22 HD22 ' D' ' 344' ' ' LEU . 60.0 mt -62.59 -25.5 68.11 Favored 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.157 -0.964 . . . . 0.22 109.242 179.803 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' C' C ' 345' ' ' ASN . . . . . 0.419 ' HB3' ' O ' ' C' ' 342' ' ' ARG . 16.2 t-20 -57.86 -56.8 17.28 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.414 -0.803 . . . . 1.0800000000000001 109.383 -179.896 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' C' C ' 346' ' ' GLU . . . . . . . . . . . . . 20.8 tt0 -62.03 -29.45 70.29 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.34 -0.85 . . . . 2.21 110.042 -179.641 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' C' C ' 347' ' ' ALA . . . . . 0.996 ' HB1' ' HB1' ' D' ' 347' ' ' ALA . . . -61.29 -54.54 42.75 Favored 'General case' 0 N--CA 1.494 1.74 0 O-C-N 121.018 -1.051 . . . . 0.17999999999999999 110.199 -179.311 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' C' C ' 348' ' ' LEU . . . . . 0.568 ' N ' HD22 ' C' ' 348' ' ' LEU . 4.2 mm? -61.7 -51.49 68.18 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.318 -0.864 . . . . 0.32000000000000001 110.463 -179.402 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' C' C ' 349' ' ' GLU . . . . . . . . . . . . . 11.5 mt-10 -57.41 -33.37 67.79 Favored 'General case' 0 N--CA 1.494 1.757 0 O-C-N 121.11 -0.994 . . . . 2.1899999999999999 110.244 -179.352 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' C' C ' 350' ' ' LEU . . . . . 0.809 HD22 HD13 ' D' ' 350' ' ' LEU . 9.3 tt -62.9 -42.86 99.93 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.116 -0.99 . . . . 0.46000000000000002 109.365 -179.758 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' C' C ' 351' ' ' LYS . . . . . . . . . . . . . 38.4 tttp -60.14 -51.62 68.82 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.288 -0.882 . . . . 1.3500000000000001 109.445 179.547 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' C' C ' 352' ' ' ASP . . . . . 0.48 ' OD1' ' NH2' ' A' ' 337' ' ' ARG . 18.1 m-20 -55.46 -37.91 68.37 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.297 -0.877 . . . . 1.1899999999999999 109.84 179.887 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' C' C ' 353' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 1.565 0 O-C-N 121.298 -0.876 . . . . 0.56999999999999995 109.958 -179.581 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' D' D ' 326' ' ' GLU . . . . . . . . . . . . . 2.6 mt-10 . . . . . 0 N--CA 1.491 1.578 0 N-CA-C 109.469 -0.567 . . . . 2.1299999999999999 109.469 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' D' D ' 327' ' ' TYR . . . . . 0.494 ' CE1' ' CG ' ' B' ' 333' ' ' ARG . 42.5 m-85 -150.53 112.49 4.55 Favored 'General case' 0 N--CA 1.488 1.442 0 O-C-N 121.204 -0.935 . . . . 0.46999999999999997 109.421 179.913 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' D' D ' 328' ' ' PHE . . . . . 0.411 ' HB2' ' CD1' ' B' ' 338' ' ' PHE . 69.7 m-85 -114.06 -173.02 2.2 Favored 'General case' 0 N--CA 1.489 1.52 0 N-CA-C 108.985 -0.746 . . . . 0.29999999999999999 108.985 179.802 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' D' D ' 329' ' ' THR . . . . . . . . . . . . . 39.7 p -151.44 169.65 21.52 Favored 'General case' 0 C--N 1.302 -1.473 0 O-C-N 121.288 -0.883 . . . . 0.22 109.379 -179.916 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' D' D ' 330' ' ' LEU . . . . . 0.535 HD11 HD22 ' B' ' 345' ' ' ASN . 19.5 tp -152.4 132.4 13.41 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.311 -0.868 . . . . 0.28000000000000003 109.706 -179.767 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' D' D ' 331' ' ' GLN . . . . . 0.446 ' OE1' ' O ' ' B' ' 328' ' ' PHE . 9.0 tp-100 -86.83 113.77 22.92 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.313 -0.867 . . . . 0.93000000000000005 109.306 179.639 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' D' D ' 332' ' ' ILE . . . . . 0.747 HG21 ' HA ' ' D' ' 338' ' ' PHE . 54.3 mt -103.72 102.97 14.46 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.746 0 O-C-N 121.242 -0.911 . . . . 0.25 110.235 -179.593 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' D' D ' 333' ' ' ARG . . . . . . . . . . . . . 5.6 mpt_? -73.45 150.92 41.31 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.027 -1.045 . . . . 2.9300000000000002 109.639 179.615 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' D' D ' 334' ' ' GLY . . . . . . . . . . . . . . . 74.86 130.73 0.24 Allowed Glycine 0 N--CA 1.491 2.33 0 N-CA-C 109.836 -1.305 . . . . 0.40999999999999998 109.836 179.57 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' D' D ' 335' ' ' ARG . . . . . 0.507 ' NH1' ' HG2' ' D' ' 335' ' ' ARG . 1.9 ttt-85 -79.06 -27.88 43.14 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.299 -1.118 . . . . 3.0299999999999998 109.642 -179.997 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' D' D ' 336' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -57.71 -66.54 0.45 Allowed 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.21 -0.931 . . . . 2.2599999999999998 109.695 -179.937 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' D' D ' 337' ' ' ARG . . . . . . . . . . . . . 2.9 mpt_? -60.73 -29.29 69.28 Favored 'General case' 0 N--CA 1.489 1.486 0 O-C-N 121.223 -0.923 . . . . 2.9199999999999999 109.386 -179.772 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' D' D ' 338' ' ' PHE . . . . . 0.747 ' HA ' HG21 ' D' ' 332' ' ' ILE . 57.1 t80 -55.52 -60.55 3.26 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.19 -0.944 . . . . 0.37 109.611 -179.785 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' D' D ' 339' ' ' GLU . . . . . . . . . . . . . 2.2 mm-40 -49.91 -34.9 21.8 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.259 -0.901 . . . . 1.99 109.898 -179.745 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' D' D ' 340' ' ' MET . . . . . . . . . . . . . 42.0 ttp -63.36 -48.87 76.15 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.144 -0.972 . . . . 0.31 109.796 -179.663 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' D' D ' 341' ' ' PHE . . . . . . . . . . . . . 45.9 m-85 -62.39 -52.64 62.81 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.137 -0.977 . . . . 0.17999999999999999 109.583 -179.875 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' D' D ' 342' ' ' ARG . . . . . 0.457 ' CG ' HH11 ' D' ' 342' ' ' ARG . 0.0 OUTLIER -45.78 -40.58 9.8 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.24 -0.913 . . . . 2.4100000000000001 109.638 -179.896 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' D' D ' 343' ' ' GLU . . . . . . . . . . . . . 9.1 tp10 -59.67 -46.56 88.67 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.171 -0.956 . . . . 2.3500000000000001 109.724 -179.835 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' D' D ' 344' ' ' LEU . . . . . 0.626 HD22 HD22 ' C' ' 344' ' ' LEU . 57.1 mt -62.5 -44.92 95.19 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.289 -0.882 . . . . 0.19 110.186 -179.374 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' D' D ' 345' ' ' ASN . . . . . . . . . . . . . 44.9 t-20 -55.52 -42.47 74.58 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.176 -0.953 . . . . 1.0900000000000001 109.632 -179.622 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' D' D ' 346' ' ' GLU . . . . . . . . . . . . . 33.7 tt0 -60.86 -39.49 89.36 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.204 -0.935 . . . . 1.6899999999999999 109.614 -179.962 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' D' D ' 347' ' ' ALA . . . . . 0.996 ' HB1' ' HB1' ' C' ' 347' ' ' ALA . . . -60.5 -49.62 76.83 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.393 -0.817 . . . . 0.17999999999999999 109.97 -179.861 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' D' D ' 348' ' ' LEU . . . . . 0.555 HD22 ' N ' ' D' ' 348' ' ' LEU . 3.9 mm? -60.93 -47.18 87.62 Favored 'General case' 0 N--CA 1.493 1.711 0 O-C-N 121.237 -0.914 . . . . 0.31 110.024 -179.327 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' D' D ' 349' ' ' GLU . . . . . . . . . . . . . 1.4 mm-40 -58.12 -36.01 72.32 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.11 -0.994 . . . . 1.95 109.796 -179.66 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' D' D ' 350' ' ' LEU . . . . . 0.809 HD13 HD22 ' C' ' 350' ' ' LEU . 5.2 tt -62.32 -44.54 96.26 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.124 -0.985 . . . . 0.42999999999999999 109.01 -179.971 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' D' D ' 351' ' ' LYS . . . . . . . . . . . . . 28.4 tttp -59.09 -44.64 91.93 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.292 -0.88 . . . . 1.3999999999999999 109.289 179.767 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' D' D ' 352' ' ' ASP . . . . . . . . . . . . . 4.2 m-20 -56.66 -41.2 76.81 Favored 'General case' 0 N--CA 1.488 1.434 0 O-C-N 121.343 -0.848 . . . . 1.1699999999999999 109.255 179.823 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' D' D ' 353' ' ' ALA . . . . . . . . . . . . . . . -67.63 -31.81 72.08 Favored 'General case' 0 N--CA 1.488 1.447 0 O-C-N 121.22 -0.925 . . . . 0.58999999999999997 109.31 -179.799 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' D' D ' 354' ' ' GLN . . . . . . . . . . . . . 44.8 tt0 . . . . . 0 N--CA 1.49 1.557 0 O-C-N 121.442 -0.786 . . . . 1.4399999999999999 109.485 179.897 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 326' ' ' GLU . . . . . . . . . . . . . 19.9 mm-40 . . . . . 0 N--CA 1.487 1.422 0 N-CA-C 109.217 -0.66 . . . . 2.1299999999999999 109.217 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 327' ' ' TYR . . . . . 0.606 ' CE2' ' HG2' ' C' ' 333' ' ' ARG . 42.4 m-85 -148.14 109.24 4.29 Favored 'General case' 0 C--N 1.302 -1.499 0 O-C-N 121.317 -0.864 . . . . 0.47999999999999998 109.318 -179.938 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 328' ' ' PHE . . . . . 0.417 ' C ' HG23 ' A' ' 329' ' ' THR . 81.5 m-85 -110.65 -170.22 1.6 Allowed 'General case' 0 N--CA 1.488 1.446 0 O-C-N 121.356 -0.84 . . . . 0.31 109.344 -179.901 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 329' ' ' THR . . . . . 0.417 HG23 ' C ' ' A' ' 328' ' ' PHE . 73.2 p -153.7 162.22 41.43 Favored 'General case' 0 C--N 1.302 -1.462 0 O-C-N 121.267 -0.896 . . . . 0.22 109.3 -179.905 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 330' ' ' LEU . . . . . 0.481 ' O ' ' HA ' ' C' ' 329' ' ' THR . 15.8 tp -149.32 130.06 14.14 Favored 'General case' 0 N--CA 1.488 1.434 0 O-C-N 121.166 -0.959 . . . . 0.28000000000000003 109.367 -179.752 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 331' ' ' GLN . . . . . . . . . . . . . 2.0 tp60 -86.03 121.64 28.93 Favored 'General case' 0 N--CA 1.489 1.482 0 O-C-N 121.35 -0.844 . . . . 0.91000000000000003 109.54 -179.906 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 332' ' ' ILE . . . . . 0.875 HG21 ' HA ' ' A' ' 338' ' ' PHE . 72.1 mt -103.45 103.73 15.59 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.561 0 O-C-N 121.238 -0.914 . . . . 0.26000000000000001 109.425 -179.999 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 333' ' ' ARG . . . . . 0.559 ' HG2' ' CE1' ' C' ' 327' ' ' TYR . 0.3 OUTLIER -72.68 146.24 46.66 Favored 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.258 -0.901 . . . . 2.9199999999999999 109.461 -179.985 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 334' ' ' GLY . . . . . . . . . . . . . . . 75.68 119.67 0.13 Allowed Glycine 0 N--CA 1.491 2.319 0 N-CA-C 109.621 -1.392 . . . . 0.40000000000000002 109.621 179.993 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 335' ' ' ARG . . . . . 0.456 ' O ' ' HB3' ' A' ' 338' ' ' PHE . 1.8 ttt180 -65.6 -27.31 68.31 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.308 -1.113 . . . . 3.0099999999999998 109.612 179.951 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 336' ' ' GLU . . . . . . . . . . . . . 23.4 tt0 -57.37 -63.79 1.11 Allowed 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.198 -0.939 . . . . 2.29 109.656 -179.941 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 337' ' ' ARG . . . . . 0.54 ' HG3' ' NH1' ' A' ' 337' ' ' ARG . 0.6 OUTLIER -60.03 -27.15 66.68 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.193 -0.942 . . . . 2.9300000000000002 109.376 -179.93 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 338' ' ' PHE . . . . . 0.875 ' HA ' HG21 ' A' ' 332' ' ' ILE . 83.8 t80 -55.31 -61.61 2.22 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.38 -0.825 . . . . 0.38 109.841 -179.808 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 339' ' ' GLU . . . . . . . . . . . . . 18.0 mt-10 -51.54 -33.62 32.89 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.26 -0.9 . . . . 1.97 110.164 -179.543 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 340' ' ' MET . . . . . . . . . . . . . 38.0 ttp -64.38 -52.7 56.96 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.126 -0.984 . . . . 0.31 110.453 -179.353 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 341' ' ' PHE . . . . . . . . . . . . . 42.5 m-85 -62.1 -46.22 90.02 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.164 -0.96 . . . . 0.17999999999999999 110.142 -179.284 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 342' ' ' ARG . . . . . 0.451 ' CG ' HH11 ' A' ' 342' ' ' ARG . 0.0 OUTLIER -48.17 -38.51 18.27 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.054 -1.029 . . . . 2.4199999999999999 109.883 -179.678 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 343' ' ' GLU . . . . . . . . . . . . . 33.3 tt0 -59.76 -51.27 70.5 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.113 -0.992 . . . . 2.3500000000000001 109.833 -179.757 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 344' ' ' LEU . . . . . 0.652 HD22 HD22 ' B' ' 344' ' ' LEU . 34.9 mt -61.57 -31.39 71.43 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.154 -0.966 . . . . 0.17999999999999999 109.556 -179.817 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 345' ' ' ASN . . . . . . . . . . . . . 13.2 t-20 -57.82 -60.3 3.91 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.297 -0.877 . . . . 1.0900000000000001 109.72 -179.868 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 346' ' ' GLU . . . . . . . . . . . . . 26.1 tt0 -61.25 -26.45 67.77 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.295 -0.878 . . . . 1.6499999999999999 109.916 -179.723 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 347' ' ' ALA . . . . . 0.879 ' HB1' ' HB1' ' B' ' 347' ' ' ALA . . . -61.11 -58.98 6.12 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.196 -0.94 . . . . 0.17999999999999999 109.966 -179.81 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 348' ' ' LEU . . . . . 0.784 HD12 ' NH2' ' C' ' 337' ' ' ARG . 3.8 mm? -62.22 -42.19 99.08 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.237 -0.914 . . . . 0.29999999999999999 109.974 -179.541 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 349' ' ' GLU . . . . . . . . . . . . . 31.5 mt-10 -57.67 -37.51 73.54 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.209 -0.932 . . . . 1.9399999999999999 110.209 -179.287 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 350' ' ' LEU . . . . . 0.699 HD13 HD22 ' B' ' 350' ' ' LEU . 6.0 tt -64.37 -44.38 91.58 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.142 -0.974 . . . . 0.46000000000000002 109.943 -179.573 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 351' ' ' LYS . . . . . . . . . . . . . 40.1 tttp -57.96 -37.67 74.6 Favored 'General case' 0 N--CA 1.488 1.466 0 O-C-N 121.093 -1.004 . . . . 1.3999999999999999 109.508 -179.676 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 352' ' ' ASP . . . . . . . . . . . . . 11.3 m-20 -55.34 -41.44 72.51 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.278 -0.889 . . . . 1.1599999999999999 109.42 179.868 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 353' ' ' ALA . . . . . . . . . . . . . . . -67.81 -30.76 70.26 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.282 -0.886 . . . . 0.63 109.707 -179.866 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 354' ' ' GLN . . . . . . . . . . . . . 4.8 mt-30 . . . . . 0 N--CA 1.492 1.636 0 O-C-N 121.154 -0.966 . . . . 1.47 109.631 -179.948 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' B' B ' 326' ' ' GLU . . . . . . . . . . . . . 20.0 mm-40 . . . . . 0 N--CA 1.487 1.421 0 N-CA-C 109.138 -0.689 . . . . 2.1299999999999999 109.138 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' B' B ' 327' ' ' TYR . . . . . 0.466 ' CE1' ' HG2' ' D' ' 333' ' ' ARG . 41.7 m-85 -148.4 109.24 4.24 Favored 'General case' 0 N--CA 1.488 1.471 0 O-C-N 121.24 -0.913 . . . . 0.47999999999999998 109.345 179.988 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 328' ' ' PHE . . . . . 0.413 ' C ' HG23 ' B' ' 329' ' ' THR . 81.3 m-85 -110.56 -170.23 1.6 Allowed 'General case' 0 N--CA 1.489 1.488 0 O-C-N 121.287 -0.883 . . . . 0.32000000000000001 109.374 -179.869 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 329' ' ' THR . . . . . 0.413 HG23 ' C ' ' B' ' 328' ' ' PHE . 73.6 p -153.68 162.17 41.48 Favored 'General case' 0 N--CA 1.488 1.443 0 O-C-N 121.254 -0.904 . . . . 0.23000000000000001 109.312 -179.99 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 330' ' ' LEU . . . . . . . . . . . . . 15.9 tp -149.13 130.18 14.42 Favored 'General case' 0 N--CA 1.488 1.469 0 O-C-N 121.288 -0.883 . . . . 0.28000000000000003 109.476 -179.869 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 331' ' ' GLN . . . . . . . . . . . . . 2.0 tp60 -86.02 121.52 28.76 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.283 -0.885 . . . . 0.91000000000000003 109.563 -179.957 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 332' ' ' ILE . . . . . 0.873 HG21 ' HA ' ' B' ' 338' ' ' PHE . 71.7 mt -103.37 103.7 15.53 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.526 0 O-C-N 121.248 -0.907 . . . . 0.23999999999999999 109.519 179.889 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 333' ' ' ARG . . . . . 0.5 ' HG2' ' CE1' ' D' ' 327' ' ' TYR . 0.3 OUTLIER -72.6 146.22 46.81 Favored 'General case' 0 N--CA 1.489 1.487 0 O-C-N 121.219 -0.925 . . . . 2.9300000000000002 109.527 179.941 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' B' B ' 334' ' ' GLY . . . . . . . . . . . . . . . 75.78 119.56 0.13 Allowed Glycine 0 N--CA 1.49 2.242 0 N-CA-C 109.63 -1.388 . . . . 0.40000000000000002 109.63 179.992 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 335' ' ' ARG . . . . . 0.483 ' HG3' ' CZ ' ' D' ' 328' ' ' PHE . 1.8 ttt180 -65.61 -27.39 68.37 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.267 -1.137 . . . . 3.0099999999999998 109.462 -179.961 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 336' ' ' GLU . . . . . . . . . . . . . 23.5 tt0 -57.38 -63.73 1.13 Allowed 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.264 -0.897 . . . . 2.2799999999999998 109.615 -179.873 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 337' ' ' ARG . . . . . 0.562 ' NH1' ' HG3' ' B' ' 337' ' ' ARG . 0.5 OUTLIER -59.88 -27.24 66.53 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.237 -0.914 . . . . 2.9300000000000002 109.417 179.937 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' B' B ' 338' ' ' PHE . . . . . 0.873 ' HA ' HG21 ' B' ' 332' ' ' ILE . 84.4 t80 -55.38 -61.48 2.31 Favored 'General case' 0 N--CA 1.488 1.455 0 O-C-N 121.273 -0.892 . . . . 0.37 109.865 -179.722 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 339' ' ' GLU . . . . . . . . . . . . . 18.0 mt-10 -51.67 -33.48 34.03 Favored 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.176 -0.953 . . . . 1.98 110.171 -179.533 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 340' ' ' MET . . . . . . . . . . . . . 38.1 ttp -64.5 -52.75 56.23 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.08 -1.012 . . . . 0.32000000000000001 110.388 -179.312 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 341' ' ' PHE . . . . . . . . . . . . . 42.2 m-85 -61.96 -46.42 89.35 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.115 -0.99 . . . . 0.17999999999999999 110.08 -179.285 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 342' ' ' ARG . . . . . 0.455 ' NH1' ' CG ' ' B' ' 342' ' ' ARG . 0.0 OUTLIER -47.98 -38.83 17.78 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.202 -0.936 . . . . 2.4199999999999999 109.868 -179.691 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' B' B ' 343' ' ' GLU . . . . . . . . . . . . . 33.1 tt0 -59.45 -51.35 70.26 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.139 -0.976 . . . . 2.3500000000000001 109.818 -179.731 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 344' ' ' LEU . . . . . 0.652 HD22 HD22 ' A' ' 344' ' ' LEU . 34.3 mt -61.57 -31.5 71.55 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.144 -0.972 . . . . 0.17999999999999999 109.586 -179.757 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 345' ' ' ASN . . . . . . . . . . . . . 13.1 t-20 -57.86 -60.14 4.16 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.302 -0.874 . . . . 1.0900000000000001 109.747 -179.849 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 346' ' ' GLU . . . . . . . . . . . . . 26.1 tt0 -61.28 -26.63 67.9 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.34 -0.85 . . . . 1.6599999999999999 109.745 -179.736 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 347' ' ' ALA . . . . . 0.879 ' HB1' ' HB1' ' A' ' 347' ' ' ALA . . . -60.93 -59.17 5.8 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.125 -0.984 . . . . 0.17000000000000001 109.934 -179.702 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 348' ' ' LEU . . . . . 0.578 HD22 ' N ' ' B' ' 348' ' ' LEU . 3.8 mm? -62.01 -42.15 98.85 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.212 -0.93 . . . . 0.28999999999999998 110.042 -179.526 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 349' ' ' GLU . . . . . . . . . . . . . 31.6 mt-10 -57.81 -37.38 73.68 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.145 -0.972 . . . . 1.95 110.246 -179.303 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 350' ' ' LEU . . . . . 0.699 HD22 HD13 ' A' ' 350' ' ' LEU . 6.0 tt -64.45 -44.28 91.59 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.163 -0.96 . . . . 0.45000000000000001 109.969 -179.565 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 351' ' ' LYS . . . . . . . . . . . . . 40.1 tttp -58.01 -37.73 74.85 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.161 -0.962 . . . . 1.3799999999999999 109.43 -179.704 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 352' ' ' ASP . . . . . . . . . . . . . 11.4 m-20 -55.3 -41.44 72.34 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.219 -0.926 . . . . 1.1599999999999999 109.45 179.829 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 353' ' ' ALA . . . . . . . . . . . . . . . -67.78 -30.75 70.27 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.29 -0.881 . . . . 0.60999999999999999 109.705 -179.891 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 354' ' ' GLN . . . . . . . . . . . . . 4.7 mt-30 . . . . . 0 N--CA 1.491 1.587 0 O-C-N 121.18 -0.95 . . . . 1.45 109.577 -179.863 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' C' C ' 326' ' ' GLU . . . . . . . . . . . . . 9.9 mm-40 . . . . . 0 N--CA 1.488 1.47 0 N-CA-C 109.241 -0.652 . . . . 2.1699999999999999 109.241 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' C' C ' 327' ' ' TYR . . . . . 0.559 ' CE1' ' HG2' ' A' ' 333' ' ' ARG . 41.1 m-85 -148.95 108.16 3.92 Favored 'General case' 0 N--CA 1.488 1.464 0 O-C-N 121.395 -0.816 . . . . 0.47999999999999998 109.257 179.906 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' C' C ' 328' ' ' PHE . . . . . 0.551 ' N ' ' CD1' ' C' ' 328' ' ' PHE . 5.0 m-85 -112.95 -168.41 1.32 Allowed 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.374 -0.829 . . . . 0.33000000000000002 109.251 -179.887 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' C' C ' 329' ' ' THR . . . . . 0.481 ' HA ' ' O ' ' A' ' 330' ' ' LEU . 57.0 p -151.65 174.59 13.29 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.202 -0.936 . . . . 0.23000000000000001 109.376 -179.926 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' C' C ' 330' ' ' LEU . . . . . . . . . . . . . 14.8 tp -151.28 125.93 9.59 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.186 -0.946 . . . . 0.28000000000000003 109.695 -179.736 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' C' C ' 331' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -87.91 114.49 24.57 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.246 -0.909 . . . . 1.48 108.999 179.636 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' C' C ' 332' ' ' ILE . . . . . 0.52 HD13 ' CD2' ' C' ' 341' ' ' PHE . 11.2 mt -103.36 112.36 36.55 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.566 0 O-C-N 121.15 -0.969 . . . . 0.23999999999999999 110.006 -179.73 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' C' C ' 333' ' ' ARG . . . . . 0.606 ' HG2' ' CE2' ' A' ' 327' ' ' TYR . 0.7 OUTLIER -72.6 154.46 40.75 Favored 'General case' 0 N--CA 1.488 1.44 0 O-C-N 121.283 -0.886 . . . . 2.7400000000000002 109.127 179.443 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' C' C ' 334' ' ' GLY . . . . . . . . . . . . . . . 73.84 128.17 0.14 Allowed Glycine 0 N--CA 1.489 2.223 0 N-CA-C 109.552 -1.419 . . . . 0.34999999999999998 109.552 179.956 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' C' C ' 335' ' ' ARG . . . . . 0.414 ' HA ' ' CE1' ' A' ' 328' ' ' PHE . 9.0 ttt180 -73.64 -40.0 64.08 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.324 -1.103 . . . . 2.5299999999999998 109.656 -179.853 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' C' C ' 336' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -56.97 -48.84 77.45 Favored 'General case' 0 N--CA 1.494 1.739 0 O-C-N 121.262 -0.899 . . . . 2.6200000000000001 109.684 -179.789 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' C' C ' 337' ' ' ARG . . . . . 0.784 ' NH2' HD12 ' A' ' 348' ' ' LEU . 0.0 OUTLIER -62.9 -37.76 88.24 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.139 -0.976 . . . . 2.8100000000000001 109.502 179.822 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' C' C ' 338' ' ' PHE . . . . . . . . . . . . . 82.2 t80 -55.16 -51.18 67.3 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.35 -0.844 . . . . 0.40000000000000002 109.861 -179.73 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' C' C ' 339' ' ' GLU . . . . . . . . . . . . . 10.3 mt-10 -52.55 -36.64 56.18 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.113 -0.992 . . . . 2.0499999999999998 110.38 -179.557 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' C' C ' 340' ' ' MET . . . . . . . . . . . . . 35.5 ttp -63.77 -51.52 64.45 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.073 -1.017 . . . . 0.32000000000000001 110.402 -179.262 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' C' C ' 341' ' ' PHE . . . . . 0.52 ' CD2' HD13 ' C' ' 332' ' ' ILE . 40.2 m-85 -61.84 -41.24 97.56 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.146 -0.971 . . . . 0.17999999999999999 110.1 -179.281 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' C' C ' 342' ' ' ARG . . . . . . . . . . . . . 1.4 ttt180 -52.24 -40.97 62.36 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.093 -1.004 . . . . 2.9100000000000001 109.526 179.934 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' C' C ' 343' ' ' GLU . . . . . . . . . . . . . 25.2 tt0 -58.95 -53.87 53.49 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.25 -0.906 . . . . 2.1400000000000001 109.59 -179.743 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' C' C ' 344' ' ' LEU . . . . . 0.512 HD22 HD22 ' D' ' 344' ' ' LEU . 30.6 mt -59.87 -26.08 65.58 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.217 -0.927 . . . . 0.22 108.939 179.915 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' C' C ' 345' ' ' ASN . . . . . . . . . . . . . 6.4 t-20 -59.52 -64.09 1.07 Allowed 'General case' 0 N--CA 1.488 1.453 0 O-C-N 121.414 -0.804 . . . . 1.0800000000000001 109.534 179.823 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' C' C ' 346' ' ' GLU . . . . . . . . . . . . . 9.1 tp10 -62.77 -25.42 68.21 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.396 -0.815 . . . . 2.21 109.972 -179.743 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' C' C ' 347' ' ' ALA . . . . . 0.683 ' HB1' ' HB1' ' D' ' 347' ' ' ALA . . . -60.58 -57.32 13.21 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.185 -0.947 . . . . 0.17999999999999999 109.862 -179.687 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' C' C ' 348' ' ' LEU . . . . . 0.529 ' N ' HD22 ' C' ' 348' ' ' LEU . 3.6 mm? -62.57 -45.0 94.93 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.184 -0.948 . . . . 0.32000000000000001 110.045 -179.503 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' C' C ' 349' ' ' GLU . . . . . 0.42 ' O ' ' HB2' ' C' ' 352' ' ' ASP . 97.7 mt-10 -57.37 -34.4 68.79 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.267 -0.895 . . . . 2.1899999999999999 110.157 -179.312 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' C' C ' 350' ' ' LEU . . . . . 0.814 HD22 HD13 ' D' ' 350' ' ' LEU . 7.9 tt -63.23 -44.55 94.93 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.067 -1.021 . . . . 0.46000000000000002 109.209 -179.929 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' C' C ' 351' ' ' LYS . . . . . . . . . . . . . 62.9 tttm -60.65 -33.29 72.58 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.323 -0.861 . . . . 1.3500000000000001 109.576 179.955 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' C' C ' 352' ' ' ASP . . . . . 0.42 ' HB2' ' O ' ' C' ' 349' ' ' GLU . 4.0 m-20 -52.75 -50.76 62.83 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.164 -0.96 . . . . 1.1899999999999999 109.172 -179.979 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' C' C ' 353' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.488 1.447 0 O-C-N 121.316 -0.865 . . . . 0.56999999999999995 108.968 179.564 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' D' D ' 326' ' ' GLU . . . . . . . . . . . . . 20.0 mm-40 . . . . . 0 N--CA 1.487 1.418 0 N-CA-C 109.229 -0.656 . . . . 2.1299999999999999 109.229 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' D' D ' 327' ' ' TYR . . . . . 0.5 ' CE1' ' HG2' ' B' ' 333' ' ' ARG . 42.1 m-85 -148.23 109.28 4.28 Favored 'General case' 0 C--N 1.303 -1.453 0 O-C-N 121.339 -0.85 . . . . 0.46999999999999997 109.368 -179.998 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' D' D ' 328' ' ' PHE . . . . . 0.483 ' CZ ' ' HG3' ' B' ' 335' ' ' ARG . 81.6 m-85 -110.59 -170.11 1.58 Allowed 'General case' 0 N--CA 1.489 1.487 0 O-C-N 121.346 -0.846 . . . . 0.29999999999999999 109.319 -179.867 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' D' D ' 329' ' ' THR . . . . . 0.42 HG23 ' C ' ' D' ' 328' ' ' PHE . 73.4 p -153.8 162.14 41.49 Favored 'General case' 0 N--CA 1.488 1.449 0 O-C-N 121.222 -0.924 . . . . 0.22 109.271 -179.963 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' D' D ' 330' ' ' LEU . . . . . . . . . . . . . 16.0 tp -149.05 130.24 14.55 Favored 'General case' 0 N--CA 1.489 1.491 0 O-C-N 121.295 -0.878 . . . . 0.28000000000000003 109.43 -179.753 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' D' D ' 331' ' ' GLN . . . . . . . . . . . . . 2.0 tp60 -86.24 121.6 29.06 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.251 -0.906 . . . . 0.93000000000000005 109.474 -179.92 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' D' D ' 332' ' ' ILE . . . . . 0.848 HG21 ' HA ' ' D' ' 338' ' ' PHE . 71.9 mt -103.5 103.54 15.31 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.537 0 O-C-N 121.263 -0.898 . . . . 0.25 109.461 179.969 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' D' D ' 333' ' ' ARG . . . . . 0.466 ' HG2' ' CE1' ' B' ' 327' ' ' TYR . 0.3 OUTLIER -72.5 146.35 46.9 Favored 'General case' 0 N--CA 1.489 1.495 0 O-C-N 121.241 -0.912 . . . . 2.9300000000000002 109.407 179.976 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' D' D ' 334' ' ' GLY . . . . . . . . . . . . . . . 75.76 119.39 0.13 Allowed Glycine 0 N--CA 1.491 2.364 0 N-CA-C 109.574 -1.411 . . . . 0.40999999999999998 109.574 179.921 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' D' D ' 335' ' ' ARG . . . . . 0.449 ' O ' ' HB3' ' D' ' 338' ' ' PHE . 1.8 ttt180 -65.49 -27.49 68.52 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.245 -1.15 . . . . 3.0299999999999998 109.513 179.911 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' D' D ' 336' ' ' GLU . . . . . . . . . . . . . 23.2 tt0 -57.24 -63.75 1.12 Allowed 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.209 -0.932 . . . . 2.2599999999999998 109.643 -179.897 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' D' D ' 337' ' ' ARG . . . . . 0.561 ' HG3' ' NH1' ' D' ' 337' ' ' ARG . 0.6 OUTLIER -60.04 -27.16 66.7 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.225 -0.922 . . . . 2.9199999999999999 109.374 179.999 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' D' D ' 338' ' ' PHE . . . . . 0.848 ' HA ' HG21 ' D' ' 332' ' ' ILE . 83.8 t80 -55.39 -61.6 2.23 Favored 'General case' 0 N--CA 1.488 1.474 0 O-C-N 121.351 -0.843 . . . . 0.37 109.893 -179.8 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' D' D ' 339' ' ' GLU . . . . . . . . . . . . . 17.8 mt-10 -51.5 -33.72 32.8 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.173 -0.955 . . . . 1.99 110.131 -179.551 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' D' D ' 340' ' ' MET . . . . . . . . . . . . . 37.9 ttp -64.24 -52.85 56.75 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.143 -0.973 . . . . 0.31 110.382 -179.336 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' D' D ' 341' ' ' PHE . . . . . . . . . . . . . 42.5 m-85 -62.01 -46.16 90.44 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.223 -0.923 . . . . 0.17999999999999999 110.147 -179.228 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' D' D ' 342' ' ' ARG . . . . . 0.455 ' CG ' HH11 ' D' ' 342' ' ' ARG . 0.0 OUTLIER -48.28 -38.63 19.26 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.113 -0.992 . . . . 2.4100000000000001 109.869 -179.676 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' D' D ' 343' ' ' GLU . . . . . . . . . . . . . 33.1 tt0 -59.7 -51.32 70.27 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.121 -0.987 . . . . 2.3500000000000001 109.779 -179.705 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' D' D ' 344' ' ' LEU . . . . . 0.512 HD22 HD22 ' C' ' 344' ' ' LEU . 34.1 mt -61.45 -31.35 71.3 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.176 -0.953 . . . . 0.19 109.667 -179.911 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' D' D ' 345' ' ' ASN . . . . . . . . . . . . . 13.0 t-20 -57.91 -60.21 4.06 Favored 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.297 -0.877 . . . . 1.0900000000000001 109.758 -179.907 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' D' D ' 346' ' ' GLU . . . . . . . . . . . . . 25.9 tt0 -61.19 -26.76 67.94 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.279 -0.888 . . . . 1.6899999999999999 109.782 -179.741 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' D' D ' 347' ' ' ALA . . . . . 0.683 ' HB1' ' HB1' ' C' ' 347' ' ' ALA . . . -60.83 -59.1 5.91 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.127 -0.983 . . . . 0.17999999999999999 110.016 -179.743 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' D' D ' 348' ' ' LEU . . . . . 0.586 HD22 ' N ' ' D' ' 348' ' ' LEU . 3.8 mm? -62.17 -42.04 98.89 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.166 -0.959 . . . . 0.31 110.016 -179.533 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' D' D ' 349' ' ' GLU . . . . . . . . . . . . . 30.9 mt-10 -57.89 -37.31 73.76 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.195 -0.941 . . . . 1.95 110.182 -179.249 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' D' D ' 350' ' ' LEU . . . . . 0.814 HD13 HD22 ' C' ' 350' ' ' LEU . 6.0 tt -64.58 -44.28 91.19 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.106 -0.996 . . . . 0.42999999999999999 109.904 -179.563 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' D' D ' 351' ' ' LYS . . . . . . . . . . . . . 40.1 tttp -57.95 -37.82 74.85 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.208 -0.932 . . . . 1.3999999999999999 109.501 -179.746 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' D' D ' 352' ' ' ASP . . . . . . . . . . . . . 11.6 m-20 -55.22 -41.5 72.14 Favored 'General case' 0 N--CA 1.489 1.49 0 O-C-N 121.22 -0.925 . . . . 1.1699999999999999 109.433 179.834 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' D' D ' 353' ' ' ALA . . . . . . . . . . . . . . . -67.89 -30.71 70.12 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.316 -0.865 . . . . 0.58999999999999997 109.692 -179.837 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' D' D ' 354' ' ' GLN . . . . . . . . . . . . . 4.7 mt-30 . . . . . 0 N--CA 1.491 1.609 0 O-C-N 121.112 -0.993 . . . . 1.4399999999999999 109.59 -179.94 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 326' ' ' GLU . . . . . 0.443 ' HB2' ' CE1' ' A' ' 328' ' ' PHE . 30.6 mm-40 . . . . . 0 N--CA 1.489 1.489 0 CA-C-O 121.274 0.559 . . . . 2.1299999999999999 109.779 . . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 327' ' ' TYR . . . . . 0.632 ' CE2' ' CG ' ' C' ' 333' ' ' ARG . 44.2 m-85 -148.87 107.16 3.75 Favored 'General case' 0 N--CA 1.489 1.485 0 O-C-N 121.326 -0.859 . . . . 0.47999999999999998 109.523 -179.967 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 328' ' ' PHE . . . . . 0.443 ' CE1' ' HB2' ' A' ' 326' ' ' GLU . 5.5 m-85 -112.93 -166.17 1.06 Allowed 'General case' 0 N--CA 1.488 1.45 0 O-C-N 121.533 -0.729 . . . . 0.31 109.081 -179.891 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 329' ' ' THR . . . . . 0.444 ' HA ' ' O ' ' C' ' 330' ' ' LEU . 36.5 p -155.32 178.5 10.15 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.109 -0.995 . . . . 0.22 109.552 179.768 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 330' ' ' LEU . . . . . 0.465 ' O ' ' HA ' ' C' ' 329' ' ' THR . 67.8 tp -151.98 130.15 11.94 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.241 -0.912 . . . . 0.28000000000000003 109.024 179.937 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 331' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -87.54 109.2 19.45 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.365 -0.834 . . . . 0.91000000000000003 109.688 -179.724 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 332' ' ' ILE . . . . . 0.522 HG21 ' HA ' ' A' ' 338' ' ' PHE . 52.7 mt -102.25 110.7 29.69 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.521 0 O-C-N 120.941 -1.099 . . . . 0.26000000000000001 109.577 179.794 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 333' ' ' ARG . . . . . 0.533 ' HG2' ' CE1' ' C' ' 327' ' ' TYR . 0.0 OUTLIER -73.33 142.74 47.09 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.461 -0.774 . . . . 2.9199999999999999 109.632 179.523 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 334' ' ' GLY . . . . . . . . . . . . . . . 82.64 132.78 1.8 Allowed Glycine 0 N--CA 1.488 2.106 0 N-CA-C 109.653 -1.379 . . . . 0.40000000000000002 109.653 179.815 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 335' ' ' ARG . . . . . . . . . . . . . 10.2 ttp180 -79.95 -26.14 40.17 Favored 'General case' 0 C--N 1.302 -1.493 0 O-C-N 121.416 -1.049 . . . . 3.0099999999999998 109.002 179.696 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 336' ' ' GLU . . . . . . . . . . . . . 2.2 tt0 -58.2 -68.77 0.22 Allowed 'General case' 0 N--CA 1.488 1.467 0 O-C-N 121.14 -0.975 . . . . 2.29 109.649 -179.732 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 337' ' ' ARG . . . . . . . . . . . . . 2.8 mmt180 -60.17 -27.45 67.12 Favored 'General case' 0 N--CA 1.489 1.481 0 O-C-N 121.115 -0.991 . . . . 2.9300000000000002 109.421 179.752 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 338' ' ' PHE . . . . . 0.522 ' HA ' HG21 ' A' ' 332' ' ' ILE . 47.1 t80 -54.79 -58.72 6.45 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.254 -0.904 . . . . 0.38 109.604 179.914 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 339' ' ' GLU . . . . . . . . . . . . . 11.4 mt-10 -53.42 -31.82 46.93 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.176 -0.953 . . . . 1.97 109.996 -179.675 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 340' ' ' MET . . . . . . . . . . . . . 9.4 ttp -64.19 -50.64 67.32 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.249 -0.907 . . . . 0.31 109.953 -179.781 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 341' ' ' PHE . . . . . . . . . . . . . 48.2 m-85 -63.58 -50.38 69.68 Favored 'General case' 0 C--N 1.3 -1.57 0 O-C-N 121.246 -0.909 . . . . 0.17999999999999999 110.001 -179.327 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 342' ' ' ARG . . . . . . . . . . . . . 71.5 ttt180 -48.87 -40.39 29.5 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.142 -0.974 . . . . 2.4199999999999999 110.041 -179.373 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 343' ' ' GLU . . . . . . . . . . . . . 3.2 tt0 -61.57 -43.68 98.41 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.121 -0.987 . . . . 2.3500000000000001 110.038 -179.441 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 344' ' ' LEU . . . . . 0.995 HD22 HD22 ' B' ' 344' ' ' LEU . 45.9 mt -63.4 -41.69 98.74 Favored 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.084 -1.01 . . . . 0.17999999999999999 109.587 179.985 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 345' ' ' ASN . . . . . 0.494 HD22 HD11 ' C' ' 330' ' ' LEU . 46.4 t30 -56.45 -49.19 75.31 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.149 -0.969 . . . . 1.0900000000000001 109.932 -179.746 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 346' ' ' GLU . . . . . . . . . . . . . 11.5 tt0 -61.27 -30.16 70.3 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.177 -0.952 . . . . 1.6499999999999999 109.686 -179.702 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 347' ' ' ALA . . . . . 1.023 ' HB1' ' HB1' ' B' ' 347' ' ' ALA . . . -63.28 -49.21 74.96 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.333 -0.854 . . . . 0.17999999999999999 109.745 -179.983 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 348' ' ' LEU . . . . . 0.584 HD22 ' N ' ' A' ' 348' ' ' LEU . 4.3 mm? -62.66 -51.44 67.23 Favored 'General case' 0 N--CA 1.494 1.754 0 O-C-N 121.444 -0.785 . . . . 0.29999999999999999 109.833 -179.789 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 349' ' ' GLU . . . . . . . . . . . . . 26.2 mt-10 -58.09 -30.83 66.55 Favored 'General case' 0 N--CA 1.488 1.446 0 O-C-N 121.352 -0.842 . . . . 1.9399999999999999 109.738 -179.406 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 350' ' ' LEU . . . . . 0.845 HD23 ' O ' ' A' ' 350' ' ' LEU . 4.1 tt -63.93 -41.62 97.58 Favored 'General case' 0 C--N 1.304 -1.393 0 O-C-N 121.271 -0.893 . . . . 0.46000000000000002 109.064 179.972 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 351' ' ' LYS . . . . . . . . . . . . . 15.8 tttt -60.41 -41.8 94.66 Favored 'General case' 0 N--CA 1.486 1.37 0 O-C-N 121.336 -0.853 . . . . 1.3999999999999999 109.5 -179.863 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 352' ' ' ASP . . . . . . . . . . . . . 94.9 m-20 -55.71 -39.45 71.08 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.083 -1.01 . . . . 1.1599999999999999 109.951 -179.8 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 353' ' ' ALA . . . . . . . . . . . . . . . -66.05 -40.13 90.7 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.079 -1.013 . . . . 0.63 109.815 -179.669 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 354' ' ' GLN . . . . . . . . . . . . . 1.4 mt-30 . . . . . 0 N--CA 1.489 1.512 0 O-C-N 121.127 -0.983 . . . . 1.47 109.573 -179.722 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' B' B ' 326' ' ' GLU . . . . . 0.429 ' HB2' ' CE1' ' B' ' 328' ' ' PHE . 26.2 mm-40 . . . . . 0 N--CA 1.492 1.642 0 CA-C-O 121.189 0.519 . . . . 2.1299999999999999 109.846 . . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 327' ' ' TYR . . . . . 0.518 ' CE2' ' HG2' ' D' ' 333' ' ' ARG . 42.0 m-85 -147.38 108.04 4.14 Favored 'General case' 0 N--CA 1.488 1.457 0 O-C-N 121.149 -0.969 . . . . 0.47999999999999998 109.699 -179.934 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 328' ' ' PHE . . . . . 0.433 ' O ' HG23 ' B' ' 329' ' ' THR . 4.9 m-85 -113.04 -166.46 1.08 Allowed 'General case' 0 N--CA 1.488 1.438 0 O-C-N 121.441 -0.787 . . . . 0.32000000000000001 109.486 179.772 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 329' ' ' THR . . . . . 0.459 ' HA ' ' O ' ' D' ' 330' ' ' LEU . 28.8 p -155.27 178.66 9.97 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.003 -1.061 . . . . 0.23000000000000001 109.847 179.917 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 330' ' ' LEU . . . . . 0.458 HD21 ' HB2' ' D' ' 345' ' ' ASN . 62.9 tp -151.24 129.98 12.36 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.557 -0.714 . . . . 0.28000000000000003 109.396 179.823 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 331' ' ' GLN . . . . . 0.415 ' HA ' HG22 ' D' ' 329' ' ' THR . 0.3 OUTLIER -88.45 110.81 21.14 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.126 -0.984 . . . . 0.91000000000000003 109.557 -179.75 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' B' B ' 332' ' ' ILE . . . . . 0.579 HG21 ' HA ' ' B' ' 338' ' ' PHE . 50.7 mt -103.68 109.27 26.61 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.759 0 O-C-N 121.257 -0.902 . . . . 0.23999999999999999 110.075 -179.516 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 333' ' ' ARG . . . . . 0.5 ' HG2' ' CE2' ' D' ' 327' ' ' TYR . 0.0 OUTLIER -72.1 142.72 49.17 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.086 -1.009 . . . . 2.9300000000000002 109.349 179.798 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' B' B ' 334' ' ' GLY . . . . . . . . . . . . . . . 82.12 132.63 1.61 Allowed Glycine 0 N--CA 1.489 2.224 0 N-CA-C 109.814 -1.314 . . . . 0.40000000000000002 109.814 179.68 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 335' ' ' ARG . . . . . . . . . . . . . 11.3 ttp180 -78.95 -26.71 43.55 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.488 -1.007 . . . . 3.0099999999999998 109.437 179.77 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 336' ' ' GLU . . . . . . . . . . . . . 2.5 tt0 -58.04 -69.16 0.19 Allowed 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.191 -0.943 . . . . 2.2799999999999998 109.578 179.864 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 337' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -59.86 -28.0 67.14 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.273 -0.892 . . . . 2.9300000000000002 109.336 -179.898 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 338' ' ' PHE . . . . . 0.579 ' HA ' HG21 ' B' ' 332' ' ' ILE . 49.7 t80 -55.15 -59.58 4.57 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.214 -0.929 . . . . 0.37 109.534 179.775 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 339' ' ' GLU . . . . . . . . . . . . . 9.4 mt-10 -53.13 -33.08 50.78 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.199 -0.938 . . . . 1.98 109.748 -179.873 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 340' ' ' MET . . . . . . . . . . . . . 9.7 ttp -62.95 -51.33 67.33 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 120.955 -1.091 . . . . 0.32000000000000001 109.808 -179.637 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 341' ' ' PHE . . . . . . . . . . . . . 48.7 m-85 -62.6 -48.78 77.94 Favored 'General case' 0 N--CA 1.488 1.465 0 O-C-N 121.171 -0.956 . . . . 0.17999999999999999 109.968 -179.606 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 342' ' ' ARG . . . . . . . . . . . . . 70.7 ttt180 -48.62 -44.11 36.97 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.066 -1.021 . . . . 2.4199999999999999 109.834 -179.791 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 343' ' ' GLU . . . . . . . . . . . . . 3.1 tt0 -58.05 -44.14 87.27 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.321 -0.862 . . . . 2.3500000000000001 110.086 -179.309 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 344' ' ' LEU . . . . . 0.995 HD22 HD22 ' A' ' 344' ' ' LEU . 58.8 mt -63.85 -40.85 97.55 Favored 'General case' 0 N--CA 1.494 1.74 0 O-C-N 121.186 -0.946 . . . . 0.17999999999999999 109.746 -179.982 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 345' ' ' ASN . . . . . 0.426 ' HA ' ' CZ ' ' D' ' 341' ' ' PHE . 48.6 t30 -57.02 -50.21 73.43 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.354 -0.841 . . . . 1.0900000000000001 109.753 -179.852 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 346' ' ' GLU . . . . . . . . . . . . . 12.4 tt0 -61.58 -30.37 70.63 Favored 'General case' 0 N--CA 1.488 1.447 0 O-C-N 121.04 -1.038 . . . . 1.6599999999999999 109.552 -179.876 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 347' ' ' ALA . . . . . 1.023 ' HB1' ' HB1' ' A' ' 347' ' ' ALA . . . -62.46 -48.85 77.8 Favored 'General case' 0 N--CA 1.493 1.692 0 O-C-N 121.2 -0.938 . . . . 0.17000000000000001 110.038 -179.836 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 348' ' ' LEU . . . . . 0.577 HD22 ' N ' ' B' ' 348' ' ' LEU . 4.2 mm? -64.07 -50.87 66.65 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 120.996 -1.065 . . . . 0.28999999999999998 109.584 -179.859 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 349' ' ' GLU . . . . . . . . . . . . . 29.3 mt-10 -56.5 -31.63 64.26 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.401 -0.812 . . . . 1.95 110.055 -179.321 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 350' ' ' LEU . . . . . 0.829 HD23 ' O ' ' B' ' 350' ' ' LEU . 3.6 tt -63.88 -40.56 96.83 Favored 'General case' 0 N--CA 1.489 1.493 0 O-C-N 121.352 -0.842 . . . . 0.45000000000000001 109.321 -179.934 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 351' ' ' LYS . . . . . . . . . . . . . 15.9 tttt -60.68 -41.99 96.19 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.199 -0.938 . . . . 1.3799999999999999 109.452 179.949 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 352' ' ' ASP . . . . . . . . . . . . . 94.6 m-20 -56.0 -40.22 73.04 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.311 -0.868 . . . . 1.1599999999999999 109.883 -179.723 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 353' ' ' ALA . . . . . . . . . . . . . . . -66.22 -40.34 90.22 Favored 'General case' 0 N--CA 1.494 1.74 0 O-C-N 121.073 -1.017 . . . . 0.60999999999999999 109.572 -179.644 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 354' ' ' GLN . . . . . . . . . . . . . 1.7 mt-30 . . . . . 0 C--N 1.302 -1.471 0 O-C-N 121.323 -0.861 . . . . 1.45 109.817 -179.588 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' C' C ' 326' ' ' GLU . . . . . . . . . . . . . 69.0 mm-40 . . . . . 0 N--CA 1.491 1.613 0 N-CA-C 109.098 -0.705 . . . . 2.1699999999999999 109.098 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' C' C ' 327' ' ' TYR . . . . . 0.533 ' CE1' ' HG2' ' A' ' 333' ' ' ARG . 47.9 m-85 -151.76 90.61 1.56 Allowed 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.005 -1.06 . . . . 0.47999999999999998 109.961 -179.514 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' C' C ' 328' ' ' PHE . . . . . 0.489 ' O ' ' CG2' ' C' ' 329' ' ' THR . 37.4 m-85 -99.34 -159.57 0.75 Allowed 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.171 -0.955 . . . . 0.33000000000000002 109.361 179.588 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' C' C ' 329' ' ' THR . . . . . 0.489 ' CG2' ' O ' ' C' ' 328' ' ' PHE . 75.7 p -157.55 -177.96 6.98 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.452 -0.78 . . . . 0.23000000000000001 109.481 -179.948 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' C' C ' 330' ' ' LEU . . . . . 0.494 HD11 HD22 ' A' ' 345' ' ' ASN . 38.6 tp -154.45 127.61 8.37 Favored 'General case' 0 C--N 1.302 -1.492 0 O-C-N 121.32 -0.862 . . . . 0.28000000000000003 109.798 -179.705 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' C' C ' 331' ' ' GLN . . . . . . . . . . . . . 37.5 tp60 -84.68 107.21 16.76 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.163 -0.961 . . . . 1.48 109.625 179.776 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' C' C ' 332' ' ' ILE . . . . . 0.519 HG21 ' HA ' ' C' ' 338' ' ' PHE . 61.1 mt -104.63 107.88 23.52 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.56 0 O-C-N 121.148 -0.97 . . . . 0.23999999999999999 109.8 -179.831 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' C' C ' 333' ' ' ARG . . . . . 0.632 ' CG ' ' CE2' ' A' ' 327' ' ' TYR . 6.8 mpt_? -74.14 139.52 44.57 Favored 'General case' 0 N--CA 1.488 1.43 0 O-C-N 121.454 -0.779 . . . . 2.7400000000000002 109.757 179.969 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' C' C ' 334' ' ' GLY . . . . . . . . . . . . . . . 87.92 129.98 3.21 Favored Glycine 0 N--CA 1.494 2.528 0 N-CA-C 109.985 -1.246 . . . . 0.34999999999999998 109.985 179.506 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' C' C ' 335' ' ' ARG . . . . . 0.469 ' NH2' ' OE1' ' C' ' 339' ' ' GLU . 2.9 ttp180 -79.87 -28.76 39.91 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.522 -0.987 . . . . 2.5299999999999998 110.002 -179.95 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' C' C ' 336' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -56.04 -72.7 0.07 Allowed 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.136 -0.977 . . . . 2.6200000000000001 109.873 -179.388 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' C' C ' 337' ' ' ARG . . . . . . . . . . . . . 99.3 mtt180 -60.09 -27.47 67.03 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.355 -0.841 . . . . 2.8100000000000001 109.566 179.942 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' C' C ' 338' ' ' PHE . . . . . 0.519 ' HA ' HG21 ' C' ' 332' ' ' ILE . 45.7 t80 -53.15 -61.34 2.36 Favored 'General case' 0 N--CA 1.487 1.39 0 O-C-N 121.19 -0.944 . . . . 0.40000000000000002 109.249 179.942 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' C' C ' 339' ' ' GLU . . . . . 0.469 ' OE1' ' NH2' ' C' ' 335' ' ' ARG . 57.6 mt-10 -50.01 -30.74 11.22 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.406 -0.809 . . . . 2.0499999999999998 109.823 -180.0 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' C' C ' 340' ' ' MET . . . . . . . . . . . . . 27.1 ttp -64.72 -51.04 64.52 Favored 'General case' 0 N--CA 1.496 1.833 0 O-C-N 121.361 -0.837 . . . . 0.32000000000000001 109.995 -179.49 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' C' C ' 341' ' ' PHE . . . . . . . . . . . . . 49.7 m-85 -63.82 -49.58 72.3 Favored 'General case' 0 N--CA 1.494 1.732 0 O-C-N 121.229 -0.919 . . . . 0.17999999999999999 109.888 -179.507 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' C' C ' 342' ' ' ARG . . . . . . . . . . . . . 16.3 ttp180 -48.3 -43.16 32.68 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.172 -0.955 . . . . 2.9100000000000001 109.804 -179.916 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' C' C ' 343' ' ' GLU . . . . . . . . . . . . . 4.0 tt0 -59.4 -44.32 92.84 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.075 -1.016 . . . . 2.1400000000000001 110.408 -179.361 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' C' C ' 344' ' ' LEU . . . . . 0.614 HD22 HD22 ' D' ' 344' ' ' LEU . 46.2 mt -64.19 -37.03 85.99 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 120.802 -1.186 . . . . 0.22 109.96 -179.604 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' C' C ' 345' ' ' ASN . . . . . 0.448 ' HB2' HD21 ' A' ' 330' ' ' LEU . 52.2 t-20 -56.68 -46.91 80.87 Favored 'General case' 0 C--N 1.301 -1.536 0 O-C-N 121.065 -1.022 . . . . 1.0800000000000001 109.107 -179.825 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' C' C ' 346' ' ' GLU . . . . . . . . . . . . . 32.6 tt0 -62.11 -30.65 71.16 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.281 -0.887 . . . . 2.21 109.518 179.737 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' C' C ' 347' ' ' ALA . . . . . 1.007 ' HB1' ' HB1' ' D' ' 347' ' ' ALA . . . -61.66 -51.55 67.99 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.098 -1.001 . . . . 0.17999999999999999 109.735 179.668 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' C' C ' 348' ' ' LEU . . . . . 0.548 ' N ' HD22 ' C' ' 348' ' ' LEU . 4.4 mm? -61.88 -53.22 58.82 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.162 -0.961 . . . . 0.32000000000000001 110.471 -179.249 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' C' C ' 349' ' ' GLU . . . . . 0.412 ' O ' ' HB2' ' C' ' 352' ' ' ASP . 9.6 mt-10 -57.23 -32.47 66.57 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.097 -1.002 . . . . 2.1899999999999999 109.21 -179.727 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' C' C ' 350' ' ' LEU . . . . . 0.925 ' CD2' HD13 ' D' ' 350' ' ' LEU . 5.1 tt -62.48 -42.51 99.54 Favored 'General case' 0 C--N 1.301 -1.506 0 N-CA-C 109.383 -0.599 . . . . 0.46000000000000002 109.383 179.926 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' C' C ' 351' ' ' LYS . . . . . 0.51 ' N ' HD23 ' C' ' 350' ' ' LEU . 0.0 OUTLIER -58.6 -34.06 70.69 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.158 -0.964 . . . . 1.3500000000000001 109.593 179.983 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' C' C ' 352' ' ' ASP . . . . . 0.412 ' HB2' ' O ' ' C' ' 349' ' ' GLU . 7.9 m-20 -55.62 -40.3 71.94 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.254 -0.904 . . . . 1.1899999999999999 109.015 179.98 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' C' C ' 353' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.488 1.467 0 O-C-N 121.244 -0.91 . . . . 0.56999999999999995 109.114 179.809 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' D' D ' 326' ' ' GLU . . . . . 0.421 ' HB2' ' CE1' ' D' ' 328' ' ' PHE . 24.9 mm-40 . . . . . 0 N--CA 1.49 1.569 0 CA-C-O 121.167 0.508 . . . . 2.1299999999999999 109.721 . . . . . . . . . 1 1 . 1 . 013 nuclear build core ' D' D ' 327' ' ' TYR . . . . . 0.5 ' CE2' ' HG2' ' B' ' 333' ' ' ARG . 42.5 m-85 -149.01 108.8 4.03 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.353 -0.842 . . . . 0.46999999999999997 109.674 -179.988 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' D' D ' 328' ' ' PHE . . . . . 0.423 ' CD1' ' N ' ' D' ' 328' ' ' PHE . 4.3 m-85 -114.02 -167.51 1.22 Allowed 'General case' 0 N--CA 1.489 1.499 0 O-C-N 121.473 -0.767 . . . . 0.29999999999999999 108.986 179.813 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' D' D ' 329' ' ' THR . . . . . 0.457 ' HA ' ' O ' ' B' ' 330' ' ' LEU . 27.0 p -154.71 176.7 12.11 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.017 -1.052 . . . . 0.22 109.701 179.953 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' D' D ' 330' ' ' LEU . . . . . 0.459 ' O ' ' HA ' ' B' ' 329' ' ' THR . 64.5 tp -149.81 129.32 13.05 Favored 'General case' 0 N--CA 1.489 1.488 0 O-C-N 121.057 -1.027 . . . . 0.28000000000000003 109.508 -179.786 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' D' D ' 331' ' ' GLN . . . . . 0.406 ' HA ' HG22 ' B' ' 329' ' ' THR . 0.0 OUTLIER -87.79 111.01 20.91 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.395 -0.816 . . . . 0.93000000000000005 109.695 -179.882 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' D' D ' 332' ' ' ILE . . . . . 0.588 HG21 ' HA ' ' D' ' 338' ' ' PHE . 57.8 mt -103.57 111.89 34.99 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.595 0 O-C-N 121.308 -0.87 . . . . 0.25 109.793 179.987 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' D' D ' 333' ' ' ARG . . . . . 0.518 ' HG2' ' CE2' ' B' ' 327' ' ' TYR . 0.0 OUTLIER -73.86 141.13 46.12 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.145 -0.972 . . . . 2.9300000000000002 109.4 179.72 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' D' D ' 334' ' ' GLY . . . . . . . . . . . . . . . 83.29 132.27 1.94 Allowed Glycine 0 N--CA 1.493 2.473 0 N-CA-C 109.866 -1.294 . . . . 0.40999999999999998 109.866 179.921 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' D' D ' 335' ' ' ARG . . . . . . . . . . . . . 11.7 ttp180 -78.32 -25.86 46.67 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.206 -1.173 . . . . 3.0299999999999998 109.12 179.668 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' D' D ' 336' ' ' GLU . . . . . . . . . . . . . 2.8 tt0 -58.93 -67.96 0.32 Allowed 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.318 -0.864 . . . . 2.2599999999999998 109.991 -179.692 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' D' D ' 337' ' ' ARG . . . . . 0.402 ' HA ' ' HD2' ' D' ' 337' ' ' ARG . 1.0 OUTLIER -61.97 -26.46 68.22 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 120.857 -1.152 . . . . 2.9199999999999999 109.026 179.951 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' D' D ' 338' ' ' PHE . . . . . 0.588 ' HA ' HG21 ' D' ' 332' ' ' ILE . 47.7 t80 -54.67 -60.9 2.72 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.344 -0.847 . . . . 0.37 109.303 179.553 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' D' D ' 339' ' ' GLU . . . . . . . . . . . . . 8.4 mt-10 -52.02 -34.03 41.13 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.247 -0.908 . . . . 1.99 109.848 -179.754 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' D' D ' 340' ' ' MET . . . . . . . . . . . . . 8.9 ttp -62.02 -50.26 72.76 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.2 -0.937 . . . . 0.31 109.923 -179.735 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' D' D ' 341' ' ' PHE . . . . . 0.426 ' CZ ' ' HA ' ' B' ' 345' ' ' ASN . 52.2 m-85 -63.73 -48.9 75.17 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 120.797 -1.19 . . . . 0.17999999999999999 110.209 -179.638 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' D' D ' 342' ' ' ARG . . . . . . . . . . . . . 71.3 ttt180 -48.66 -44.96 38.13 Favored 'General case' 0 C--N 1.302 -1.498 0 O-C-N 121.296 -0.878 . . . . 2.4100000000000001 109.834 -179.358 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' D' D ' 343' ' ' GLU . . . . . . . . . . . . . 3.0 tt0 -56.49 -45.48 80.95 Favored 'General case' 0 N--CA 1.489 1.494 0 O-C-N 121.204 -0.935 . . . . 2.3500000000000001 109.902 -179.489 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' D' D ' 344' ' ' LEU . . . . . 0.614 HD22 HD22 ' C' ' 344' ' ' LEU . 47.4 mt -62.94 -40.51 97.86 Favored 'General case' 0 N--CA 1.494 1.757 0 O-C-N 121.147 -0.971 . . . . 0.19 110.088 -179.712 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' D' D ' 345' ' ' ASN . . . . . 0.458 ' HB2' HD21 ' B' ' 330' ' ' LEU . 55.5 t30 -56.86 -49.47 75.4 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.173 -0.954 . . . . 1.0900000000000001 109.71 -179.605 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' D' D ' 346' ' ' GLU . . . . . . . . . . . . . 9.2 tt0 -61.9 -29.91 70.53 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.365 -0.834 . . . . 1.6899999999999999 109.747 -179.929 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' D' D ' 347' ' ' ALA . . . . . 1.007 ' HB1' ' HB1' ' C' ' 347' ' ' ALA . . . -62.52 -49.47 75.19 Favored 'General case' 0 N--CA 1.494 1.739 0 O-C-N 121.112 -0.993 . . . . 0.17999999999999999 109.977 -179.984 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' D' D ' 348' ' ' LEU . . . . . 0.592 HD22 ' N ' ' D' ' 348' ' ' LEU . 4.2 mm? -63.23 -52.61 61.51 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.154 -0.966 . . . . 0.31 109.524 -179.683 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' D' D ' 349' ' ' GLU . . . . . . . . . . . . . 25.1 mt-10 -55.36 -31.18 61.54 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.494 -0.754 . . . . 1.95 109.948 -179.683 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' D' D ' 350' ' ' LEU . . . . . 0.925 HD13 ' CD2' ' C' ' 350' ' ' LEU . 4.4 tt -64.6 -41.3 96.31 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.316 -0.865 . . . . 0.42999999999999999 109.106 179.982 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' D' D ' 351' ' ' LYS . . . . . . . . . . . . . 17.8 tttt -59.04 -44.01 91.72 Favored 'General case' 0 N--CA 1.489 1.497 0 O-C-N 121.278 -0.889 . . . . 1.3999999999999999 109.648 -179.973 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' D' D ' 352' ' ' ASP . . . . . . . . . . . . . 86.6 m-20 -55.1 -40.32 70.32 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.421 -0.799 . . . . 1.1699999999999999 110.125 -179.404 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' D' D ' 353' ' ' ALA . . . . . . . . . . . . . . . -66.19 -38.39 87.9 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.239 -0.913 . . . . 0.58999999999999997 109.741 -179.658 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' D' D ' 354' ' ' GLN . . . . . . . . . . . . . 1.3 mt-30 . . . . . 0 C--N 1.302 -1.484 0 O-C-N 121.238 -0.914 . . . . 1.4399999999999999 109.873 -179.541 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 326' ' ' GLU . . . . . . . . . . . . . 4.3 mm-40 . . . . . 0 N--CA 1.491 1.595 0 CA-C-O 121.283 0.563 . . . . 2.1299999999999999 109.499 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 327' ' ' TYR . . . . . 0.604 ' CE2' ' HG2' ' C' ' 333' ' ' ARG . 43.4 m-85 -149.52 106.11 3.53 Favored 'General case' 0 N--CA 1.488 1.444 0 O-C-N 121.289 -0.882 . . . . 0.47999999999999998 109.56 179.837 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 328' ' ' PHE . . . . . 0.442 ' O ' ' NE2' ' C' ' 331' ' ' GLN . 22.6 m-85 -111.98 -167.57 1.2 Allowed 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.388 -0.82 . . . . 0.31 108.938 179.717 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 329' ' ' THR . . . . . 0.422 ' HA ' ' O ' ' C' ' 330' ' ' LEU . 77.7 p -153.59 -179.73 8.05 Favored 'General case' 0 C--N 1.303 -1.441 0 O-C-N 121.152 -0.968 . . . . 0.22 109.374 179.883 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 330' ' ' LEU . . . . . 0.428 ' O ' ' HA ' ' C' ' 329' ' ' THR . 52.1 tp -152.73 131.96 12.76 Favored 'General case' 0 N--CA 1.488 1.469 0 O-C-N 121.18 -0.95 . . . . 0.28000000000000003 109.564 -179.892 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 331' ' ' GLN . . . . . . . . . . . . . 44.6 tp60 -87.99 106.64 18.27 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.359 -0.838 . . . . 0.91000000000000003 109.5 179.933 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 332' ' ' ILE . . . . . . . . . . . . . 31.9 mt -103.49 103.1 14.63 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.541 0 O-C-N 121.129 -0.982 . . . . 0.26000000000000001 109.534 179.926 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 333' ' ' ARG . . . . . 0.531 ' NH1' ' HG2' ' A' ' 333' ' ' ARG . 0.0 OUTLIER -72.46 151.49 42.51 Favored 'General case' 0 N--CA 1.488 1.464 0 O-C-N 121.265 -0.897 . . . . 2.9199999999999999 109.445 179.861 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 334' ' ' GLY . . . . . . . . . . . . . . . 86.47 128.99 2.45 Favored Glycine 0 N--CA 1.491 2.315 0 N-CA-C 109.593 -1.403 . . . . 0.40000000000000002 109.593 -179.984 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 335' ' ' ARG . . . . . 0.451 ' HA ' ' CE2' ' C' ' 328' ' ' PHE . 3.5 ttm180 -79.66 -39.09 32.2 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.278 -1.131 . . . . 3.0099999999999998 109.586 179.988 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 336' ' ' GLU . . . . . . . . . . . . . 2.2 mt-10 -58.05 -61.42 2.56 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.225 -0.922 . . . . 2.29 109.7 -179.916 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 337' ' ' ARG . . . . . 0.457 ' CG ' ' NH1' ' A' ' 337' ' ' ARG . 0.0 OUTLIER -59.75 -29.33 68.08 Favored 'General case' 0 N--CA 1.489 1.494 0 O-C-N 121.168 -0.957 . . . . 2.9300000000000002 109.528 -179.842 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 338' ' ' PHE . . . . . 0.449 ' HB3' ' O ' ' A' ' 335' ' ' ARG . 48.3 t80 -55.69 -56.03 25.17 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.145 -0.972 . . . . 0.38 109.465 179.993 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 339' ' ' GLU . . . . . . . . . . . . . 24.0 mt-10 -50.24 -33.27 19.05 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.195 -0.941 . . . . 1.97 110.045 -179.647 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 340' ' ' MET . . . . . . . . . . . . . 32.1 ttp -63.19 -51.0 68.13 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.158 -0.963 . . . . 0.31 109.878 -179.713 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 341' ' ' PHE . . . . . . . . . . . . . 38.9 m-85 -62.67 -52.02 64.93 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.177 -0.952 . . . . 0.17999999999999999 109.704 -179.741 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 342' ' ' ARG . . . . . . . . . . . . . 9.7 ttm180 -47.63 -36.65 11.21 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.188 -0.945 . . . . 2.4199999999999999 109.438 -179.948 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 343' ' ' GLU . . . . . . . . . . . . . 32.2 tt0 -59.18 -49.61 77.18 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.219 -0.926 . . . . 2.3500000000000001 109.433 -179.92 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 344' ' ' LEU . . . . . 0.687 HD22 ' CD2' ' B' ' 344' ' ' LEU . 57.5 mt -62.42 -32.31 73.14 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.223 -0.923 . . . . 0.17999999999999999 109.437 179.984 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 345' ' ' ASN . . . . . . . . . . . . . 9.6 t-20 -56.81 -54.93 40.77 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.302 -0.874 . . . . 1.0900000000000001 109.618 -179.886 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 346' ' ' GLU . . . . . . . . . . . . . 43.8 tp10 -61.35 -31.66 71.54 Favored 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.274 -0.891 . . . . 1.6499999999999999 109.813 -179.797 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 347' ' ' ALA . . . . . 0.772 ' HB1' ' HB1' ' B' ' 347' ' ' ALA . . . -59.91 -57.86 11.04 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.204 -0.935 . . . . 0.17999999999999999 109.988 -179.73 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 348' ' ' LEU . . . . . 0.71 HD12 ' HE ' ' C' ' 337' ' ' ARG . 4.2 mm? -61.59 -41.91 98.11 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.206 -0.934 . . . . 0.29999999999999999 109.81 -179.584 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 349' ' ' GLU . . . . . . . . . . . . . 98.5 mt-10 -58.08 -34.93 70.69 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.264 -0.898 . . . . 1.9399999999999999 110.007 -179.53 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 350' ' ' LEU . . . . . 0.86 HD13 HD22 ' B' ' 350' ' ' LEU . 5.7 tt -63.54 -46.46 85.89 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.111 -0.993 . . . . 0.46000000000000002 109.523 -179.819 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 351' ' ' LYS . . . . . . . . . . . . . 42.4 tttt -59.38 -38.0 79.37 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.274 -0.891 . . . . 1.3999999999999999 109.443 -179.978 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 352' ' ' ASP . . . . . . . . . . . . . 23.0 m-20 -55.71 -36.14 66.86 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.199 -0.938 . . . . 1.1599999999999999 109.671 -179.995 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 353' ' ' ALA . . . . . . . . . . . . . . . -66.88 -35.75 80.74 Favored 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.235 -0.916 . . . . 0.63 109.76 -179.745 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 354' ' ' GLN . . . . . . . . . . . . . 5.9 mt-30 . . . . . 0 N--CA 1.49 1.556 0 O-C-N 121.215 -0.928 . . . . 1.47 109.657 -179.92 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' B' B ' 326' ' ' GLU . . . . . . . . . . . . . 4.3 mm-40 . . . . . 0 N--CA 1.49 1.568 0 N-CA-C 109.43 -0.582 . . . . 2.1299999999999999 109.43 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' B' B ' 327' ' ' TYR . . . . . 0.517 ' CE2' ' HG2' ' D' ' 333' ' ' ARG . 43.1 m-85 -149.59 106.1 3.52 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.365 -0.835 . . . . 0.47999999999999998 109.46 179.823 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 328' ' ' PHE . . . . . 0.488 ' CE1' ' HA ' ' D' ' 335' ' ' ARG . 22.5 m-85 -111.97 -167.74 1.22 Allowed 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.236 -0.915 . . . . 0.32000000000000001 108.974 179.653 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 329' ' ' THR . . . . . 0.414 HG23 ' C ' ' B' ' 328' ' ' PHE . 75.7 p -153.38 -179.55 7.85 Favored 'General case' 0 N--CA 1.488 1.453 0 O-C-N 121.195 -0.941 . . . . 0.23000000000000001 109.331 179.899 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 330' ' ' LEU . . . . . . . . . . . . . 52.2 tp -152.93 131.87 12.53 Favored 'General case' 0 N--CA 1.489 1.484 0 O-C-N 121.274 -0.891 . . . . 0.28000000000000003 109.484 -179.867 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 331' ' ' GLN . . . . . . . . . . . . . 44.6 tp60 -88.09 106.41 18.14 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.284 -0.885 . . . . 0.91000000000000003 109.505 179.967 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 332' ' ' ILE . . . . . . . . . . . . . 31.5 mt -103.28 103.26 14.84 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.601 0 O-C-N 121.198 -0.939 . . . . 0.23999999999999999 109.609 179.86 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 333' ' ' ARG . . . . . 0.566 ' HG2' ' CE2' ' D' ' 327' ' ' TYR . 0.0 OUTLIER -72.55 151.39 42.45 Favored 'General case' 0 N--CA 1.489 1.5 0 O-C-N 121.278 -0.889 . . . . 2.9300000000000002 109.465 179.835 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' B' B ' 334' ' ' GLY . . . . . . . . . . . . . . . 86.6 128.96 2.48 Favored Glycine 0 N--CA 1.49 2.254 0 N-CA-C 109.556 -1.418 . . . . 0.40000000000000002 109.556 -179.977 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 335' ' ' ARG . . . . . 0.444 ' O ' ' HB3' ' B' ' 338' ' ' PHE . 3.4 ttm180 -79.58 -39.29 32.06 Favored 'General case' 0 N--CA 1.489 1.495 0 O-C-N 121.3 -1.117 . . . . 3.0099999999999998 109.506 -179.994 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 336' ' ' GLU . . . . . . . . . . . . . 2.2 mt-10 -57.89 -61.36 2.59 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.221 -0.924 . . . . 2.2799999999999998 109.77 -179.921 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 337' ' ' ARG . . . . . 0.455 ' NH1' ' CG ' ' B' ' 337' ' ' ARG . 0.0 OUTLIER -59.82 -29.35 68.19 Favored 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.226 -0.921 . . . . 2.9300000000000002 109.502 -179.871 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' B' B ' 338' ' ' PHE . . . . . 0.444 ' HB3' ' O ' ' B' ' 335' ' ' ARG . 48.0 t80 -55.54 -56.12 23.96 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.184 -0.948 . . . . 0.37 109.469 179.943 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 339' ' ' GLU . . . . . . . . . . . . . 23.9 mt-10 -50.36 -33.17 19.49 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.27 -0.894 . . . . 1.98 109.99 -179.657 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 340' ' ' MET . . . . . . . . . . . . . 32.3 ttp -63.39 -50.85 68.24 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.052 -1.03 . . . . 0.32000000000000001 109.812 -179.73 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 341' ' ' PHE . . . . . . . . . . . . . 39.3 m-85 -62.74 -51.8 65.75 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.19 -0.944 . . . . 0.17999999999999999 109.819 -179.812 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 342' ' ' ARG . . . . . . . . . . . . . 9.7 ttm180 -47.78 -36.83 12.26 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.245 -0.91 . . . . 2.4199999999999999 109.522 -179.988 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 343' ' ' GLU . . . . . . . . . . . . . 32.5 tt0 -58.88 -49.72 76.72 Favored 'General case' 0 N--CA 1.489 1.486 0 O-C-N 121.214 -0.929 . . . . 2.3500000000000001 109.47 179.957 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 344' ' ' LEU . . . . . 0.687 ' CD2' HD22 ' A' ' 344' ' ' LEU . 56.8 mt -62.39 -32.34 73.14 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.174 -0.954 . . . . 0.17999999999999999 109.466 179.947 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 345' ' ' ASN . . . . . . . . . . . . . 9.6 t-20 -56.81 -54.88 41.26 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.352 -0.842 . . . . 1.0900000000000001 109.678 -179.87 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 346' ' ' GLU . . . . . . . . . . . . . 43.8 tp10 -61.37 -31.66 71.56 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.237 -0.914 . . . . 1.6599999999999999 109.787 -179.849 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 347' ' ' ALA . . . . . 0.772 ' HB1' ' HB1' ' A' ' 347' ' ' ALA . . . -59.93 -57.8 11.29 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.235 -0.916 . . . . 0.17000000000000001 109.974 -179.663 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 348' ' ' LEU . . . . . 0.6 HD22 ' N ' ' B' ' 348' ' ' LEU . 4.2 mm? -61.6 -41.91 98.11 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.198 -0.939 . . . . 0.28999999999999998 109.828 -179.558 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 349' ' ' GLU . . . . . . . . . . . . . 98.5 mt-10 -57.97 -35.18 70.81 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.246 -0.909 . . . . 1.95 109.946 -179.492 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 350' ' ' LEU . . . . . 0.86 HD22 HD13 ' A' ' 350' ' ' LEU . 5.7 tt -63.33 -46.59 85.92 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.157 -0.964 . . . . 0.45000000000000001 109.576 -179.836 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 351' ' ' LYS . . . . . . . . . . . . . 42.4 tttt -59.37 -37.86 78.98 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.294 -0.879 . . . . 1.3799999999999999 109.398 -179.899 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 352' ' ' ASP . . . . . . . . . . . . . 22.8 m-20 -55.72 -36.17 66.93 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.349 -0.844 . . . . 1.1599999999999999 109.717 179.992 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 353' ' ' ALA . . . . . . . . . . . . . . . -66.91 -35.75 80.7 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.217 -0.927 . . . . 0.60999999999999999 109.838 -179.752 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 354' ' ' GLN . . . . . . . . . . . . . 5.9 mt-30 . . . . . 0 N--CA 1.491 1.597 0 O-C-N 121.115 -0.991 . . . . 1.45 109.543 -179.892 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' C' C ' 326' ' ' GLU . . . . . 0.522 ' O ' ' CD1' ' C' ' 327' ' ' TYR . 5.2 mt-10 . . . . . 0 N--CA 1.49 1.542 0 N-CA-C 109.428 -0.582 . . . . 2.1699999999999999 109.428 . . . . . . . . . 1 1 . 1 . 014 nuclear build core ' C' C ' 327' ' ' TYR . . . . . 0.522 ' CD1' ' O ' ' C' ' 326' ' ' GLU . 40.3 m-85 -149.77 109.11 3.96 Favored 'General case' 0 N--CA 1.489 1.494 0 O-C-N 121.149 -0.97 . . . . 0.47999999999999998 109.723 -179.973 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' C' C ' 328' ' ' PHE . . . . . 0.451 ' CE2' ' HA ' ' A' ' 335' ' ' ARG . 83.7 m-85 -113.89 -167.04 1.15 Allowed 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.401 -0.812 . . . . 0.33000000000000002 109.137 179.81 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' C' C ' 329' ' ' THR . . . . . 0.431 HG23 ' C ' ' C' ' 328' ' ' PHE . 22.4 p -153.73 179.19 9.08 Favored 'General case' 0 N--CA 1.489 1.487 0 O-C-N 121.124 -0.985 . . . . 0.23000000000000001 109.494 179.988 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' C' C ' 330' ' ' LEU . . . . . 0.422 ' O ' ' HA ' ' A' ' 329' ' ' THR . 54.1 tp -152.99 131.61 12.27 Favored 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.243 -0.911 . . . . 0.28000000000000003 109.761 -179.802 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' C' C ' 331' ' ' GLN . . . . . 0.442 ' NE2' ' O ' ' A' ' 328' ' ' PHE . 0.0 OUTLIER -88.52 102.35 14.83 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.268 -0.895 . . . . 1.48 108.838 179.818 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' C' C ' 332' ' ' ILE . . . . . . . . . . . . . 53.6 mt -104.01 112.04 36.01 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.704 0 O-C-N 121.118 -0.988 . . . . 0.23999999999999999 110.204 -179.606 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' C' C ' 333' ' ' ARG . . . . . 0.604 ' HG2' ' CE2' ' A' ' 327' ' ' TYR . 1.4 mpp_? -75.18 163.94 27.01 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.294 -0.879 . . . . 2.7400000000000002 109.656 179.407 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' C' C ' 334' ' ' GLY . . . . . . . . . . . . . . . 72.55 130.3 0.12 Allowed Glycine 0 N--CA 1.493 2.476 0 N-CA-C 110.344 -1.102 . . . . 0.34999999999999998 110.344 179.172 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' C' C ' 335' ' ' ARG . . . . . 0.481 ' O ' ' HB3' ' C' ' 338' ' ' PHE . 3.9 ttp180 -80.67 -37.98 29.88 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.401 -1.058 . . . . 2.5299999999999998 109.414 179.684 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' C' C ' 336' ' ' GLU . . . . . . . . . . . . . 4.0 mt-10 -58.36 -60.98 2.94 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.218 -0.927 . . . . 2.6200000000000001 109.676 -179.738 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' C' C ' 337' ' ' ARG . . . . . 0.71 ' HE ' HD12 ' A' ' 348' ' ' LEU . 0.0 OUTLIER -59.47 -29.24 67.68 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.208 -0.932 . . . . 2.8100000000000001 109.463 -179.789 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' C' C ' 338' ' ' PHE . . . . . 0.481 ' HB3' ' O ' ' C' ' 335' ' ' ARG . 47.6 t80 -54.87 -55.55 29.2 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.228 -0.92 . . . . 0.40000000000000002 109.245 179.825 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' C' C ' 339' ' ' GLU . . . . . . . . . . . . . 85.4 mt-10 -50.84 -29.17 11.08 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.297 -0.877 . . . . 2.0499999999999998 109.672 -179.985 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' C' C ' 340' ' ' MET . . . . . . . . . . . . . 14.9 ttp -63.4 -53.83 46.29 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.132 -0.98 . . . . 0.32000000000000001 109.64 -179.766 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' C' C ' 341' ' ' PHE . . . . . . . . . . . . . 38.8 m-85 -62.76 -46.1 89.61 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.211 -0.931 . . . . 0.17999999999999999 109.729 -179.783 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' C' C ' 342' ' ' ARG . . . . . 0.445 HH11 ' CG ' ' C' ' 342' ' ' ARG . 0.0 OUTLIER -49.72 -42.45 46.01 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.215 -0.928 . . . . 2.9100000000000001 109.621 -179.89 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' C' C ' 343' ' ' GLU . . . . . . . . . . . . . 23.1 tt0 -57.89 -47.26 83.32 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.134 -0.978 . . . . 2.1400000000000001 109.298 -179.966 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' C' C ' 344' ' ' LEU . . . . . 0.615 HD22 HD22 ' D' ' 344' ' ' LEU . 76.3 mt -62.61 -29.07 70.33 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.211 -0.93 . . . . 0.22 109.232 179.704 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' C' C ' 345' ' ' ASN . . . . . . . . . . . . . 13.1 t-20 -58.84 -58.33 9.1 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.491 -0.756 . . . . 1.0800000000000001 109.837 179.998 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' C' C ' 346' ' ' GLU . . . . . . . . . . . . . 6.6 tm-20 -60.8 -25.86 66.87 Favored 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.322 -0.861 . . . . 2.21 109.785 -179.644 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' C' C ' 347' ' ' ALA . . . . . 0.854 ' HB1' ' HB1' ' D' ' 347' ' ' ALA . . . -63.84 -58.2 7.53 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.137 -0.977 . . . . 0.17999999999999999 110.028 -179.945 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' C' C ' 348' ' ' LEU . . . . . 0.567 ' N ' HD22 ' C' ' 348' ' ' LEU . 3.9 mm? -62.6 -49.61 74.54 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.202 -0.936 . . . . 0.32000000000000001 110.582 -179.355 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' C' C ' 349' ' ' GLU . . . . . . . . . . . . . 54.3 mt-10 -56.97 -39.05 73.88 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.187 -0.946 . . . . 2.1899999999999999 110.301 -179.096 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' C' C ' 350' ' ' LEU . . . . . 0.794 ' CD2' HD13 ' D' ' 350' ' ' LEU . 7.1 tt -64.57 -30.42 71.44 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.046 -1.033 . . . . 0.46000000000000002 109.653 -179.761 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' C' C ' 351' ' ' LYS . . . . . . . . . . . . . 10.2 tttt -59.34 -48.88 79.94 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.308 -0.87 . . . . 1.3500000000000001 109.414 -179.854 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' C' C ' 352' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -60.03 -47.06 87.41 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.331 -0.856 . . . . 1.1899999999999999 109.588 179.867 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' C' C ' 353' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 1.597 0 O-C-N 121.224 -0.922 . . . . 0.56999999999999995 109.461 -179.787 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' D' D ' 326' ' ' GLU . . . . . 0.401 ' O ' ' CD1' ' D' ' 327' ' ' TYR . 4.3 mm-40 . . . . . 0 N--CA 1.49 1.54 0 N-CA-C 109.451 -0.574 . . . . 2.1299999999999999 109.451 . . . . . . . . . 1 1 . 1 . 014 nuclear build core ' D' D ' 327' ' ' TYR . . . . . 0.566 ' CE2' ' HG2' ' B' ' 333' ' ' ARG . 43.7 m-85 -149.61 106.04 3.51 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.268 -0.895 . . . . 0.46999999999999997 109.534 179.824 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' D' D ' 328' ' ' PHE . . . . . 0.434 ' CE1' ' HA ' ' B' ' 335' ' ' ARG . 23.4 m-85 -111.87 -167.5 1.19 Allowed 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.339 -0.85 . . . . 0.29999999999999999 109.007 179.683 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' D' D ' 329' ' ' THR . . . . . 0.408 HG23 ' C ' ' D' ' 328' ' ' PHE . 75.5 p -153.59 -179.76 8.08 Favored 'General case' 0 N--CA 1.488 1.452 0 O-C-N 121.158 -0.964 . . . . 0.22 109.424 179.925 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' D' D ' 330' ' ' LEU . . . . . . . . . . . . . 52.2 tp -152.75 131.91 12.71 Favored 'General case' 0 N--CA 1.488 1.467 0 O-C-N 121.205 -0.934 . . . . 0.28000000000000003 109.532 -179.877 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' D' D ' 331' ' ' GLN . . . . . . . . . . . . . 44.6 tp60 -88.13 106.55 18.25 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.274 -0.891 . . . . 0.93000000000000005 109.521 179.922 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' D' D ' 332' ' ' ILE . . . . . . . . . . . . . 31.9 mt -103.41 103.37 15.04 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.545 0 O-C-N 121.168 -0.957 . . . . 0.25 109.519 179.919 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' D' D ' 333' ' ' ARG . . . . . 0.547 ' NH1' ' HG2' ' D' ' 333' ' ' ARG . 0.0 OUTLIER -72.66 151.45 42.25 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.249 -0.907 . . . . 2.9300000000000002 109.398 179.861 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' D' D ' 334' ' ' GLY . . . . . . . . . . . . . . . 86.56 128.87 2.46 Favored Glycine 0 N--CA 1.49 2.235 0 N-CA-C 109.595 -1.402 . . . . 0.40999999999999998 109.595 -179.978 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' D' D ' 335' ' ' ARG . . . . . 0.488 ' HA ' ' CE1' ' B' ' 328' ' ' PHE . 3.4 ttm180 -79.54 -39.18 32.51 Favored 'General case' 0 N--CA 1.489 1.487 0 O-C-N 121.202 -1.175 . . . . 3.0299999999999998 109.524 -179.975 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' D' D ' 336' ' ' GLU . . . . . . . . . . . . . 2.2 mt-10 -57.98 -61.4 2.57 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.252 -0.905 . . . . 2.2599999999999998 109.731 -179.89 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' D' D ' 337' ' ' ARG . . . . . 0.457 ' CG ' HH11 ' D' ' 337' ' ' ARG . 0.0 OUTLIER -59.85 -29.35 68.23 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.18 -0.95 . . . . 2.9199999999999999 109.504 -179.84 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' D' D ' 338' ' ' PHE . . . . . 0.44 ' HB3' ' O ' ' D' ' 335' ' ' ARG . 48.2 t80 -55.53 -56.2 23.04 Favored 'General case' 0 N--CA 1.488 1.474 0 O-C-N 121.219 -0.926 . . . . 0.37 109.483 179.886 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' D' D ' 339' ' ' GLU . . . . . . . . . . . . . 24.1 mt-10 -50.09 -33.49 18.76 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.23 -0.919 . . . . 1.99 110.03 -179.716 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' D' D ' 340' ' ' MET . . . . . . . . . . . . . 32.2 ttp -63.13 -51.11 67.78 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.2 -0.938 . . . . 0.31 109.814 -179.674 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' D' D ' 341' ' ' PHE . . . . . . . . . . . . . 39.3 m-85 -62.46 -51.99 65.28 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.146 -0.971 . . . . 0.17999999999999999 109.757 -179.741 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' D' D ' 342' ' ' ARG . . . . . . . . . . . . . 9.7 ttm180 -47.69 -36.76 11.69 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.156 -0.965 . . . . 2.4100000000000001 109.483 -179.926 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' D' D ' 343' ' ' GLU . . . . . . . . . . . . . 32.7 tt0 -58.91 -49.64 77.03 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.278 -0.889 . . . . 2.3500000000000001 109.504 179.935 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' D' D ' 344' ' ' LEU . . . . . 0.615 HD22 HD22 ' C' ' 344' ' ' LEU . 57.5 mt -62.47 -32.37 73.25 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.177 -0.952 . . . . 0.19 109.453 -179.996 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' D' D ' 345' ' ' ASN . . . . . . . . . . . . . 9.6 t-20 -56.77 -54.93 40.6 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.266 -0.896 . . . . 1.0900000000000001 109.63 -179.858 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' D' D ' 346' ' ' GLU . . . . . . . . . . . . . 44.0 tp10 -61.4 -31.61 71.53 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.258 -0.902 . . . . 1.6899999999999999 109.755 -179.746 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' D' D ' 347' ' ' ALA . . . . . 0.854 ' HB1' ' HB1' ' C' ' 347' ' ' ALA . . . -59.93 -57.82 11.21 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.236 -0.915 . . . . 0.17999999999999999 109.988 -179.709 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' D' D ' 348' ' ' LEU . . . . . 0.608 HD22 ' N ' ' D' ' 348' ' ' LEU . 4.2 mm? -61.53 -42.0 98.18 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.219 -0.926 . . . . 0.31 109.885 -179.664 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' D' D ' 349' ' ' GLU . . . . . . . . . . . . . 98.5 mt-10 -57.9 -35.12 70.59 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.245 -0.91 . . . . 1.95 109.943 -179.541 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' D' D ' 350' ' ' LEU . . . . . 0.794 HD13 ' CD2' ' C' ' 350' ' ' LEU . 5.7 tt -63.39 -46.37 86.73 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.125 -0.985 . . . . 0.42999999999999999 109.603 -179.814 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' D' D ' 351' ' ' LYS . . . . . . . . . . . . . 42.4 tttt -59.48 -37.87 79.36 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.253 -0.904 . . . . 1.3999999999999999 109.475 -179.996 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' D' D ' 352' ' ' ASP . . . . . . . . . . . . . 22.9 m-20 -55.76 -36.15 66.99 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.258 -0.901 . . . . 1.1699999999999999 109.635 179.975 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' D' D ' 353' ' ' ALA . . . . . . . . . . . . . . . -66.95 -35.83 80.85 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.239 -0.913 . . . . 0.58999999999999997 109.738 -179.739 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' D' D ' 354' ' ' GLN . . . . . . . . . . . . . 5.8 mt-30 . . . . . 0 N--CA 1.49 1.541 0 O-C-N 121.229 -0.919 . . . . 1.4399999999999999 109.595 -179.829 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 326' ' ' GLU . . . . . . . . . . . . . 20.8 mt-10 . . . . . 0 N--CA 1.49 1.572 0 N-CA-C 109.354 -0.61 . . . . 2.1299999999999999 109.354 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 327' ' ' TYR . . . . . 0.588 ' CE1' ' HG2' ' C' ' 333' ' ' ARG . 48.0 m-85 -148.54 111.36 4.81 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.303 -0.873 . . . . 0.47999999999999998 109.338 179.978 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 328' ' ' PHE . . . . . . . . . . . . . 94.5 m-85 -113.3 -169.88 1.58 Allowed 'General case' 0 N--CA 1.488 1.467 0 O-C-N 121.114 -0.991 . . . . 0.31 109.466 -179.706 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 329' ' ' THR . . . . . 0.502 ' HA ' ' O ' ' C' ' 330' ' ' LEU . 29.4 p -152.16 166.31 32.1 Favored 'General case' 0 C--N 1.303 -1.424 0 O-C-N 121.298 -0.876 . . . . 0.22 109.022 179.879 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 330' ' ' LEU . . . . . . . . . . . . . 49.2 tp -149.71 128.32 12.35 Favored 'General case' 0 C--N 1.303 -1.444 0 O-C-N 121.107 -0.996 . . . . 0.28000000000000003 109.972 -179.396 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 331' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -86.74 109.92 19.55 Favored 'General case' 0 N--CA 1.488 1.471 0 O-C-N 121.321 -0.862 . . . . 0.91000000000000003 109.184 179.681 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 332' ' ' ILE . . . . . 0.63 HD12 ' HD1' ' A' ' 338' ' ' PHE . 10.6 mt -103.65 108.44 24.54 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.536 0 O-C-N 121.203 -0.936 . . . . 0.26000000000000001 109.766 -179.716 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 333' ' ' ARG . . . . . 0.52 ' HG2' ' CE1' ' C' ' 327' ' ' TYR . 37.8 mtm-85 -71.95 151.86 42.95 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.192 -0.942 . . . . 2.9199999999999999 109.337 179.804 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 334' ' ' GLY . . . . . . . . . . . . . . . 79.8 129.85 0.77 Allowed Glycine 0 N--CA 1.491 2.335 0 N-CA-C 109.703 -1.359 . . . . 0.40000000000000002 109.703 179.746 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 335' ' ' ARG . . . . . . . . . . . . . 9.6 ttm180 -79.92 -37.47 34.54 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.275 -1.132 . . . . 3.0099999999999998 109.579 179.919 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 336' ' ' GLU . . . . . . . . . . . . . 4.2 mm-40 -57.15 -63.48 1.2 Allowed 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.325 -0.859 . . . . 2.29 109.807 -179.744 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 337' ' ' ARG . . . . . 0.442 ' HG2' HH11 ' A' ' 337' ' ' ARG . 5.0 mmt-85 -60.39 -30.44 69.59 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.266 -0.896 . . . . 2.9300000000000002 109.788 -179.737 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 338' ' ' PHE . . . . . 0.63 ' HD1' HD12 ' A' ' 332' ' ' ILE . 25.8 t80 -55.26 -56.89 14.82 Favored 'General case' 0 N--CA 1.489 1.487 0 O-C-N 121.063 -1.023 . . . . 0.38 109.122 179.716 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 339' ' ' GLU . . . . . . . . . . . . . 32.1 mt-10 -51.32 -30.6 18.82 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.428 -0.795 . . . . 1.97 109.574 -179.755 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 340' ' ' MET . . . . . . . . . . . . . 41.5 ttp -63.66 -50.57 68.74 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.286 -0.884 . . . . 0.31 109.593 -179.834 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 341' ' ' PHE . . . . . 0.416 ' CZ ' ' HA ' ' C' ' 345' ' ' ASN . 75.7 m-85 -62.74 -46.49 87.81 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.205 -0.934 . . . . 0.17999999999999999 109.718 -179.873 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 342' ' ' ARG . . . . . 0.453 HH11 ' HG3' ' A' ' 342' ' ' ARG . 0.3 OUTLIER -49.03 -42.69 39.11 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.257 -0.902 . . . . 2.4199999999999999 109.987 -179.578 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 343' ' ' GLU . . . . . . . . . . . . . 25.1 tt0 -59.82 -44.62 93.94 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.38 -0.825 . . . . 2.3500000000000001 109.846 -179.72 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 344' ' ' LEU . . . . . . . . . . . . . 41.1 mt -62.49 -36.01 81.17 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.1 -1.0 . . . . 0.17999999999999999 109.933 -179.661 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 345' ' ' ASN . . . . . . . . . . . . . 63.8 t-20 -57.41 -54.66 44.34 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.298 -0.876 . . . . 1.0900000000000001 109.906 -179.626 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 346' ' ' GLU . . . . . . . . . . . . . 83.5 tt0 -60.92 -30.33 70.13 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.139 -0.976 . . . . 1.6499999999999999 109.946 -179.59 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 347' ' ' ALA . . . . . 0.876 ' HB1' ' HB1' ' B' ' 347' ' ' ALA . . . -60.58 -56.34 22.5 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.176 -0.953 . . . . 0.17999999999999999 110.014 -179.616 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 348' ' ' LEU . . . . . 0.575 HD22 ' N ' ' A' ' 348' ' ' LEU . 3.9 mm? -61.33 -48.93 79.08 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.16 -0.962 . . . . 0.29999999999999999 110.073 -179.398 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 349' ' ' GLU . . . . . . . . . . . . . 80.6 mm-40 -57.13 -30.27 64.26 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.24 -0.912 . . . . 1.9399999999999999 110.127 -179.453 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 350' ' ' LEU . . . . . 0.73 HD23 ' O ' ' A' ' 350' ' ' LEU . 4.2 tt -64.28 -48.0 77.38 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.127 -0.983 . . . . 0.46000000000000002 109.419 -179.984 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 351' ' ' LYS . . . . . . . . . . . . . 68.0 tttt -59.17 -48.83 80.15 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.277 -0.889 . . . . 1.3999999999999999 109.538 -179.964 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 352' ' ' ASP . . . . . . . . . . . . . 3.4 m-20 -54.82 -29.36 54.62 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.251 -0.905 . . . . 1.1599999999999999 109.478 -179.995 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 353' ' ' ALA . . . . . . . . . . . . . . . -67.2 -37.98 84.56 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.276 -0.89 . . . . 0.63 109.512 179.945 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 354' ' ' GLN . . . . . . . . . . . . . 90.5 mt-30 . . . . . 0 N--CA 1.488 1.461 0 O-C-N 121.252 -0.905 . . . . 1.47 109.475 -179.999 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' B' B ' 326' ' ' GLU . . . . . . . . . . . . . 20.0 mt-10 . . . . . 0 N--CA 1.488 1.475 0 CA-C-O 121.354 0.597 . . . . 2.1299999999999999 109.449 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' B' B ' 327' ' ' TYR . . . . . 0.473 ' CE1' ' HG2' ' D' ' 333' ' ' ARG . 48.7 m-85 -148.86 112.04 4.93 Favored 'General case' 0 N--CA 1.488 1.454 0 O-C-N 121.286 -0.884 . . . . 0.47999999999999998 109.322 179.891 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 328' ' ' PHE . . . . . 0.4 ' CE1' ' HB2' ' D' ' 335' ' ' ARG . 94.0 m-85 -113.5 -169.45 1.5 Allowed 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.246 -0.908 . . . . 0.32000000000000001 109.514 -179.865 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 329' ' ' THR . . . . . . . . . . . . . 29.6 p -152.64 166.46 32.04 Favored 'General case' 0 N--CA 1.487 1.42 0 O-C-N 121.274 -0.891 . . . . 0.23000000000000001 109.055 179.771 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 330' ' ' LEU . . . . . 0.547 HD11 HD22 ' D' ' 345' ' ' ASN . 49.3 tp -149.87 128.85 12.61 Favored 'General case' 0 C--N 1.302 -1.473 0 O-C-N 121.033 -1.042 . . . . 0.28000000000000003 109.812 -179.46 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 331' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -87.3 109.69 19.69 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.398 -0.813 . . . . 0.91000000000000003 109.184 179.773 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 332' ' ' ILE . . . . . 0.61 HD12 ' HD1' ' B' ' 338' ' ' PHE . 10.3 mt -103.61 108.67 25.03 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.499 0 O-C-N 121.16 -0.962 . . . . 0.23999999999999999 109.778 -179.686 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 333' ' ' ARG . . . . . 0.504 ' NH1' ' HG3' ' B' ' 333' ' ' ARG . 39.3 mtm-85 -71.93 152.24 42.69 Favored 'General case' 0 N--CA 1.488 1.455 0 O-C-N 121.312 -0.868 . . . . 2.9300000000000002 109.387 179.73 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 334' ' ' GLY . . . . . . . . . . . . . . . 78.46 129.83 0.57 Allowed Glycine 0 N--CA 1.49 2.236 0 N-CA-C 109.719 -1.352 . . . . 0.40000000000000002 109.719 179.811 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 335' ' ' ARG . . . . . . . . . . . . . 9.6 ttm180 -79.77 -37.99 34.15 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.29 -1.123 . . . . 3.0099999999999998 109.65 -179.938 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 336' ' ' GLU . . . . . . . . . . . . . 4.5 mm-40 -56.21 -63.68 1.11 Allowed 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.232 -0.917 . . . . 2.2799999999999998 109.783 -179.8 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 337' ' ' ARG . . . . . 0.447 ' HG2' HH11 ' B' ' 337' ' ' ARG . 4.7 mmt-85 -60.53 -30.44 69.74 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.282 -0.886 . . . . 2.9300000000000002 109.608 -179.634 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 338' ' ' PHE . . . . . 0.61 ' HD1' HD12 ' B' ' 332' ' ' ILE . 25.6 t80 -55.09 -57.49 11.51 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.185 -0.947 . . . . 0.37 109.015 179.599 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 339' ' ' GLU . . . . . . . . . . . . . 31.5 mt-10 -50.76 -30.78 14.92 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.313 -0.867 . . . . 1.98 109.695 -179.82 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 340' ' ' MET . . . . . . . . . . . . . 41.5 ttp -63.54 -50.94 67.57 Favored 'General case' 0 N--CA 1.488 1.468 0 O-C-N 121.325 -0.859 . . . . 0.32000000000000001 109.58 -179.93 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 341' ' ' PHE . . . . . . . . . . . . . 76.6 m-85 -62.35 -46.78 87.11 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.086 -1.009 . . . . 0.17999999999999999 109.685 -179.905 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 342' ' ' ARG . . . . . 0.452 HH11 ' HG3' ' B' ' 342' ' ' ARG . 0.2 OUTLIER -48.41 -43.37 34.07 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.294 -0.878 . . . . 2.4199999999999999 109.795 -179.612 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' B' B ' 343' ' ' GLU . . . . . . . . . . . . . 26.0 tt0 -59.42 -44.79 92.81 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.298 -0.876 . . . . 2.3500000000000001 109.895 -179.569 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 344' ' ' LEU . . . . . . . . . . . . . 41.2 mt -62.17 -36.47 81.97 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.197 -0.939 . . . . 0.17999999999999999 109.889 -179.618 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 345' ' ' ASN . . . . . 0.425 ' HA ' ' CZ ' ' D' ' 341' ' ' PHE . 62.7 t-20 -57.05 -54.86 41.98 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.203 -0.935 . . . . 1.0900000000000001 109.982 -179.669 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 346' ' ' GLU . . . . . . . . . . . . . 83.7 tt0 -61.06 -30.49 70.36 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.14 -0.975 . . . . 1.6599999999999999 109.842 -179.472 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 347' ' ' ALA . . . . . 0.876 ' HB1' ' HB1' ' A' ' 347' ' ' ALA . . . -60.31 -56.29 23.35 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.2 -0.937 . . . . 0.17000000000000001 110.116 -179.741 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 348' ' ' LEU . . . . . 0.585 HD22 ' N ' ' B' ' 348' ' ' LEU . 3.9 mm? -61.66 -48.4 81.02 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.087 -1.008 . . . . 0.28999999999999998 110.06 -179.366 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 349' ' ' GLU . . . . . . . . . . . . . 80.8 mm-40 -57.32 -30.66 64.95 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.158 -0.964 . . . . 1.95 110.079 -179.351 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 350' ' ' LEU . . . . . 0.731 HD23 ' O ' ' B' ' 350' ' ' LEU . 4.2 tt -63.95 -47.98 78.3 Favored 'General case' 0 C--N 1.302 -1.465 0 O-C-N 121.204 -0.935 . . . . 0.45000000000000001 109.398 -179.909 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 351' ' ' LYS . . . . . . . . . . . . . 68.3 tttt -59.15 -48.35 81.92 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.331 -0.856 . . . . 1.3799999999999999 109.566 -179.973 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 352' ' ' ASP . . . . . . . . . . . . . 3.2 m-20 -55.26 -29.68 58.58 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.243 -0.911 . . . . 1.1599999999999999 109.371 179.988 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 353' ' ' ALA . . . . . . . . . . . . . . . -66.74 -38.3 86.38 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.329 -0.857 . . . . 0.60999999999999999 109.487 -179.967 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 354' ' ' GLN . . . . . . . . . . . . . 90.3 mt-30 . . . . . 0 N--CA 1.489 1.515 0 O-C-N 121.236 -0.915 . . . . 1.45 109.467 179.863 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' C' C ' 326' ' ' GLU . . . . . . . . . . . . . 34.3 mt-10 . . . . . 0 N--CA 1.489 1.513 0 CA-C-O 121.348 0.594 . . . . 2.1699999999999999 109.608 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' C' C ' 327' ' ' TYR . . . . . 0.52 ' CE1' ' HG2' ' A' ' 333' ' ' ARG . 39.1 m-85 -148.11 111.41 4.93 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.387 -0.82 . . . . 0.47999999999999998 109.399 179.973 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' C' C ' 328' ' ' PHE . . . . . 0.4 ' O ' HG23 ' C' ' 329' ' ' THR . 97.8 m-85 -113.98 -168.16 1.31 Allowed 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.155 -0.966 . . . . 0.33000000000000002 109.629 -179.978 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' C' C ' 329' ' ' THR . . . . . 0.4 HG23 ' O ' ' C' ' 328' ' ' PHE . 9.4 p -153.13 165.83 34.4 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.392 -0.818 . . . . 0.23000000000000001 108.962 -179.99 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' C' C ' 330' ' ' LEU . . . . . 0.502 ' O ' ' HA ' ' A' ' 329' ' ' THR . 16.3 tp -151.94 126.31 9.36 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.202 -0.936 . . . . 0.28000000000000003 109.858 -179.521 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' C' C ' 331' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -85.89 118.65 25.51 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.298 -0.876 . . . . 1.48 109.044 179.433 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' C' C ' 332' ' ' ILE . . . . . . . . . . . . . 83.1 mt -103.45 109.86 28.24 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.508 0 O-C-N 121.163 -0.961 . . . . 0.23999999999999999 110.111 -179.452 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' C' C ' 333' ' ' ARG . . . . . 0.588 ' HG2' ' CE1' ' A' ' 327' ' ' TYR . 10.9 mtt180 -72.8 128.74 36.41 Favored 'General case' 0 N--CA 1.489 1.479 0 O-C-N 121.284 -0.885 . . . . 2.7400000000000002 109.289 179.674 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' C' C ' 334' ' ' GLY . . . . . . . . . . . . . . . 101.46 131.56 7.43 Favored Glycine 0 N--CA 1.489 2.212 0 N-CA-C 109.426 -1.47 . . . . 0.34999999999999998 109.426 -179.913 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' C' C ' 335' ' ' ARG . . . . . 0.484 ' O ' ' HB3' ' C' ' 338' ' ' PHE . 12.1 ttt180 -80.42 -37.28 32.4 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.239 -1.154 . . . . 2.5299999999999998 109.991 -179.653 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' C' C ' 336' ' ' GLU . . . . . . . . . . . . . 6.2 mm-40 -58.51 -57.15 14.22 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.052 -1.03 . . . . 2.6200000000000001 109.943 -179.586 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' C' C ' 337' ' ' ARG . . . . . . . . . . . . . 2.0 mtp180 -59.96 -24.61 64.55 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.235 -0.916 . . . . 2.8100000000000001 109.629 -179.603 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' C' C ' 338' ' ' PHE . . . . . 0.484 ' HB3' ' O ' ' C' ' 335' ' ' ARG . 85.3 t80 -54.95 -63.08 1.27 Allowed 'General case' 0 N--CA 1.489 1.489 0 O-C-N 121.289 -0.882 . . . . 0.40000000000000002 109.387 -179.973 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' C' C ' 339' ' ' GLU . . . . . . . . . . . . . 42.5 mt-10 -50.03 -30.17 10.18 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.287 -0.883 . . . . 2.0499999999999998 109.917 -179.68 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' C' C ' 340' ' ' MET . . . . . . . . . . . . . 27.4 ttp -64.22 -55.95 18.04 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.169 -0.957 . . . . 0.32000000000000001 110.051 -179.882 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' C' C ' 341' ' ' PHE . . . . . . . . . . . . . 52.9 m-85 -62.32 -51.4 67.8 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.157 -0.965 . . . . 0.17999999999999999 109.76 -179.51 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' C' C ' 342' ' ' ARG . . . . . . . . . . . . . 2.7 ttp180 -45.49 -40.85 8.93 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.268 -0.895 . . . . 2.9100000000000001 109.577 179.999 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' C' C ' 343' ' ' GLU . . . . . . . . . . . . . 16.9 tt0 -60.5 -48.62 80.95 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.208 -0.932 . . . . 2.1400000000000001 110.297 -179.637 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' C' C ' 344' ' ' LEU . . . . . 0.48 HD22 ' CD2' ' D' ' 344' ' ' LEU . 37.5 mt -60.51 -42.43 96.4 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 120.937 -1.102 . . . . 0.22 109.852 -179.481 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' C' C ' 345' ' ' ASN . . . . . 0.416 ' HA ' ' CZ ' ' A' ' 341' ' ' PHE . 44.4 t-20 -56.03 -47.9 76.97 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.161 -0.962 . . . . 1.0800000000000001 109.436 179.906 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' C' C ' 346' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -62.42 -37.31 85.36 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.173 -0.955 . . . . 2.21 109.785 -179.756 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' C' C ' 347' ' ' ALA . . . . . 0.775 ' HB1' ' HB1' ' D' ' 347' ' ' ALA . . . -59.04 -55.4 35.53 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.137 -0.977 . . . . 0.17999999999999999 110.251 -179.664 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' C' C ' 348' ' ' LEU . . . . . 0.604 ' N ' HD22 ' C' ' 348' ' ' LEU . 4.1 mm? -60.13 -38.62 83.61 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.109 -0.994 . . . . 0.32000000000000001 109.548 -179.578 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' C' C ' 349' ' ' GLU . . . . . . . . . . . . . 89.3 mt-10 -59.0 -41.68 88.25 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.352 -0.842 . . . . 2.1899999999999999 110.206 -179.481 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' C' C ' 350' ' ' LEU . . . . . 0.687 HD22 HD13 ' D' ' 350' ' ' LEU . 6.6 tt -63.21 -40.77 98.43 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.216 -0.928 . . . . 0.46000000000000002 110.022 -179.439 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' C' C ' 351' ' ' LYS . . . . . . . . . . . . . 2.8 tttm -59.38 -41.27 88.95 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.242 -0.911 . . . . 1.3500000000000001 109.886 -179.602 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' C' C ' 352' ' ' ASP . . . . . . . . . . . . . 3.1 m-20 -56.08 -41.11 74.62 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.171 -0.955 . . . . 1.1899999999999999 110.064 -179.774 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' C' C ' 353' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 1.585 0 O-C-N 121.219 -0.926 . . . . 0.56999999999999995 109.578 -179.881 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' D' D ' 326' ' ' GLU . . . . . . . . . . . . . 19.7 mt-10 . . . . . 0 N--CA 1.489 1.482 0 CA-C-O 121.316 0.579 . . . . 2.1299999999999999 109.566 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' D' D ' 327' ' ' TYR . . . . . 0.468 ' CE1' ' HG2' ' B' ' 333' ' ' ARG . 49.9 m-85 -148.84 111.7 4.84 Favored 'General case' 0 N--CA 1.488 1.455 0 O-C-N 121.167 -0.958 . . . . 0.46999999999999997 109.285 179.935 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' D' D ' 328' ' ' PHE . . . . . . . . . . . . . 94.4 m-85 -113.45 -169.5 1.51 Allowed 'General case' 0 N--CA 1.487 1.405 0 O-C-N 121.337 -0.852 . . . . 0.29999999999999999 109.459 -179.859 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' D' D ' 329' ' ' THR . . . . . 0.412 ' HA ' ' O ' ' B' ' 330' ' ' LEU . 25.7 p -152.69 166.95 30.54 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.285 -0.885 . . . . 0.22 108.937 179.953 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' D' D ' 330' ' ' LEU . . . . . 0.407 HD21 ' HB2' ' B' ' 345' ' ' ASN . 49.2 tp -150.1 128.51 12.17 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.151 -0.968 . . . . 0.28000000000000003 109.737 -179.441 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' D' D ' 331' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -86.95 109.74 19.56 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.231 -0.918 . . . . 0.93000000000000005 109.134 179.632 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' D' D ' 332' ' ' ILE . . . . . 0.608 HD12 ' HD1' ' D' ' 338' ' ' PHE . 10.7 mt -103.62 108.55 24.76 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.539 0 O-C-N 121.201 -0.937 . . . . 0.25 109.765 -179.647 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' D' D ' 333' ' ' ARG . . . . . 0.52 ' NH1' ' HG3' ' D' ' 333' ' ' ARG . 39.0 mtm-85 -72.0 152.51 42.41 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.267 -0.895 . . . . 2.9300000000000002 109.375 179.736 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' D' D ' 334' ' ' GLY . . . . . . . . . . . . . . . 78.41 129.73 0.56 Allowed Glycine 0 N--CA 1.492 2.405 0 N-CA-C 109.635 -1.386 . . . . 0.40999999999999998 109.635 179.889 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' D' D ' 335' ' ' ARG . . . . . 0.4 ' HB2' ' CE1' ' B' ' 328' ' ' PHE . 9.6 ttm180 -80.1 -37.04 34.52 Favored 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.343 -1.092 . . . . 3.0299999999999998 109.421 -179.937 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' D' D ' 336' ' ' GLU . . . . . . . . . . . . . 4.7 mm-40 -56.76 -63.88 1.06 Allowed 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.254 -0.904 . . . . 2.2599999999999998 109.726 -179.788 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' D' D ' 337' ' ' ARG . . . . . 0.443 ' HG2' HH11 ' D' ' 337' ' ' ARG . 5.5 mmt-85 -60.34 -29.93 69.2 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.201 -0.937 . . . . 2.9199999999999999 109.803 -179.557 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' D' D ' 338' ' ' PHE . . . . . 0.608 ' HD1' HD12 ' D' ' 332' ' ' ILE . 25.7 t80 -55.82 -57.52 11.72 Favored 'General case' 0 N--CA 1.489 1.492 0 O-C-N 121.242 -0.911 . . . . 0.37 108.909 179.745 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' D' D ' 339' ' ' GLU . . . . . . . . . . . . . 31.0 mt-10 -50.48 -30.93 13.93 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.25 -0.906 . . . . 1.99 109.665 -179.961 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' D' D ' 340' ' ' MET . . . . . . . . . . . . . 41.8 ttp -63.26 -50.96 68.13 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.2 -0.937 . . . . 0.31 109.696 -179.811 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' D' D ' 341' ' ' PHE . . . . . 0.425 ' CZ ' ' HA ' ' B' ' 345' ' ' ASN . 76.8 m-85 -62.35 -46.67 87.63 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.258 -0.901 . . . . 0.17999999999999999 109.661 -179.887 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' D' D ' 342' ' ' ARG . . . . . 0.446 ' HG3' HH11 ' D' ' 342' ' ' ARG . 0.2 OUTLIER -48.43 -43.63 34.52 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.348 -0.845 . . . . 2.4100000000000001 109.871 -179.611 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' D' D ' 343' ' ' GLU . . . . . . . . . . . . . 26.2 tt0 -59.24 -44.56 92.34 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.223 -0.923 . . . . 2.3500000000000001 109.976 -179.595 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' D' D ' 344' ' ' LEU . . . . . 0.48 ' CD2' HD22 ' C' ' 344' ' ' LEU . 42.2 mt -62.41 -36.38 82.16 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.239 -0.913 . . . . 0.19 109.879 -179.654 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' D' D ' 345' ' ' ASN . . . . . 0.547 HD22 HD11 ' B' ' 330' ' ' LEU . 62.3 t-20 -57.53 -54.71 43.78 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.221 -0.925 . . . . 1.0900000000000001 109.923 -179.614 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' D' D ' 346' ' ' GLU . . . . . . . . . . . . . 84.3 tt0 -61.1 -30.33 70.29 Favored 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.127 -0.983 . . . . 1.6899999999999999 109.815 -179.605 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' D' D ' 347' ' ' ALA . . . . . 0.775 ' HB1' ' HB1' ' C' ' 347' ' ' ALA . . . -60.6 -56.22 23.93 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.117 -0.989 . . . . 0.17999999999999999 110.056 -179.652 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' D' D ' 348' ' ' LEU . . . . . 0.596 HD22 ' N ' ' D' ' 348' ' ' LEU . 3.9 mm? -61.54 -48.73 79.69 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.235 -0.915 . . . . 0.31 109.979 -179.491 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' D' D ' 349' ' ' GLU . . . . . . . . . . . . . 80.8 mm-40 -57.2 -30.21 64.36 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.114 -0.991 . . . . 1.95 110.068 -179.317 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' D' D ' 350' ' ' LEU . . . . . 0.722 HD23 ' O ' ' D' ' 350' ' ' LEU . 4.2 tt -64.09 -48.19 77.14 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.03 -1.044 . . . . 0.42999999999999999 109.34 179.945 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' D' D ' 351' ' ' LYS . . . . . . . . . . . . . 68.5 tttt -58.95 -48.43 81.53 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.287 -0.883 . . . . 1.3999999999999999 109.551 -179.899 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' D' D ' 352' ' ' ASP . . . . . . . . . . . . . 3.1 m-20 -55.15 -29.24 57.38 Favored 'General case' 0 N--CA 1.488 1.467 0 O-C-N 121.217 -0.927 . . . . 1.1699999999999999 109.478 179.963 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' D' D ' 353' ' ' ALA . . . . . . . . . . . . . . . -67.33 -38.23 84.57 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.271 -0.893 . . . . 0.58999999999999997 109.47 179.968 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' D' D ' 354' ' ' GLN . . . . . 0.409 ' OE1' HD11 ' C' ' 350' ' ' LEU . 89.6 mt-30 . . . . . 0 N--CA 1.49 1.533 0 O-C-N 121.222 -0.924 . . . . 1.4399999999999999 109.453 179.995 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 326' ' ' GLU . . . . . . . . . . . . . 66.9 mm-40 . . . . . 0 N--CA 1.489 1.489 0 N-CA-C 109.312 -0.625 . . . . 2.1299999999999999 109.312 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 327' ' ' TYR . . . . . 0.605 ' CE1' ' CG ' ' C' ' 333' ' ' ARG . 43.1 m-85 -148.75 95.27 2.39 Favored 'General case' 0 N--CA 1.488 1.446 0 O-C-N 121.249 -0.907 . . . . 0.47999999999999998 109.557 -179.898 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 328' ' ' PHE . . . . . . . . . . . . . 84.7 m-85 -103.35 -162.48 0.91 Allowed 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.255 -0.903 . . . . 0.31 109.62 -179.991 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 329' ' ' THR . . . . . . . . . . . . . 40.8 p -154.12 166.91 31.6 Favored 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.365 -0.834 . . . . 0.22 109.11 179.855 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 330' ' ' LEU . . . . . . . . . . . . . 18.9 tp -149.96 126.61 10.96 Favored 'General case' 0 N--CA 1.488 1.46 0 O-C-N 121.097 -1.002 . . . . 0.28000000000000003 110.064 -179.561 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 331' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -88.07 112.62 22.86 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.353 -0.842 . . . . 0.91000000000000003 108.95 179.399 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 332' ' ' ILE . . . . . 0.578 HG21 ' HA ' ' A' ' 338' ' ' PHE . 50.5 mt -103.49 109.45 27.06 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.595 0 O-C-N 121.216 -0.928 . . . . 0.26000000000000001 109.792 -179.716 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 333' ' ' ARG . . . . . 0.542 ' HG2' ' CE1' ' C' ' 327' ' ' TYR . 80.8 mtt180 -72.73 149.46 43.71 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.37 -0.831 . . . . 2.9199999999999999 109.449 179.803 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 334' ' ' GLY . . . . . . . . . . . . . . . 82.03 124.69 0.78 Allowed Glycine 0 N--CA 1.491 2.307 0 N-CA-C 109.398 -1.481 . . . . 0.40000000000000002 109.398 -179.894 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 335' ' ' ARG . . . . . . . . . . . . . 60.6 ttt180 -75.53 -33.42 60.71 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.318 -1.107 . . . . 3.0099999999999998 109.542 -179.894 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 336' ' ' GLU . . . . . . . . . . . . . 62.8 tt0 -58.32 -61.84 2.27 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.267 -0.896 . . . . 2.29 109.768 -179.886 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 337' ' ' ARG . . . . . 0.654 ' NH2' HD12 ' C' ' 348' ' ' LEU . 8.2 mmt180 -62.1 -33.18 73.95 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.122 -0.987 . . . . 2.9300000000000002 109.783 -179.739 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 338' ' ' PHE . . . . . 0.578 ' HA ' HG21 ' A' ' 332' ' ' ILE . 45.7 t80 -54.38 -57.02 12.87 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.123 -0.986 . . . . 0.38 109.753 -179.631 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 339' ' ' GLU . . . . . . . . . . . . . 41.6 mt-10 -51.09 -35.1 33.37 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.234 -0.916 . . . . 1.97 109.989 -179.699 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 340' ' ' MET . . . . . . . . . . . . . 48.5 ttp -63.61 -49.14 74.47 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.262 -0.899 . . . . 0.31 110.092 -179.56 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 341' ' ' PHE . . . . . . . . . . . . . 44.3 m-85 -61.83 -45.97 91.51 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.239 -0.913 . . . . 0.17999999999999999 109.835 -179.456 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 342' ' ' ARG . . . . . . . . . . . . . 5.7 ttt180 -49.91 -42.26 47.73 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.167 -0.958 . . . . 2.4199999999999999 110.06 -179.658 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 343' ' ' GLU . . . . . . . . . . . . . 1.2 tp10 -59.04 -49.85 76.33 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.144 -0.972 . . . . 2.3500000000000001 109.886 -179.613 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 344' ' ' LEU . . . . . 0.439 HD22 HD22 ' B' ' 344' ' ' LEU . 61.5 mt -59.94 -30.95 69.42 Favored 'General case' 0 N--CA 1.489 1.495 0 O-C-N 121.222 -0.924 . . . . 0.17999999999999999 109.403 -179.737 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 345' ' ' ASN . . . . . 0.553 ' C ' HD21 ' A' ' 345' ' ' ASN . 0.3 OUTLIER -58.41 -59.3 5.56 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.271 -0.893 . . . . 1.0900000000000001 109.74 -179.98 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 346' ' ' GLU . . . . . 0.465 ' OE1' ' NZ ' ' B' ' 351' ' ' LYS . 1.0 OUTLIER -61.48 -26.29 67.8 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.234 -0.917 . . . . 1.6499999999999999 109.884 -179.577 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 347' ' ' ALA . . . . . 0.478 ' HB1' ' HB1' ' B' ' 347' ' ' ALA . . . -60.79 -57.93 10.59 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.173 -0.954 . . . . 0.17999999999999999 110.018 -179.74 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 348' ' ' LEU . . . . . 0.592 HD22 ' N ' ' A' ' 348' ' ' LEU . 4.1 mm? -61.94 -44.5 96.63 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.211 -0.931 . . . . 0.29999999999999999 110.122 -179.38 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 349' ' ' GLU . . . . . . . . . . . . . 12.0 mm-40 -58.34 -33.34 69.43 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.123 -0.985 . . . . 1.9399999999999999 109.939 -179.462 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 350' ' ' LEU . . . . . 0.754 HD23 ' O ' ' A' ' 350' ' ' LEU . 5.1 tt -64.47 -43.51 93.98 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.225 -0.922 . . . . 0.46000000000000002 109.843 -179.761 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 351' ' ' LYS . . . . . 0.44 ' NZ ' ' OE1' ' B' ' 346' ' ' GLU . 19.8 tttp -59.15 -45.11 91.82 Favored 'General case' 0 N--CA 1.489 1.499 0 O-C-N 121.337 -0.852 . . . . 1.3999999999999999 109.961 -179.643 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 352' ' ' ASP . . . . . . . . . . . . . 36.1 m-20 -58.66 -49.03 79.04 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.233 -0.917 . . . . 1.1599999999999999 110.265 -179.584 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 353' ' ' ALA . . . . . . . . . . . . . . . -65.99 -11.05 45.11 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.087 -1.008 . . . . 0.63 109.893 -179.31 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 354' ' ' GLN . . . . . 0.675 ' OE1' HD11 ' B' ' 350' ' ' LEU . 5.6 mt-30 . . . . . 0 N--CA 1.49 1.538 0 O-C-N 121.228 -0.92 . . . . 1.47 109.55 179.765 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 326' ' ' GLU . . . . . . . . . . . . . 67.0 mm-40 . . . . . 0 N--CA 1.489 1.5 0 N-CA-C 109.261 -0.644 . . . . 2.1299999999999999 109.261 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' B' B ' 327' ' ' TYR . . . . . 0.579 ' CE1' ' HG2' ' D' ' 333' ' ' ARG . 44.1 m-85 -148.63 94.97 2.36 Favored 'General case' 0 N--CA 1.488 1.425 0 O-C-N 121.011 -1.056 . . . . 0.47999999999999998 109.582 -179.956 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 328' ' ' PHE . . . . . . . . . . . . . 85.5 m-85 -103.19 -162.83 0.94 Allowed 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.265 -0.897 . . . . 0.32000000000000001 109.534 -179.91 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 329' ' ' THR . . . . . . . . . . . . . 41.1 p -153.96 166.92 31.46 Favored 'General case' 0 N--CA 1.488 1.471 0 O-C-N 121.33 -0.856 . . . . 0.23000000000000001 109.082 179.943 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 330' ' ' LEU . . . . . 0.512 HD11 HD22 ' D' ' 345' ' ' ASN . 18.6 tp -149.97 126.03 10.6 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.011 -1.056 . . . . 0.28000000000000003 109.954 -179.579 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 331' ' ' GLN . . . . . 0.453 ' OE1' ' O ' ' D' ' 328' ' ' PHE . 0.2 OUTLIER -87.38 112.66 22.35 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.273 -0.892 . . . . 0.91000000000000003 108.895 179.432 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' B' B ' 332' ' ' ILE . . . . . 0.561 HG21 ' HA ' ' B' ' 338' ' ' PHE . 50.3 mt -103.46 109.6 27.47 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.561 0 O-C-N 121.113 -0.992 . . . . 0.23999999999999999 109.746 -179.699 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 333' ' ' ARG . . . . . 0.541 ' HG2' ' CE1' ' D' ' 327' ' ' TYR . 81.6 mtt180 -72.84 149.96 43.1 Favored 'General case' 0 N--CA 1.489 1.486 0 O-C-N 121.329 -0.857 . . . . 2.9300000000000002 109.414 179.748 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 334' ' ' GLY . . . . . . . . . . . . . . . 81.4 124.81 0.7 Allowed Glycine 0 N--CA 1.491 2.36 0 N-CA-C 109.444 -1.463 . . . . 0.40000000000000002 109.444 -179.893 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 335' ' ' ARG . . . . . . . . . . . . . 58.7 ttt180 -75.42 -33.15 60.92 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.22 -1.165 . . . . 3.0099999999999998 109.644 -179.874 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 336' ' ' GLU . . . . . . . . . . . . . 61.3 tt0 -58.78 -61.77 2.37 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.241 -0.912 . . . . 2.2799999999999998 109.704 -179.793 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 337' ' ' ARG . . . . . . . . . . . . . 7.8 mmt180 -61.78 -33.1 73.48 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.161 -0.962 . . . . 2.9300000000000002 109.743 -179.762 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 338' ' ' PHE . . . . . 0.561 ' HA ' HG21 ' B' ' 332' ' ' ILE . 46.4 t80 -54.26 -57.54 10.79 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.171 -0.956 . . . . 0.37 109.794 -179.805 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 339' ' ' GLU . . . . . . . . . . . . . 41.3 mt-10 -51.02 -34.82 31.02 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.177 -0.952 . . . . 1.98 110.071 -179.686 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 340' ' ' MET . . . . . . . . . . . . . 47.8 ttp -63.91 -48.99 74.4 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.146 -0.971 . . . . 0.32000000000000001 110.094 -179.505 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 341' ' ' PHE . . . . . . . . . . . . . 44.5 m-85 -61.96 -46.17 90.47 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.151 -0.968 . . . . 0.17999999999999999 109.885 -179.56 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 342' ' ' ARG . . . . . . . . . . . . . 6.0 ttt180 -49.69 -42.36 45.52 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.213 -0.929 . . . . 2.4199999999999999 110.051 -179.631 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 343' ' ' GLU . . . . . . . . . . . . . 1.1 tp10 -58.92 -49.62 77.11 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.077 -1.014 . . . . 2.3500000000000001 109.882 -179.604 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 344' ' ' LEU . . . . . 0.439 HD22 HD22 ' A' ' 344' ' ' LEU . 60.0 mt -60.29 -30.84 69.74 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.208 -0.932 . . . . 0.17999999999999999 109.432 -179.677 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 345' ' ' ASN . . . . . 0.428 ' HA ' ' CZ ' ' D' ' 341' ' ' PHE . 64.4 t-20 -58.56 -59.05 5.99 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.354 -0.841 . . . . 1.0900000000000001 109.735 179.978 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 346' ' ' GLU . . . . . 0.44 ' OE1' ' NZ ' ' A' ' 351' ' ' LYS . 1.1 tm-20 -61.64 -26.38 67.96 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.237 -0.914 . . . . 1.6599999999999999 109.943 -179.642 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 347' ' ' ALA . . . . . 0.478 ' HB1' ' HB1' ' A' ' 347' ' ' ALA . . . -60.67 -57.7 11.6 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.187 -0.946 . . . . 0.17000000000000001 110.116 -179.817 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 348' ' ' LEU . . . . . 0.695 HD12 ' CZ ' ' D' ' 337' ' ' ARG . 4.1 mm? -62.06 -44.7 96.12 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.188 -0.945 . . . . 0.28999999999999998 110.192 -179.448 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 349' ' ' GLU . . . . . . . . . . . . . 11.3 mm-40 -58.35 -33.09 69.16 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.222 -0.924 . . . . 1.95 109.979 -179.422 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 350' ' ' LEU . . . . . 0.766 HD23 ' O ' ' B' ' 350' ' ' LEU . 5.2 tt -64.59 -43.34 94.12 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.258 -0.901 . . . . 0.45000000000000001 109.858 -179.797 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 351' ' ' LYS . . . . . 0.465 ' NZ ' ' OE1' ' A' ' 346' ' ' GLU . 19.1 tttp -59.5 -44.57 93.07 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.365 -0.834 . . . . 1.3799999999999999 109.917 -179.588 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 352' ' ' ASP . . . . . . . . . . . . . 37.2 m-20 -58.68 -49.24 78.27 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.242 -0.911 . . . . 1.1599999999999999 110.178 -179.676 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 353' ' ' ALA . . . . . . . . . . . . . . . -65.8 -11.22 44.37 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.044 -1.035 . . . . 0.60999999999999999 109.839 -179.438 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 354' ' ' GLN . . . . . 0.722 ' OE1' HD11 ' A' ' 350' ' ' LEU . 5.5 mt-30 . . . . . 0 N--CA 1.49 1.54 0 O-C-N 121.189 -0.945 . . . . 1.45 109.464 179.962 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' C' C ' 326' ' ' GLU . . . . . . . . . . . . . 1.8 mm-40 . . . . . 0 N--CA 1.491 1.592 0 N-CA-C 109.527 -0.545 . . . . 2.1699999999999999 109.527 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' C' C ' 327' ' ' TYR . . . . . 0.542 ' CE1' ' HG2' ' A' ' 333' ' ' ARG . 41.2 m-85 -149.94 105.79 3.44 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.245 -0.909 . . . . 0.47999999999999998 109.76 179.847 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' C' C ' 328' ' ' PHE . . . . . 0.437 ' O ' HG23 ' C' ' 329' ' ' THR . 91.6 m-85 -111.7 -164.21 0.9 Allowed 'General case' 0 C--N 1.303 -1.436 0 O-C-N 121.42 -0.8 . . . . 0.33000000000000002 109.185 179.757 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' C' C ' 329' ' ' THR . . . . . 0.437 HG23 ' O ' ' C' ' 328' ' ' PHE . 11.3 p -153.94 160.46 42.11 Favored 'General case' 0 C--N 1.302 -1.478 0 O-C-N 121.397 -0.815 . . . . 0.23000000000000001 109.064 179.776 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' C' C ' 330' ' ' LEU . . . . . . . . . . . . . 16.7 tp -148.96 125.64 11.09 Favored 'General case' 0 N--CA 1.488 1.471 0 O-C-N 121.252 -0.905 . . . . 0.28000000000000003 109.644 -179.788 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' C' C ' 331' ' ' GLN . . . . . . . . . . . . . 1.5 tp60 -86.93 116.65 25.14 Favored 'General case' 0 N--CA 1.489 1.5 0 O-C-N 121.282 -0.887 . . . . 1.48 109.021 179.61 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' C' C ' 332' ' ' ILE . . . . . 0.407 HD13 ' CD2' ' C' ' 341' ' ' PHE . 59.6 mt -103.3 110.02 28.62 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.452 0 O-C-N 121.128 -0.983 . . . . 0.23999999999999999 109.654 -179.796 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' C' C ' 333' ' ' ARG . . . . . 0.605 ' CG ' ' CE1' ' A' ' 327' ' ' TYR . 2.1 mpt_? -71.61 149.75 45.32 Favored 'General case' 0 C--N 1.304 -1.381 0 O-C-N 121.334 -0.854 . . . . 2.7400000000000002 109.07 179.634 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' C' C ' 334' ' ' GLY . . . . . . . . . . . . . . . 80.98 130.09 0.99 Allowed Glycine 0 N--CA 1.489 2.189 0 N-CA-C 109.567 -1.413 . . . . 0.34999999999999998 109.567 -179.942 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' C' C ' 335' ' ' ARG . . . . . . . . . . . . . 57.1 ttt180 -77.92 -36.88 48.91 Favored 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.401 -1.058 . . . . 2.5299999999999998 109.52 -179.89 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' C' C ' 336' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -57.5 -58.28 8.98 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.371 -0.831 . . . . 2.6200000000000001 110.169 -179.471 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' C' C ' 337' ' ' ARG . . . . . 0.555 ' NH1' ' HG3' ' C' ' 337' ' ' ARG . 0.1 OUTLIER -59.87 -31.92 70.23 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.173 -0.954 . . . . 2.8100000000000001 109.797 -179.638 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' C' C ' 338' ' ' PHE . . . . . . . . . . . . . 79.7 t80 -54.07 -55.21 29.69 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.294 -0.879 . . . . 0.40000000000000002 109.745 -179.72 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' C' C ' 339' ' ' GLU . . . . . . . . . . . . . 34.0 mt-10 -52.01 -35.71 47.66 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.299 -0.876 . . . . 2.0499999999999998 109.977 -179.795 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' C' C ' 340' ' ' MET . . . . . . . . . . . . . 31.5 ttp -64.38 -51.2 64.47 Favored 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.307 -0.87 . . . . 0.32000000000000001 110.304 -179.454 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' C' C ' 341' ' ' PHE . . . . . 0.407 ' CD2' HD13 ' C' ' 332' ' ' ILE . 33.1 m-85 -62.06 -40.06 94.5 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.056 -1.028 . . . . 0.17999999999999999 110.365 -179.338 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' C' C ' 342' ' ' ARG . . . . . 0.522 ' NH1' ' HG3' ' C' ' 342' ' ' ARG . 0.0 OUTLIER -51.7 -48.61 63.46 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.022 -1.049 . . . . 2.9100000000000001 110.091 -179.516 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' C' C ' 343' ' ' GLU . . . . . . . . . . . . . 1.6 tp10 -59.74 -43.81 94.06 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.274 -0.891 . . . . 2.1400000000000001 110.247 -179.419 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' C' C ' 344' ' ' LEU . . . . . . . . . . . . . 53.6 mt -61.5 -34.53 75.66 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.157 -0.964 . . . . 0.22 109.839 -179.529 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' C' C ' 345' ' ' ASN . . . . . 0.406 ' O ' ' HG2' ' C' ' 349' ' ' GLU . 39.0 t-20 -58.82 -57.77 11.57 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.242 -0.911 . . . . 1.0800000000000001 109.71 -179.997 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' C' C ' 346' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -60.61 -24.87 65.84 Favored 'General case' 0 N--CA 1.489 1.486 0 O-C-N 121.205 -0.934 . . . . 2.21 109.926 -179.603 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' C' C ' 347' ' ' ALA . . . . . 0.562 ' HB1' ' HB1' ' D' ' 347' ' ' ALA . . . -62.07 -59.62 4.81 Favored 'General case' 0 N--CA 1.489 1.501 0 O-C-N 121.095 -1.003 . . . . 0.17999999999999999 109.65 -179.979 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' C' C ' 348' ' ' LEU . . . . . 0.654 HD12 ' NH2' ' A' ' 337' ' ' ARG . 3.8 mm? -64.43 -48.35 75.66 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.271 -0.893 . . . . 0.32000000000000001 110.328 -179.583 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' C' C ' 349' ' ' GLU . . . . . 0.406 ' HG2' ' O ' ' C' ' 345' ' ' ASN . 3.8 mm-40 -55.33 -34.11 63.92 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.119 -0.988 . . . . 2.1899999999999999 109.482 -179.393 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' C' C ' 350' ' ' LEU . . . . . 0.811 ' CD2' HD13 ' D' ' 350' ' ' LEU . 5.0 tt -64.87 -36.98 86.11 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.301 -0.874 . . . . 0.46000000000000002 109.073 179.695 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' C' C ' 351' ' ' LYS . . . . . . . . . . . . . 19.4 tttt -60.33 -47.57 85.47 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.494 -0.754 . . . . 1.3500000000000001 109.306 179.913 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' C' C ' 352' ' ' ASP . . . . . . . . . . . . . 15.0 m-20 -55.88 -52.96 62.26 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.385 -0.822 . . . . 1.1899999999999999 109.514 -179.988 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' C' C ' 353' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 1.624 0 O-C-N 121.188 -0.945 . . . . 0.56999999999999995 109.59 -179.818 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' D' D ' 326' ' ' GLU . . . . . . . . . . . . . 66.1 mm-40 . . . . . 0 N--CA 1.488 1.436 0 N-CA-C 109.222 -0.659 . . . . 2.1299999999999999 109.222 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' D' D ' 327' ' ' TYR . . . . . 0.541 ' CE1' ' HG2' ' B' ' 333' ' ' ARG . 43.8 m-85 -148.44 94.81 2.35 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.21 -0.931 . . . . 0.46999999999999997 109.453 -179.875 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' D' D ' 328' ' ' PHE . . . . . 0.453 ' O ' ' OE1' ' B' ' 331' ' ' GLN . 85.6 m-85 -103.03 -162.54 0.92 Allowed 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.191 -0.943 . . . . 0.29999999999999999 109.574 179.93 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' D' D ' 329' ' ' THR . . . . . 0.42 ' HA ' ' O ' ' B' ' 330' ' ' LEU . 40.3 p -154.24 166.79 32.05 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.316 -0.865 . . . . 0.22 108.951 179.895 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' D' D ' 330' ' ' LEU . . . . . . . . . . . . . 18.7 tp -149.78 125.96 10.69 Favored 'General case' 0 N--CA 1.488 1.443 0 O-C-N 121.029 -1.044 . . . . 0.28000000000000003 109.824 -179.502 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' D' D ' 331' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -87.48 112.48 22.24 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.203 -0.936 . . . . 0.93000000000000005 108.876 179.491 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' D' D ' 332' ' ' ILE . . . . . 0.542 HG21 ' HA ' ' D' ' 338' ' ' PHE . 47.2 mt -103.34 109.64 27.54 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.543 0 O-C-N 121.257 -0.902 . . . . 0.25 109.858 -179.68 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' D' D ' 333' ' ' ARG . . . . . 0.579 ' HG2' ' CE1' ' B' ' 327' ' ' TYR . 82.0 mtt180 -72.84 150.74 42.44 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.445 -0.784 . . . . 2.9300000000000002 109.358 179.838 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' D' D ' 334' ' ' GLY . . . . . . . . . . . . . . . 80.75 125.18 0.63 Allowed Glycine 0 N--CA 1.491 2.308 0 N-CA-C 109.373 -1.491 . . . . 0.40999999999999998 109.373 -179.833 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' D' D ' 335' ' ' ARG . . . . . . . . . . . . . 57.0 ttt180 -75.7 -33.65 60.35 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.366 -1.079 . . . . 3.0299999999999998 109.535 -179.978 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' D' D ' 336' ' ' GLU . . . . . . . . . . . . . 60.8 tt0 -58.29 -62.2 2.01 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.255 -0.903 . . . . 2.2599999999999998 109.77 -179.854 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' D' D ' 337' ' ' ARG . . . . . 0.695 ' CZ ' HD12 ' B' ' 348' ' ' LEU . 7.4 mmt180 -61.23 -32.85 72.64 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.247 -0.908 . . . . 2.9199999999999999 109.74 -179.771 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' D' D ' 338' ' ' PHE . . . . . 0.542 ' HA ' HG21 ' D' ' 332' ' ' ILE . 46.5 t80 -54.44 -57.64 10.54 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.289 -0.882 . . . . 0.37 109.72 -179.732 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' D' D ' 339' ' ' GLU . . . . . . . . . . . . . 41.2 mt-10 -50.99 -34.88 30.97 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.166 -0.959 . . . . 1.99 109.978 -179.666 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' D' D ' 340' ' ' MET . . . . . . . . . . . . . 46.7 ttp -63.84 -49.74 71.61 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.086 -1.009 . . . . 0.31 110.019 -179.496 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' D' D ' 341' ' ' PHE . . . . . 0.428 ' CZ ' ' HA ' ' B' ' 345' ' ' ASN . 44.7 m-85 -61.31 -46.6 89.61 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.126 -0.984 . . . . 0.17999999999999999 110.007 -179.674 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' D' D ' 342' ' ' ARG . . . . . . . . . . . . . 6.0 ttt180 -49.39 -42.58 42.76 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.168 -0.958 . . . . 2.4100000000000001 110.02 -179.625 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' D' D ' 343' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -58.65 -49.93 75.72 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.133 -0.979 . . . . 2.3500000000000001 109.844 -179.518 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' D' D ' 344' ' ' LEU . . . . . . . . . . . . . 60.2 mt -59.93 -30.89 69.36 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.175 -0.953 . . . . 0.19 109.504 -179.786 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' D' D ' 345' ' ' ASN . . . . . 0.512 HD22 HD11 ' B' ' 330' ' ' LEU . 64.3 t-20 -58.61 -59.29 5.63 Favored 'General case' 0 N--CA 1.488 1.455 0 O-C-N 121.204 -0.935 . . . . 1.0900000000000001 109.82 179.955 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' D' D ' 346' ' ' GLU . . . . . . . . . . . . . 1.2 tm-20 -61.31 -26.71 67.98 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.29 -0.881 . . . . 1.6899999999999999 109.981 -179.687 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' D' D ' 347' ' ' ALA . . . . . 0.562 ' HB1' ' HB1' ' C' ' 347' ' ' ALA . . . -60.29 -57.72 11.6 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.1 -1.0 . . . . 0.17999999999999999 110.111 -179.723 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' D' D ' 348' ' ' LEU . . . . . 0.599 HD22 ' N ' ' D' ' 348' ' ' LEU . 4.1 mm? -62.12 -44.68 96.1 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.152 -0.968 . . . . 0.31 110.092 -179.348 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' D' D ' 349' ' ' GLU . . . . . . . . . . . . . 10.2 mm-40 -58.22 -33.31 69.17 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.209 -0.932 . . . . 1.95 110.018 -179.436 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' D' D ' 350' ' ' LEU . . . . . 0.811 HD13 ' CD2' ' C' ' 350' ' ' LEU . 5.3 tt -64.44 -43.89 92.86 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.147 -0.971 . . . . 0.42999999999999999 109.716 -179.819 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' D' D ' 351' ' ' LYS . . . . . 0.433 ' O ' ' HB2' ' D' ' 354' ' ' GLN . 18.7 tttp -58.96 -44.72 91.54 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.371 -0.831 . . . . 1.3999999999999999 110.015 -179.601 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' D' D ' 352' ' ' ASP . . . . . . . . . . . . . 35.2 m-20 -58.46 -48.9 79.24 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.297 -0.877 . . . . 1.1699999999999999 110.307 -179.576 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' D' D ' 353' ' ' ALA . . . . . . . . . . . . . . . -66.43 -11.15 50.3 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.259 -0.901 . . . . 0.58999999999999997 109.784 -179.351 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' D' D ' 354' ' ' GLN . . . . . 0.546 ' HG3' HD23 ' D' ' 350' ' ' LEU . 5.1 mt-30 . . . . . 0 N--CA 1.491 1.592 0 O-C-N 121.211 -0.93 . . . . 1.4399999999999999 109.484 179.829 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 326' ' ' GLU . . . . . . . . . . . . . 2.9 mm-40 . . . . . 0 N--CA 1.489 1.489 0 N-CA-C 109.016 -0.735 . . . . 2.1299999999999999 109.016 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 327' ' ' TYR . . . . . 0.577 ' CE1' ' HG2' ' C' ' 333' ' ' ARG . 48.1 m-85 -148.98 102.42 3.26 Favored 'General case' 0 N--CA 1.488 1.444 0 O-C-N 121.168 -0.958 . . . . 0.47999999999999998 109.395 179.985 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 328' ' ' PHE . . . . . . . . . . . . . 37.8 m-85 -106.87 -168.24 1.38 Allowed 'General case' 0 N--CA 1.489 1.479 0 O-C-N 121.406 -0.809 . . . . 0.31 109.282 -179.962 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 329' ' ' THR . . . . . . . . . . . . . 6.3 p -152.41 166.92 30.4 Favored 'General case' 0 N--CA 1.488 1.428 0 O-C-N 121.284 -0.885 . . . . 0.22 109.007 179.96 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 330' ' ' LEU . . . . . 0.497 HD11 HD22 ' C' ' 345' ' ' ASN . 16.9 tp -148.97 130.37 14.74 Favored 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.173 -0.954 . . . . 0.28000000000000003 109.767 -179.605 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 331' ' ' GLN . . . . . . . . . . . . . 19.1 tp60 -88.42 111.78 22.17 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.326 -0.859 . . . . 0.91000000000000003 109.53 179.785 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 332' ' ' ILE . . . . . 0.505 HG21 ' HA ' ' A' ' 338' ' ' PHE . 75.7 mt -103.96 111.41 33.51 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.702 0 O-C-N 121.121 -0.987 . . . . 0.26000000000000001 109.603 179.836 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 333' ' ' ARG . . . . . 0.534 ' HG2' ' CE1' ' C' ' 327' ' ' TYR . 67.5 mtt180 -73.94 151.27 40.41 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.289 -0.882 . . . . 2.9199999999999999 109.714 -179.983 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 334' ' ' GLY . . . . . . . . . . . . . . . 75.79 130.36 0.31 Allowed Glycine 0 N--CA 1.49 2.299 0 N-CA-C 109.545 -1.422 . . . . 0.40000000000000002 109.545 179.914 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 335' ' ' ARG . . . . . 0.446 ' HB2' ' CZ ' ' C' ' 328' ' ' PHE . 33.1 ttt180 -78.21 -31.65 49.51 Favored 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.216 -1.167 . . . . 3.0099999999999998 109.675 -179.819 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 336' ' ' GLU . . . . . . . . . . . . . 2.2 mt-10 -57.78 -62.01 2.11 Favored 'General case' 0 N--CA 1.493 1.675 0 O-C-N 121.19 -0.944 . . . . 2.29 109.776 -179.816 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 337' ' ' ARG . . . . . 0.421 ' HG2' HH11 ' A' ' 337' ' ' ARG . 1.9 mmt-85 -59.92 -32.05 70.42 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.238 -0.914 . . . . 2.9300000000000002 109.529 -179.922 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 338' ' ' PHE . . . . . 0.505 ' HA ' HG21 ' A' ' 332' ' ' ILE . 64.5 t80 -56.44 -57.65 11.4 Favored 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.262 -0.899 . . . . 0.38 109.818 -179.991 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 339' ' ' GLU . . . . . . . . . . . . . 48.2 mt-10 -51.77 -31.92 28.86 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.231 -0.918 . . . . 1.97 109.947 -179.841 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 340' ' ' MET . . . . . . . . . . . . . 37.9 ttp -63.9 -50.66 67.88 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.239 -0.913 . . . . 0.31 109.729 -179.601 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 341' ' ' PHE . . . . . . . . . . . . . 39.2 m-85 -62.66 -41.86 99.3 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.297 -0.877 . . . . 0.17999999999999999 109.949 -179.62 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 342' ' ' ARG . . . . . 0.538 ' HG2' ' NH1' ' A' ' 342' ' ' ARG . 0.1 OUTLIER -50.4 -42.43 53.63 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.093 -1.004 . . . . 2.4199999999999999 109.771 -179.818 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 343' ' ' GLU . . . . . . . . . . . . . 2.3 tp10 -57.65 -45.72 85.11 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.211 -0.931 . . . . 2.3500000000000001 109.705 -179.708 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 344' ' ' LEU . . . . . . . . . . . . . 32.3 mt -62.36 -33.4 74.66 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.108 -0.995 . . . . 0.17999999999999999 109.452 -179.973 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 345' ' ' ASN . . . . . . . . . . . . . 8.8 t-20 -56.72 -58.35 8.45 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.249 -0.907 . . . . 1.0900000000000001 109.848 -179.797 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 346' ' ' GLU . . . . . . . . . . . . . 3.2 tt0 -60.42 -28.75 68.51 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.212 -0.93 . . . . 1.6499999999999999 109.88 -179.539 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 347' ' ' ALA . . . . . 0.835 ' HB1' ' HB1' ' B' ' 347' ' ' ALA . . . -61.07 -59.84 4.72 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.122 -0.986 . . . . 0.17999999999999999 110.132 -179.996 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 348' ' ' LEU . . . . . 0.591 HD22 ' N ' ' A' ' 348' ' ' LEU . 4.0 mm? -61.8 -43.74 98.26 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.27 -0.894 . . . . 0.29999999999999999 110.058 -179.48 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 349' ' ' GLU . . . . . 0.42 ' OE2' ' NH1' ' C' ' 333' ' ' ARG . 1.8 mm-40 -56.7 -36.74 70.01 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.214 -0.929 . . . . 1.9399999999999999 109.753 -179.393 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 350' ' ' LEU . . . . . 0.915 HD22 HD13 ' B' ' 350' ' ' LEU . 5.0 tt -63.2 -42.96 99.39 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.17 -0.956 . . . . 0.46000000000000002 109.504 -179.738 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 351' ' ' LYS . . . . . . . . . . . . . 29.9 tttp -58.2 -35.55 71.8 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.142 -0.974 . . . . 1.3999999999999999 109.132 179.89 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 352' ' ' ASP . . . . . . . . . . . . . 98.4 m-20 -57.07 -40.62 77.24 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.35 -0.844 . . . . 1.1599999999999999 109.367 179.764 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 353' ' ' ALA . . . . . . . . . . . . . . . -67.74 -24.45 65.36 Favored 'General case' 0 N--CA 1.489 1.491 0 O-C-N 121.317 -0.865 . . . . 0.63 109.865 -179.838 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 354' ' ' GLN . . . . . . . . . . . . . 4.0 tt0 . . . . . 0 N--CA 1.493 1.685 0 O-C-N 121.085 -1.009 . . . . 1.47 109.671 179.945 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' B' B ' 326' ' ' GLU . . . . . . . . . . . . . 3.1 mm-40 . . . . . 0 N--CA 1.488 1.452 0 N-CA-C 109.125 -0.694 . . . . 2.1299999999999999 109.125 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' B' B ' 327' ' ' TYR . . . . . 0.556 ' CE1' ' HG2' ' D' ' 333' ' ' ARG . 48.8 m-85 -148.84 103.51 3.37 Favored 'General case' 0 N--CA 1.488 1.463 0 O-C-N 121.28 -0.887 . . . . 0.47999999999999998 109.247 179.782 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 328' ' ' PHE . . . . . . . . . . . . . 38.4 m-85 -108.27 -168.79 1.41 Allowed 'General case' 0 N--CA 1.488 1.473 0 O-C-N 121.249 -0.907 . . . . 0.32000000000000001 109.149 -179.998 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 329' ' ' THR . . . . . . . . . . . . . 6.7 p -151.8 167.13 29.24 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.213 -0.929 . . . . 0.23000000000000001 109.27 179.985 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 330' ' ' LEU . . . . . . . . . . . . . 16.9 tp -149.08 130.65 14.89 Favored 'General case' 0 N--CA 1.488 1.437 0 O-C-N 121.15 -0.969 . . . . 0.28000000000000003 109.74 -179.648 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 331' ' ' GLN . . . . . . . . . . . . . 19.6 tp60 -88.88 111.71 22.39 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.45 -0.781 . . . . 0.91000000000000003 109.409 179.951 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 332' ' ' ILE . . . . . 0.503 HG21 ' HA ' ' B' ' 338' ' ' PHE . 75.5 mt -103.93 111.19 32.61 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.603 0 O-C-N 121.151 -0.968 . . . . 0.23999999999999999 109.637 179.91 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 333' ' ' ARG . . . . . 0.55 ' HG2' ' CE1' ' D' ' 327' ' ' TYR . 67.5 mtt180 -73.71 151.47 40.7 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.187 -0.946 . . . . 2.9300000000000002 109.648 -179.984 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 334' ' ' GLY . . . . . . . . . . . . . . . 75.79 130.17 0.3 Allowed Glycine 0 N--CA 1.491 2.316 0 N-CA-C 109.772 -1.331 . . . . 0.40000000000000002 109.772 179.827 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 335' ' ' ARG . . . . . . . . . . . . . 34.8 ttt180 -78.12 -31.32 49.85 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.291 -1.123 . . . . 3.0099999999999998 109.808 -179.924 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 336' ' ' GLU . . . . . . . . . . . . . 2.1 mt-10 -58.28 -61.71 2.37 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.058 -1.026 . . . . 2.2799999999999998 109.789 -179.736 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 337' ' ' ARG . . . . . 0.427 ' HG2' HH11 ' B' ' 337' ' ' ARG . 1.6 mmt-85 -60.2 -31.69 70.39 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.174 -0.953 . . . . 2.9300000000000002 109.601 -179.864 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 338' ' ' PHE . . . . . 0.503 ' HA ' HG21 ' B' ' 332' ' ' ILE . 64.9 t80 -56.32 -58.5 7.74 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.147 -0.97 . . . . 0.37 109.712 179.837 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 339' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -51.04 -32.07 20.55 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.172 -0.955 . . . . 1.98 109.893 -179.867 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 340' ' ' MET . . . . . . . . . . . . . 39.4 ttp -63.41 -50.95 67.83 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.095 -1.003 . . . . 0.32000000000000001 109.795 -179.743 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 341' ' ' PHE . . . . . . . . . . . . . 40.1 m-85 -62.5 -41.84 99.09 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.253 -0.904 . . . . 0.17999999999999999 109.99 -179.589 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 342' ' ' ARG . . . . . 0.547 ' NH1' ' HG2' ' B' ' 342' ' ' ARG . 0.1 OUTLIER -50.63 -41.86 55.56 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.153 -0.967 . . . . 2.4199999999999999 109.902 -179.662 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' B' B ' 343' ' ' GLU . . . . . . . . . . . . . 2.3 tp10 -58.38 -46.22 86.79 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.162 -0.961 . . . . 2.3500000000000001 109.565 -179.707 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 344' ' ' LEU . . . . . . . . . . . . . 34.5 mt -61.51 -33.79 74.4 Favored 'General case' 0 N--CA 1.489 1.477 0 O-C-N 121.277 -0.889 . . . . 0.17999999999999999 109.421 179.937 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 345' ' ' ASN . . . . . . . . . . . . . 9.0 t-20 -56.86 -57.5 12.23 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.235 -0.915 . . . . 1.0900000000000001 110.066 -179.669 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 346' ' ' GLU . . . . . . . . . . . . . 3.2 tt0 -61.12 -28.41 69.08 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.263 -0.898 . . . . 1.6599999999999999 109.697 -179.569 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 347' ' ' ALA . . . . . 0.835 ' HB1' ' HB1' ' A' ' 347' ' ' ALA . . . -61.28 -59.94 4.52 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.189 -0.945 . . . . 0.17000000000000001 110.047 -179.785 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 348' ' ' LEU . . . . . 0.593 HD22 ' N ' ' B' ' 348' ' ' LEU . 4.0 mm? -61.71 -43.74 98.28 Favored 'General case' 0 N--CA 1.494 1.743 0 O-C-N 121.356 -0.84 . . . . 0.28999999999999998 109.994 -179.49 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 349' ' ' GLU . . . . . . . . . . . . . 1.8 mm-40 -56.75 -36.61 69.96 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.24 -0.912 . . . . 1.95 109.958 -179.419 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 350' ' ' LEU . . . . . 0.915 HD13 HD22 ' A' ' 350' ' ' LEU . 5.0 tt -63.42 -42.88 98.72 Favored 'General case' 0 N--CA 1.489 1.484 0 O-C-N 121.108 -0.995 . . . . 0.45000000000000001 109.428 -179.777 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 351' ' ' LYS . . . . . . . . . . . . . 30.4 tttp -57.96 -35.92 71.83 Favored 'General case' 0 N--CA 1.489 1.481 0 O-C-N 121.07 -1.019 . . . . 1.3799999999999999 109.135 179.832 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 352' ' ' ASP . . . . . . . . . . . . . 98.4 m-20 -57.05 -40.49 76.89 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.351 -0.843 . . . . 1.1599999999999999 109.403 179.8 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 353' ' ' ALA . . . . . . . . . . . . . . . -67.71 -24.54 65.4 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.308 -0.87 . . . . 0.60999999999999999 109.71 -179.763 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 354' ' ' GLN . . . . . . . . . . . . . 10.6 tt0 . . . . . 0 N--CA 1.492 1.663 0 O-C-N 121.222 -0.924 . . . . 1.45 109.704 -179.875 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' C' C ' 326' ' ' GLU . . . . . 0.42 ' HB3' ' CE1' ' C' ' 328' ' ' PHE . 6.8 mm-40 . . . . . 0 N--CA 1.491 1.577 0 CA-C-O 121.347 0.594 . . . . 2.1699999999999999 109.561 . . . . . . . . . 1 1 . 1 . 017 nuclear build core ' C' C ' 327' ' ' TYR . . . . . 0.534 ' CE1' ' HG2' ' A' ' 333' ' ' ARG . 46.1 m-85 -148.61 107.79 3.91 Favored 'General case' 0 N--CA 1.488 1.443 0 O-C-N 121.327 -0.858 . . . . 0.47999999999999998 109.267 -179.982 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' C' C ' 328' ' ' PHE . . . . . 0.446 ' CZ ' ' HB2' ' A' ' 335' ' ' ARG . 14.4 m-85 -113.66 -167.84 1.26 Allowed 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.345 -0.847 . . . . 0.33000000000000002 109.433 179.914 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' C' C ' 329' ' ' THR . . . . . . . . . . . . . 29.5 p -151.46 169.54 21.78 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.341 -0.849 . . . . 0.23000000000000001 109.282 -180.0 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' C' C ' 330' ' ' LEU . . . . . . . . . . . . . 28.3 tp -150.62 123.32 8.59 Favored 'General case' 0 C--N 1.304 -1.398 0 O-C-N 121.264 -0.898 . . . . 0.28000000000000003 109.509 -179.787 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' C' C ' 331' ' ' GLN . . . . . . . . . . . . . 1.2 tt0 -86.71 115.56 24.23 Favored 'General case' 0 N--CA 1.489 1.48 0 O-C-N 121.317 -0.865 . . . . 1.48 108.974 179.599 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' C' C ' 332' ' ' ILE . . . . . 0.709 HG21 ' HA ' ' C' ' 338' ' ' PHE . 84.2 mt -103.2 111.78 34.24 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.511 0 O-C-N 121.178 -0.951 . . . . 0.23999999999999999 109.62 -179.552 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' C' C ' 333' ' ' ARG . . . . . 0.577 ' HG2' ' CE1' ' A' ' 327' ' ' TYR . 5.6 mtp180 -73.35 144.38 46.51 Favored 'General case' 0 N--CA 1.487 1.422 0 O-C-N 121.274 -0.891 . . . . 2.7400000000000002 109.443 179.8 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' C' C ' 334' ' ' GLY . . . . . . . . . . . . . . . 75.99 123.76 0.17 Allowed Glycine 0 N--CA 1.49 2.293 0 N-CA-C 109.572 -1.411 . . . . 0.34999999999999998 109.572 179.864 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' C' C ' 335' ' ' ARG . . . . . 0.511 ' NH1' ' HG2' ' C' ' 335' ' ' ARG . 0.7 OUTLIER -70.59 -24.89 62.84 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.296 -1.12 . . . . 2.5299999999999998 109.858 -179.728 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' C' C ' 336' ' ' GLU . . . . . . . . . . . . . 18.4 mt-10 -56.25 -67.8 0.27 Allowed 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.169 -0.957 . . . . 2.6200000000000001 109.737 -179.553 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' C' C ' 337' ' ' ARG . . . . . 0.479 ' HD2' ' N ' ' C' ' 337' ' ' ARG . 11.4 mpt_? -60.11 -30.22 69.12 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.245 -0.91 . . . . 2.8100000000000001 109.774 -179.823 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' C' C ' 338' ' ' PHE . . . . . 0.709 ' HA ' HG21 ' C' ' 332' ' ' ILE . 57.8 t80 -54.67 -59.75 4.29 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.325 -0.859 . . . . 0.40000000000000002 109.984 -179.634 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' C' C ' 339' ' ' GLU . . . . . . . . . . . . . 14.8 mt-10 -51.14 -34.47 31.24 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.256 -0.903 . . . . 2.0499999999999998 110.306 -179.567 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' C' C ' 340' ' ' MET . . . . . . . . . . . . . 53.8 ttp -63.62 -50.45 69.32 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.089 -1.007 . . . . 0.32000000000000001 109.956 -179.611 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' C' C ' 341' ' ' PHE . . . . . . . . . . . . . 65.2 m-85 -61.56 -45.41 94.26 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.243 -0.911 . . . . 0.17999999999999999 109.948 -179.593 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' C' C ' 342' ' ' ARG . . . . . . . . . . . . . 1.9 tmt_? -48.98 -42.69 38.61 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.282 -0.886 . . . . 2.9100000000000001 110.025 -179.59 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' C' C ' 343' ' ' GLU . . . . . . . . . . . . . 28.8 tt0 -59.61 -47.04 87.13 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.153 -0.967 . . . . 2.1400000000000001 110.24 -179.373 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' C' C ' 344' ' ' LEU . . . . . 0.401 HD22 HD22 ' D' ' 344' ' ' LEU . 73.4 mt -61.78 -34.58 76.14 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.142 -0.974 . . . . 0.22 110.218 -179.44 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' C' C ' 345' ' ' ASN . . . . . 0.497 HD22 HD11 ' A' ' 330' ' ' LEU . 39.1 t30 -57.64 -55.66 31.91 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.094 -1.004 . . . . 1.0800000000000001 109.944 -179.526 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' C' C ' 346' ' ' GLU . . . . . 0.486 ' O ' ' HB2' ' C' ' 350' ' ' LEU . 3.5 tt0 -59.94 -27.34 66.69 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.164 -0.96 . . . . 2.21 109.638 -179.635 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' C' C ' 347' ' ' ALA . . . . . 0.979 ' HB1' ' HB1' ' D' ' 347' ' ' ALA . . . -62.76 -58.06 8.77 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.169 -0.957 . . . . 0.17999999999999999 110.076 -179.917 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' C' C ' 348' ' ' LEU . . . . . 0.582 ' N ' HD22 ' C' ' 348' ' ' LEU . 4.2 mm? -62.52 -50.25 72.13 Favored 'General case' 0 N--CA 1.494 1.739 0 O-C-N 121.276 -0.89 . . . . 0.32000000000000001 110.42 -179.289 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' C' C ' 349' ' ' GLU . . . . . . . . . . . . . 67.5 mm-40 -57.18 -33.42 67.44 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.124 -0.985 . . . . 2.1899999999999999 109.831 -179.242 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' C' C ' 350' ' ' LEU . . . . . 0.795 HD22 HD13 ' D' ' 350' ' ' LEU . 5.4 tt -62.81 -40.22 96.71 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.236 -0.915 . . . . 0.46000000000000002 109.383 -179.902 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' C' C ' 351' ' ' LYS . . . . . 0.4 ' HE3' ' OE1' ' D' ' 346' ' ' GLU . 1.5 tttm -62.13 -47.77 83.08 Favored 'General case' 0 N--CA 1.488 1.455 0 O-C-N 121.207 -0.933 . . . . 1.3500000000000001 110.169 -179.801 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' C' C ' 352' ' ' ASP . . . . . . . . . . . . . 77.5 m-20 -51.35 -27.18 9.06 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.199 -0.938 . . . . 1.1899999999999999 109.247 -179.6 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' C' C ' 353' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.488 1.469 0 O-C-N 121.323 -0.861 . . . . 0.56999999999999995 109.312 179.742 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' D' D ' 326' ' ' GLU . . . . . . . . . . . . . 3.2 mm-40 . . . . . 0 N--CA 1.488 1.473 0 N-CA-C 109.028 -0.731 . . . . 2.1299999999999999 109.028 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' D' D ' 327' ' ' TYR . . . . . 0.55 ' CE1' ' HG2' ' B' ' 333' ' ' ARG . 47.2 m-85 -149.03 103.05 3.31 Favored 'General case' 0 N--CA 1.488 1.442 0 O-C-N 121.219 -0.926 . . . . 0.46999999999999997 109.357 179.815 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' D' D ' 328' ' ' PHE . . . . . . . . . . . . . 39.5 m-85 -107.61 -168.5 1.39 Allowed 'General case' 0 N--CA 1.489 1.477 0 O-C-N 121.286 -0.884 . . . . 0.29999999999999999 109.248 -179.953 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' D' D ' 329' ' ' THR . . . . . . . . . . . . . 7.1 p -152.04 166.97 29.95 Favored 'General case' 0 N--CA 1.488 1.457 0 O-C-N 121.259 -0.9 . . . . 0.22 109.144 179.942 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' D' D ' 330' ' ' LEU . . . . . . . . . . . . . 18.0 tp -148.9 130.75 15.16 Favored 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.184 -0.948 . . . . 0.28000000000000003 109.778 -179.605 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' D' D ' 331' ' ' GLN . . . . . . . . . . . . . 19.3 tp60 -89.06 111.18 21.86 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.509 -0.744 . . . . 0.93000000000000005 109.545 179.814 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' D' D ' 332' ' ' ILE . . . . . 0.51 HG21 ' HA ' ' D' ' 338' ' ' PHE . 74.0 mt -103.49 111.77 34.45 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.568 0 O-C-N 121.073 -1.017 . . . . 0.25 109.579 179.921 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' D' D ' 333' ' ' ARG . . . . . 0.556 ' HG2' ' CE1' ' B' ' 327' ' ' TYR . 68.2 mtt180 -74.07 151.56 40.14 Favored 'General case' 0 N--CA 1.488 1.451 0 O-C-N 121.221 -0.924 . . . . 2.9300000000000002 109.7 179.901 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' D' D ' 334' ' ' GLY . . . . . . . . . . . . . . . 76.03 130.8 0.35 Allowed Glycine 0 N--CA 1.491 2.338 0 N-CA-C 109.663 -1.375 . . . . 0.40999999999999998 109.663 179.798 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' D' D ' 335' ' ' ARG . . . . . . . . . . . . . 35.9 ttt180 -78.61 -31.99 47.31 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.309 -1.113 . . . . 3.0299999999999998 109.715 -179.934 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' D' D ' 336' ' ' GLU . . . . . . . . . . . . . 2.1 mt-10 -57.44 -61.86 2.19 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.173 -0.954 . . . . 2.2599999999999998 109.832 -179.732 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' D' D ' 337' ' ' ARG . . . . . 0.408 HH11 ' HG2' ' D' ' 337' ' ' ARG . 1.5 mmt-85 -60.3 -31.74 70.55 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.172 -0.955 . . . . 2.9199999999999999 109.593 -179.831 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' D' D ' 338' ' ' PHE . . . . . 0.51 ' HA ' HG21 ' D' ' 332' ' ' ILE . 63.6 t80 -56.24 -58.19 9.01 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.347 -0.845 . . . . 0.37 109.739 179.898 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' D' D ' 339' ' ' GLU . . . . . . . . . . . . . 43.1 mt-10 -51.59 -31.67 25.72 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.257 -0.902 . . . . 1.99 109.901 -179.767 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' D' D ' 340' ' ' MET . . . . . . . . . . . . . 39.8 ttp -63.8 -50.68 68.02 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.244 -0.91 . . . . 0.31 109.768 -179.695 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' D' D ' 341' ' ' PHE . . . . . . . . . . . . . 40.3 m-85 -62.55 -41.92 99.2 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.234 -0.916 . . . . 0.17999999999999999 110.086 -179.725 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' D' D ' 342' ' ' ARG . . . . . 0.558 ' NH1' ' HG2' ' D' ' 342' ' ' ARG . 0.2 OUTLIER -50.33 -42.56 53.03 Favored 'General case' 0 N--CA 1.492 1.675 0 O-C-N 121.125 -0.984 . . . . 2.4100000000000001 109.843 -179.598 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' D' D ' 343' ' ' GLU . . . . . . . . . . . . . 2.2 tp10 -57.92 -45.65 86.2 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.239 -0.913 . . . . 2.3500000000000001 109.652 -179.686 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' D' D ' 344' ' ' LEU . . . . . 0.401 HD22 HD22 ' C' ' 344' ' ' LEU . 36.0 mt -62.04 -34.13 75.66 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.223 -0.923 . . . . 0.19 109.398 -179.956 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' D' D ' 345' ' ' ASN . . . . . . . . . . . . . 9.2 t-20 -56.54 -58.13 9.35 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.277 -0.889 . . . . 1.0900000000000001 109.95 -179.876 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' D' D ' 346' ' ' GLU . . . . . 0.4 ' OE1' ' HE3' ' C' ' 351' ' ' LYS . 3.1 tt0 -60.19 -28.95 68.38 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.269 -0.894 . . . . 1.6899999999999999 109.704 -179.484 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' D' D ' 347' ' ' ALA . . . . . 0.979 ' HB1' ' HB1' ' C' ' 347' ' ' ALA . . . -61.1 -59.77 4.82 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.228 -0.92 . . . . 0.17999999999999999 110.108 -179.766 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' D' D ' 348' ' ' LEU . . . . . 0.595 HD22 ' N ' ' D' ' 348' ' ' LEU . 4.0 mm? -61.71 -44.28 97.24 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.138 -0.976 . . . . 0.31 109.959 -179.39 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' D' D ' 349' ' ' GLU . . . . . . . . . . . . . 1.8 mm-40 -56.14 -36.69 68.55 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.175 -0.953 . . . . 1.95 109.892 -179.381 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' D' D ' 350' ' ' LEU . . . . . 0.795 HD13 HD22 ' C' ' 350' ' ' LEU . 5.1 tt -63.34 -42.48 98.94 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.169 -0.957 . . . . 0.42999999999999999 109.467 -179.716 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' D' D ' 351' ' ' LYS . . . . . . . . . . . . . 30.9 tttp -58.63 -35.79 73.05 Favored 'General case' 0 N--CA 1.489 1.486 0 O-C-N 121.135 -0.978 . . . . 1.3999999999999999 109.076 179.884 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' D' D ' 352' ' ' ASP . . . . . . . . . . . . . 98.6 m-20 -56.82 -40.45 76.03 Favored 'General case' 0 N--CA 1.488 1.47 0 O-C-N 121.345 -0.847 . . . . 1.1699999999999999 109.479 179.729 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' D' D ' 353' ' ' ALA . . . . . . . . . . . . . . . -68.03 -24.54 65.11 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.334 -0.854 . . . . 0.58999999999999997 109.737 -179.756 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' D' D ' 354' ' ' GLN . . . . . . . . . . . . . 10.4 tt0 . . . . . 0 N--CA 1.492 1.673 0 O-C-N 121.205 -0.934 . . . . 1.4399999999999999 109.544 -179.914 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 326' ' ' GLU . . . . . . . . . . . . . 1.8 mm-40 . . . . . 0 N--CA 1.49 1.549 0 N-CA-C 109.241 -0.651 . . . . 2.1299999999999999 109.241 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 327' ' ' TYR . . . . . 0.589 ' CE1' ' HG2' ' C' ' 333' ' ' ARG . 46.6 m-85 -149.14 105.31 3.5 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.129 -0.982 . . . . 0.47999999999999998 109.767 -179.769 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 328' ' ' PHE . . . . . 0.552 ' CZ ' ' HD3' ' C' ' 335' ' ' ARG . 97.3 m-85 -112.28 -163.71 0.87 Allowed 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.388 -0.82 . . . . 0.31 109.407 179.801 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 329' ' ' THR . . . . . 0.449 ' HA ' ' O ' ' C' ' 330' ' ' LEU . 74.4 p -154.58 166.34 33.65 Favored 'General case' 0 N--CA 1.489 1.487 0 O-C-N 121.278 -0.889 . . . . 0.22 109.032 179.812 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 330' ' ' LEU . . . . . 0.421 ' O ' ' HA ' ' C' ' 329' ' ' THR . 32.9 tp -151.06 131.96 14.18 Favored 'General case' 0 N--CA 1.488 1.449 0 O-C-N 121.119 -0.988 . . . . 0.28000000000000003 109.886 -179.775 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 331' ' ' GLN . . . . . . . . . . . . . 19.4 tp60 -86.87 114.84 23.85 Favored 'General case' 0 N--CA 1.488 1.449 0 O-C-N 121.318 -0.864 . . . . 0.91000000000000003 109.121 179.688 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 332' ' ' ILE . . . . . 0.554 HG21 ' HA ' ' A' ' 338' ' ' PHE . 52.1 mt -103.26 107.22 21.66 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.572 0 O-C-N 121.215 -0.928 . . . . 0.26000000000000001 109.659 -179.797 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 333' ' ' ARG . . . . . 0.532 ' HG2' ' CE1' ' C' ' 327' ' ' TYR . 9.9 mtp180 -72.49 140.04 48.0 Favored 'General case' 0 N--CA 1.488 1.447 0 O-C-N 121.252 -0.905 . . . . 2.9199999999999999 109.45 179.897 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 334' ' ' GLY . . . . . . . . . . . . . . . 88.88 127.53 2.98 Favored Glycine 0 N--CA 1.49 2.297 0 N-CA-C 109.723 -1.351 . . . . 0.40000000000000002 109.723 -179.991 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 335' ' ' ARG . . . . . 0.484 ' HB2' ' OE1' ' C' ' 326' ' ' GLU . 8.0 ttt180 -78.33 -34.62 48.48 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.265 -1.138 . . . . 3.0099999999999998 109.636 179.956 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 336' ' ' GLU . . . . . . . . . . . . . 9.3 tt0 -57.89 -62.33 1.89 Allowed 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.166 -0.959 . . . . 2.29 109.714 -179.862 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 337' ' ' ARG . . . . . 0.512 ' NH1' ' HG2' ' A' ' 337' ' ' ARG . 0.0 OUTLIER -60.97 -27.39 68.23 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.202 -0.936 . . . . 2.9300000000000002 109.717 -179.746 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 338' ' ' PHE . . . . . 0.554 ' HA ' HG21 ' A' ' 332' ' ' ILE . 52.0 t80 -54.08 -64.73 0.73 Allowed 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.239 -0.913 . . . . 0.38 109.651 -179.727 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 339' ' ' GLU . . . . . . . . . . . . . 43.2 mt-10 -50.62 -29.04 9.99 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.245 -0.909 . . . . 1.97 109.681 -179.739 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 340' ' ' MET . . . . . 0.448 ' HB3' ' O ' ' A' ' 337' ' ' ARG . 6.9 ttp -64.43 -52.29 58.81 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.17 -0.956 . . . . 0.31 109.851 -179.853 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 341' ' ' PHE . . . . . . . . . . . . . 40.4 m-85 -62.54 -44.61 95.93 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.313 -0.867 . . . . 0.17999999999999999 110.068 -179.687 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 342' ' ' ARG . . . . . . . . . . . . . 1.8 ttp180 -49.82 -41.87 45.85 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.102 -0.999 . . . . 2.4199999999999999 109.867 -179.598 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 343' ' ' GLU . . . . . . . . . . . . . 38.4 tt0 -59.06 -47.19 86.15 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.194 -0.941 . . . . 2.3500000000000001 109.882 -179.697 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 344' ' ' LEU . . . . . 0.411 HD22 HD22 ' B' ' 344' ' ' LEU . 78.6 mt -62.71 -32.56 73.68 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.213 -0.929 . . . . 0.17999999999999999 109.925 -179.65 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 345' ' ' ASN . . . . . 0.514 ' HA ' ' CZ ' ' C' ' 341' ' ' PHE . 53.8 t-20 -57.03 -56.09 26.26 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.203 -0.936 . . . . 1.0900000000000001 110.064 -179.641 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 346' ' ' GLU . . . . . . . . . . . . . 3.9 tp10 -61.48 -26.79 68.13 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.145 -0.972 . . . . 1.6499999999999999 110.089 -179.397 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 347' ' ' ALA . . . . . 0.984 ' HB1' ' HB1' ' B' ' 347' ' ' ALA . . . -61.41 -58.31 8.72 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.081 -1.012 . . . . 0.17999999999999999 110.182 -179.618 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 348' ' ' LEU . . . . . 0.58 HD22 ' N ' ' A' ' 348' ' ' LEU . 4.0 mm? -62.1 -50.72 70.8 Favored 'General case' 0 N--CA 1.494 1.773 0 O-C-N 121.183 -0.948 . . . . 0.29999999999999999 110.323 -179.287 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 349' ' ' GLU . . . . . . . . . . . . . 66.6 mt-10 -57.15 -30.87 64.81 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.184 -0.948 . . . . 1.9399999999999999 110.055 -179.149 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 350' ' ' LEU . . . . . 0.616 HD22 HD22 ' B' ' 350' ' ' LEU . 8.9 tt -65.06 -45.59 84.68 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.147 -0.971 . . . . 0.46000000000000002 109.579 -179.876 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 351' ' ' LYS . . . . . . . . . . . . . 41.1 tttm -57.35 -43.19 83.23 Favored 'General case' 0 N--CA 1.488 1.45 0 O-C-N 121.337 -0.852 . . . . 1.3999999999999999 109.541 -179.441 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 352' ' ' ASP . . . . . . . . . . . . . 14.3 m-20 -55.85 -54.86 39.43 Favored 'General case' 0 N--CA 1.488 1.46 0 O-C-N 121.214 -0.929 . . . . 1.1599999999999999 109.583 179.976 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 353' ' ' ALA . . . . . . . . . . . . . . . -68.47 -11.48 59.84 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.227 -0.921 . . . . 0.63 109.8 -179.832 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 354' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.49 1.566 0 O-C-N 121.167 -0.958 . . . . 1.47 109.723 -179.771 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 326' ' ' GLU . . . . . . . . . . . . . 1.8 mm-40 . . . . . 0 N--CA 1.49 1.572 0 N-CA-C 109.204 -0.665 . . . . 2.1299999999999999 109.204 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' B' B ' 327' ' ' TYR . . . . . 0.58 ' CE1' ' HG2' ' D' ' 333' ' ' ARG . 46.2 m-85 -149.18 105.26 3.49 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.096 -1.003 . . . . 0.47999999999999998 109.812 -179.79 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 328' ' ' PHE . . . . . 0.417 ' C ' HG23 ' B' ' 329' ' ' THR . 97.2 m-85 -112.16 -163.69 0.87 Allowed 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.375 -0.828 . . . . 0.32000000000000001 109.471 179.783 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 329' ' ' THR . . . . . 0.417 HG23 ' C ' ' B' ' 328' ' ' PHE . 73.8 p -154.59 166.33 33.7 Favored 'General case' 0 N--CA 1.489 1.488 0 O-C-N 121.283 -0.886 . . . . 0.23000000000000001 108.986 179.788 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 330' ' ' LEU . . . . . . . . . . . . . 32.5 tp -151.07 131.93 14.15 Favored 'General case' 0 N--CA 1.489 1.481 0 O-C-N 121.102 -0.999 . . . . 0.28000000000000003 109.857 -179.809 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 331' ' ' GLN . . . . . . . . . . . . . 19.5 tp60 -86.89 114.97 23.97 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.358 -0.839 . . . . 0.91000000000000003 109.081 179.688 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 332' ' ' ILE . . . . . 0.552 HG21 ' HA ' ' B' ' 338' ' ' PHE . 52.2 mt -103.38 106.9 20.99 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.58 0 O-C-N 121.248 -0.908 . . . . 0.23999999999999999 109.677 -179.769 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 333' ' ' ARG . . . . . 0.489 ' HG2' ' CE1' ' D' ' 327' ' ' TYR . 9.8 mtp180 -72.22 140.05 48.49 Favored 'General case' 0 N--CA 1.489 1.497 0 O-C-N 121.259 -0.901 . . . . 2.9300000000000002 109.414 179.756 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 334' ' ' GLY . . . . . . . . . . . . . . . 88.95 127.45 2.98 Favored Glycine 0 N--CA 1.491 2.361 0 N-CA-C 109.72 -1.352 . . . . 0.40000000000000002 109.72 179.851 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 335' ' ' ARG . . . . . 0.474 ' O ' ' HB3' ' B' ' 338' ' ' PHE . 8.2 ttt180 -78.14 -34.77 49.65 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.303 -1.116 . . . . 3.0099999999999998 109.576 179.991 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 336' ' ' GLU . . . . . . . . . . . . . 9.2 tt0 -57.79 -62.36 1.86 Allowed 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.265 -0.897 . . . . 2.2799999999999998 109.771 -179.787 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 337' ' ' ARG . . . . . 0.519 ' NH1' ' HG2' ' B' ' 337' ' ' ARG . 0.0 OUTLIER -60.85 -27.55 68.19 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.258 -0.901 . . . . 2.9300000000000002 109.827 -179.801 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' B' B ' 338' ' ' PHE . . . . . 0.552 ' HA ' HG21 ' B' ' 332' ' ' ILE . 52.2 t80 -53.92 -64.87 0.69 Allowed 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.284 -0.885 . . . . 0.37 109.669 -179.772 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 339' ' ' GLU . . . . . . . . . . . . . 42.7 mt-10 -50.5 -28.94 9.36 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.256 -0.902 . . . . 1.98 109.77 -179.775 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 340' ' ' MET . . . . . 0.45 ' HB3' ' O ' ' B' ' 337' ' ' ARG . 6.9 ttp -64.54 -52.2 58.91 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.182 -0.949 . . . . 0.32000000000000001 109.79 -179.8 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 341' ' ' PHE . . . . . 0.546 ' CZ ' ' HA ' ' D' ' 345' ' ' ASN . 39.9 m-85 -62.66 -44.53 96.03 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.243 -0.911 . . . . 0.17999999999999999 110.019 -179.624 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 342' ' ' ARG . . . . . . . . . . . . . 1.8 ttp180 -49.93 -41.79 47.04 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.156 -0.965 . . . . 2.4199999999999999 109.918 -179.618 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 343' ' ' GLU . . . . . . . . . . . . . 37.4 tt0 -59.24 -47.15 86.42 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.181 -0.949 . . . . 2.3500000000000001 109.793 -179.645 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 344' ' ' LEU . . . . . 0.411 HD22 HD22 ' A' ' 344' ' ' LEU . 79.3 mt -62.71 -32.46 73.57 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.129 -0.982 . . . . 0.17999999999999999 109.825 -179.645 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 345' ' ' ASN . . . . . 0.461 ' HA ' ' CZ ' ' D' ' 341' ' ' PHE . 54.1 t-20 -57.22 -56.04 27.0 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.22 -0.925 . . . . 1.0900000000000001 110.014 -179.585 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 346' ' ' GLU . . . . . . . . . . . . . 3.9 tp10 -61.49 -26.66 68.06 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.259 -0.9 . . . . 1.6599999999999999 110.011 -179.443 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 347' ' ' ALA . . . . . 0.984 ' HB1' ' HB1' ' A' ' 347' ' ' ALA . . . -61.53 -58.34 8.53 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.124 -0.985 . . . . 0.17000000000000001 110.17 -179.623 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 348' ' ' LEU . . . . . 0.584 HD22 ' N ' ' B' ' 348' ' ' LEU . 4.0 mm? -62.11 -50.75 70.65 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.192 -0.943 . . . . 0.28999999999999998 110.327 -179.267 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 349' ' ' GLU . . . . . . . . . . . . . 66.7 mt-10 -57.09 -30.93 64.75 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.185 -0.947 . . . . 1.95 110.084 -179.15 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 350' ' ' LEU . . . . . 0.616 HD22 HD22 ' A' ' 350' ' ' LEU . 8.9 tt -65.01 -45.54 85.1 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.151 -0.968 . . . . 0.45000000000000001 109.601 -179.923 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 351' ' ' LYS . . . . . . . . . . . . . 40.8 tttm -57.33 -43.17 83.13 Favored 'General case' 0 N--CA 1.489 1.497 0 O-C-N 121.268 -0.895 . . . . 1.3799999999999999 109.618 -179.45 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 352' ' ' ASP . . . . . . . . . . . . . 14.4 m-20 -55.91 -54.88 39.32 Favored 'General case' 0 N--CA 1.489 1.478 0 O-C-N 121.208 -0.932 . . . . 1.1599999999999999 109.56 179.902 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 353' ' ' ALA . . . . . . . . . . . . . . . -68.44 -11.61 59.98 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.215 -0.928 . . . . 0.60999999999999999 109.802 -179.78 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 354' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.492 1.64 0 O-C-N 121.167 -0.958 . . . . 1.45 109.727 -179.779 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' C' C ' 326' ' ' GLU . . . . . 0.484 ' OE1' ' HB2' ' A' ' 335' ' ' ARG . 2.3 mt-10 . . . . . 0 N--CA 1.488 1.463 0 CA-C-O 121.35 0.595 . . . . 2.1699999999999999 109.415 . . . . . . . . . 1 1 . 1 . 018 nuclear build core ' C' C ' 327' ' ' TYR . . . . . 0.532 ' CE1' ' HG2' ' A' ' 333' ' ' ARG . 42.6 m-85 -148.98 103.41 3.35 Favored 'General case' 0 N--CA 1.489 1.493 0 O-C-N 121.269 -0.894 . . . . 0.47999999999999998 109.175 179.941 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' C' C ' 328' ' ' PHE . . . . . . . . . . . . . 52.9 m-85 -107.13 -167.41 1.27 Allowed 'General case' 0 N--CA 1.488 1.469 0 O-C-N 121.292 -0.88 . . . . 0.33000000000000002 109.378 -179.944 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' C' C ' 329' ' ' THR . . . . . 0.421 ' HA ' ' O ' ' A' ' 330' ' ' LEU . 4.5 p -152.07 167.85 27.16 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.26 -0.9 . . . . 0.23000000000000001 109.043 179.907 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' C' C ' 330' ' ' LEU . . . . . 0.449 ' O ' ' HA ' ' A' ' 329' ' ' THR . 27.0 tp -151.15 129.5 12.04 Favored 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.127 -0.983 . . . . 0.28000000000000003 109.946 -179.525 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' C' C ' 331' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -89.41 114.91 26.43 Favored 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.3 -0.875 . . . . 1.48 109.438 179.724 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' C' C ' 332' ' ' ILE . . . . . 0.478 HD12 ' CD1' ' C' ' 338' ' ' PHE . 60.2 mt -103.76 113.29 40.23 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.622 0 O-C-N 121.11 -0.994 . . . . 0.23999999999999999 109.648 179.964 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' C' C ' 333' ' ' ARG . . . . . 0.589 ' HG2' ' CE1' ' A' ' 327' ' ' TYR . 34.7 mtt180 -73.44 139.91 46.15 Favored 'General case' 0 N--CA 1.489 1.478 0 O-C-N 121.171 -0.956 . . . . 2.7400000000000002 109.443 179.772 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' C' C ' 334' ' ' GLY . . . . . . . . . . . . . . . 81.43 125.64 0.75 Allowed Glycine 0 N--CA 1.491 2.325 0 N-CA-C 109.597 -1.401 . . . . 0.34999999999999998 109.597 179.946 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' C' C ' 335' ' ' ARG . . . . . 0.552 ' HD3' ' CZ ' ' A' ' 328' ' ' PHE . 0.0 OUTLIER -76.57 -25.57 54.16 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.194 -1.18 . . . . 2.5299999999999998 109.696 -179.986 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' C' C ' 336' ' ' GLU . . . . . . . . . . . . . 1.9 tt0 -55.85 -69.49 0.14 Allowed 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.135 -0.978 . . . . 2.6200000000000001 109.72 -179.716 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' C' C ' 337' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -60.72 -23.83 65.21 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.164 -0.96 . . . . 2.8100000000000001 109.566 -179.862 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' C' C ' 338' ' ' PHE . . . . . 0.478 ' CD1' HD12 ' C' ' 332' ' ' ILE . 61.2 t80 -54.67 -59.4 4.76 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.215 -0.928 . . . . 0.40000000000000002 109.491 -179.971 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' C' C ' 339' ' ' GLU . . . . . . . . . . . . . 2.1 mt-10 -52.1 -33.37 39.22 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.231 -0.918 . . . . 2.0499999999999998 109.945 -179.794 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' C' C ' 340' ' ' MET . . . . . . . . . . . . . 41.5 ttp -63.21 -50.73 69.12 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.067 -1.021 . . . . 0.32000000000000001 109.896 -179.618 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' C' C ' 341' ' ' PHE . . . . . 0.514 ' CZ ' ' HA ' ' A' ' 345' ' ' ASN . 46.9 m-85 -62.16 -50.34 72.23 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.142 -0.974 . . . . 0.17999999999999999 109.785 -179.796 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' C' C ' 342' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -48.19 -42.2 29.2 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.224 -0.923 . . . . 2.9100000000000001 110.068 -179.61 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' C' C ' 343' ' ' GLU . . . . . . . . . . . . . 10.2 tp10 -57.9 -48.1 80.85 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.251 -0.905 . . . . 2.1400000000000001 109.618 -179.673 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' C' C ' 344' ' ' LEU . . . . . . . . . . . . . 79.6 mt -62.33 -26.51 68.47 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.292 -0.88 . . . . 0.22 109.603 -179.95 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' C' C ' 345' ' ' ASN . . . . . 0.414 HD22 HD11 ' A' ' 330' ' ' LEU . 56.9 t-20 -58.5 -57.63 12.11 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.288 -0.883 . . . . 1.0800000000000001 110.019 -179.786 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' C' C ' 346' ' ' GLU . . . . . 0.469 ' O ' ' HG2' ' C' ' 346' ' ' GLU . 25.4 tt0 -60.96 -27.81 68.53 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.185 -0.947 . . . . 2.21 110.043 -179.415 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' C' C ' 347' ' ' ALA . . . . . 0.896 ' HB1' ' HB1' ' D' ' 347' ' ' ALA . . . -61.93 -58.4 8.07 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.037 -1.039 . . . . 0.17999999999999999 110.276 -179.498 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' C' C ' 348' ' ' LEU . . . . . 0.535 ' N ' HD22 ' C' ' 348' ' ' LEU . 3.7 mm? -62.09 -48.94 77.96 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.206 -0.934 . . . . 0.32000000000000001 110.538 -179.065 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' C' C ' 349' ' ' GLU . . . . . . . . . . . . . 16.5 mm-40 -57.49 -34.99 69.64 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.091 -1.005 . . . . 2.1899999999999999 110.267 -179.135 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' C' C ' 350' ' ' LEU . . . . . 0.64 HD22 HD22 ' D' ' 350' ' ' LEU . 8.5 tt -64.48 -40.46 95.73 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.056 -1.028 . . . . 0.46000000000000002 109.563 -179.794 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' C' C ' 351' ' ' LYS . . . . . 0.408 ' NZ ' ' HG3' ' D' ' 343' ' ' GLU . 7.0 ttmt -59.33 -48.97 79.62 Favored 'General case' 0 N--CA 1.489 1.477 0 O-C-N 121.293 -0.879 . . . . 1.3500000000000001 109.612 -179.837 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' C' C ' 352' ' ' ASP . . . . . . . . . . . . . 62.1 m-20 -56.94 -54.57 45.15 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.338 -0.851 . . . . 1.1899999999999999 110.232 -179.732 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' C' C ' 353' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 1.56 0 O-C-N 121.141 -0.975 . . . . 0.56999999999999995 110.063 -179.327 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' D' D ' 326' ' ' GLU . . . . . . . . . . . . . 1.8 mm-40 . . . . . 0 N--CA 1.49 1.533 0 N-CA-C 109.243 -0.651 . . . . 2.1299999999999999 109.243 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' D' D ' 327' ' ' TYR . . . . . 0.489 ' CE1' ' HG2' ' B' ' 333' ' ' ARG . 46.7 m-85 -149.36 105.38 3.47 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.066 -1.021 . . . . 0.46999999999999997 109.924 -179.834 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' D' D ' 328' ' ' PHE . . . . . 0.423 ' C ' HG23 ' D' ' 329' ' ' THR . 97.1 m-85 -112.29 -163.57 0.86 Allowed 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.307 -0.871 . . . . 0.29999999999999999 109.451 179.838 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' D' D ' 329' ' ' THR . . . . . 0.423 HG23 ' C ' ' D' ' 328' ' ' PHE . 72.5 p -154.71 166.38 33.62 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.309 -0.869 . . . . 0.22 108.924 179.817 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' D' D ' 330' ' ' LEU . . . . . . . . . . . . . 32.5 tp -151.07 132.09 14.29 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.056 -1.028 . . . . 0.28000000000000003 109.823 -179.782 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' D' D ' 331' ' ' GLN . . . . . . . . . . . . . 19.4 tp60 -86.96 114.98 24.04 Favored 'General case' 0 N--CA 1.489 1.488 0 O-C-N 121.37 -0.832 . . . . 0.93000000000000005 109.021 179.672 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' D' D ' 332' ' ' ILE . . . . . 0.565 HG21 ' HA ' ' D' ' 338' ' ' PHE . 52.5 mt -103.43 106.87 20.96 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.542 0 O-C-N 121.209 -0.932 . . . . 0.25 109.662 -179.8 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' D' D ' 333' ' ' ARG . . . . . 0.58 ' HG2' ' CE1' ' B' ' 327' ' ' TYR . 9.9 mtp180 -72.19 140.14 48.58 Favored 'General case' 0 N--CA 1.488 1.441 0 O-C-N 121.273 -0.892 . . . . 2.9300000000000002 109.393 179.824 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' D' D ' 334' ' ' GLY . . . . . . . . . . . . . . . 88.96 127.23 2.93 Favored Glycine 0 N--CA 1.492 2.414 0 N-CA-C 109.689 -1.365 . . . . 0.40999999999999998 109.689 179.93 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' D' D ' 335' ' ' ARG . . . . . 0.476 ' O ' ' HB3' ' D' ' 338' ' ' PHE . 7.9 ttt180 -78.2 -34.52 49.39 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.258 -1.142 . . . . 3.0299999999999998 109.63 179.947 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' D' D ' 336' ' ' GLU . . . . . . . . . . . . . 9.2 tt0 -58.05 -62.19 2.0 Allowed 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.276 -0.89 . . . . 2.2599999999999998 109.659 -179.819 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' D' D ' 337' ' ' ARG . . . . . 0.516 ' NH1' ' HG2' ' D' ' 337' ' ' ARG . 0.0 OUTLIER -60.99 -27.58 68.4 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.317 -0.864 . . . . 2.9199999999999999 109.706 -179.774 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' D' D ' 338' ' ' PHE . . . . . 0.565 ' HA ' HG21 ' D' ' 332' ' ' ILE . 52.9 t80 -53.84 -64.66 0.76 Allowed 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.248 -0.907 . . . . 0.37 109.777 -179.792 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' D' D ' 339' ' ' GLU . . . . . . . . . . . . . 42.8 mt-10 -50.6 -29.17 10.24 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.25 -0.906 . . . . 1.99 109.687 -179.765 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' D' D ' 340' ' ' MET . . . . . 0.441 ' HB3' ' O ' ' D' ' 337' ' ' ARG . 7.0 ttp -64.39 -52.26 59.12 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.236 -0.915 . . . . 0.31 109.793 -179.763 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' D' D ' 341' ' ' PHE . . . . . 0.461 ' CZ ' ' HA ' ' B' ' 345' ' ' ASN . 39.8 m-85 -62.71 -44.53 95.98 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.303 -0.873 . . . . 0.17999999999999999 109.991 -179.594 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' D' D ' 342' ' ' ARG . . . . . . . . . . . . . 1.9 ttp180 -49.86 -41.93 46.42 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.158 -0.964 . . . . 2.4100000000000001 109.921 -179.656 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' D' D ' 343' ' ' GLU . . . . . 0.408 ' HG3' ' NZ ' ' C' ' 351' ' ' LYS . 38.1 tt0 -59.08 -47.19 86.16 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.133 -0.98 . . . . 2.3500000000000001 109.885 -179.701 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' D' D ' 344' ' ' LEU . . . . . . . . . . . . . 79.3 mt -62.66 -32.55 73.63 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.191 -0.943 . . . . 0.19 109.909 -179.717 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' D' D ' 345' ' ' ASN . . . . . 0.546 ' HA ' ' CZ ' ' B' ' 341' ' ' PHE . 53.7 t-20 -57.11 -56.12 25.94 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.283 -0.886 . . . . 1.0900000000000001 110.04 -179.613 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' D' D ' 346' ' ' GLU . . . . . . . . . . . . . 4.0 tp10 -61.45 -26.51 67.93 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.152 -0.968 . . . . 1.6899999999999999 110.144 -179.498 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' D' D ' 347' ' ' ALA . . . . . 0.896 ' HB1' ' HB1' ' C' ' 347' ' ' ALA . . . -61.57 -58.34 8.5 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.169 -0.957 . . . . 0.17999999999999999 110.172 -179.566 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' D' D ' 348' ' ' LEU . . . . . 0.583 HD22 ' N ' ' D' ' 348' ' ' LEU . 4.0 mm? -62.05 -50.63 71.22 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.212 -0.93 . . . . 0.31 110.294 -179.29 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' D' D ' 349' ' ' GLU . . . . . . . . . . . . . 66.9 mt-10 -57.19 -30.99 64.98 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.135 -0.978 . . . . 1.95 110.134 -179.226 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' D' D ' 350' ' ' LEU . . . . . 0.64 HD22 HD22 ' C' ' 350' ' ' LEU . 8.9 tt -65.08 -45.13 86.51 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.09 -1.006 . . . . 0.42999999999999999 109.675 -179.884 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' D' D ' 351' ' ' LYS . . . . . . . . . . . . . 40.9 tttm -57.74 -43.3 85.29 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.302 -0.874 . . . . 1.3999999999999999 109.593 -179.643 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' D' D ' 352' ' ' ASP . . . . . . . . . . . . . 14.3 m-20 -55.81 -54.92 38.59 Favored 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.253 -0.905 . . . . 1.1699999999999999 109.561 179.926 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' D' D ' 353' ' ' ALA . . . . . . . . . . . . . . . -68.45 -11.43 59.73 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.247 -0.908 . . . . 0.58999999999999997 109.779 -179.872 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' D' D ' 354' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.489 1.517 0 O-C-N 121.149 -0.969 . . . . 1.4399999999999999 109.798 -179.826 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 326' ' ' GLU . . . . . . . . . . . . . 3.6 mt-10 . . . . . 0 N--CA 1.488 1.47 0 CA-C-O 121.364 0.602 . . . . 2.1299999999999999 109.545 . . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 327' ' ' TYR . . . . . 0.449 ' CE1' ' HG2' ' C' ' 333' ' ' ARG . 47.2 m-85 -149.85 112.76 4.83 Favored 'General case' 0 N--CA 1.489 1.491 0 O-C-N 121.377 -0.827 . . . . 0.47999999999999998 109.43 -179.9 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 328' ' ' PHE . . . . . 0.481 ' O ' ' OE1' ' C' ' 331' ' ' GLN . 77.4 m-85 -113.46 -170.18 1.64 Allowed 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.257 -0.902 . . . . 0.31 109.385 -179.934 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 329' ' ' THR . . . . . 0.424 ' HA ' ' O ' ' C' ' 330' ' ' LEU . 52.4 p -154.58 169.26 24.25 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.082 -1.012 . . . . 0.22 109.438 -179.775 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 330' ' ' LEU . . . . . 0.497 HD11 HD22 ' C' ' 345' ' ' ASN . 33.6 tp -152.12 129.09 11.01 Favored 'General case' 0 N--CA 1.488 1.474 0 O-C-N 121.081 -1.012 . . . . 0.28000000000000003 110.144 -179.927 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 331' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -87.83 109.62 19.89 Favored 'General case' 0 N--CA 1.487 1.404 0 O-C-N 121.302 -0.874 . . . . 0.91000000000000003 108.841 179.271 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 332' ' ' ILE . . . . . . . . . . . . . 18.3 mt -103.03 104.91 17.32 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.523 0 O-C-N 121.14 -0.975 . . . . 0.26000000000000001 109.682 -179.586 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 333' ' ' ARG . . . . . 0.629 ' CG ' ' CE1' ' C' ' 327' ' ' TYR . 0.0 OUTLIER -72.01 152.92 42.1 Favored 'General case' 0 C--N 1.303 -1.455 0 O-C-N 121.564 -0.71 . . . . 2.9199999999999999 109.25 179.714 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 334' ' ' GLY . . . . . . . . . . . . . . . 76.45 129.69 0.34 Allowed Glycine 0 N--CA 1.489 2.202 0 N-CA-C 109.545 -1.422 . . . . 0.40000000000000002 109.545 179.997 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 335' ' ' ARG . . . . . . . . . . . . . 9.2 ttm180 -79.15 -26.0 42.82 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.317 -1.107 . . . . 3.0099999999999998 109.785 -179.939 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 336' ' ' GLU . . . . . . . . . . . . . 16.3 mt-10 -57.42 -68.89 0.19 Allowed 'General case' 0 N--CA 1.495 1.786 0 O-C-N 121.225 -0.922 . . . . 2.29 109.83 -179.728 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 337' ' ' ARG . . . . . . . . . . . . . 6.1 mpt_? -59.41 -29.39 67.71 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.226 -0.921 . . . . 2.9300000000000002 109.586 -179.738 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 338' ' ' PHE . . . . . . . . . . . . . 72.4 t80 -53.99 -59.6 4.43 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.431 -0.793 . . . . 0.38 109.645 -179.829 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 339' ' ' GLU . . . . . . . . . . . . . 58.9 mt-10 -50.54 -34.89 27.15 Favored 'General case' 0 N--CA 1.488 1.473 0 O-C-N 121.197 -0.939 . . . . 1.97 110.181 -179.456 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 340' ' ' MET . . . . . . . . . . . . . 52.9 ttp -64.2 -50.08 69.5 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.193 -0.942 . . . . 0.31 110.408 -179.288 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 341' ' ' PHE . . . . . . . . . . . . . 55.6 m-85 -62.08 -39.95 94.17 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.238 -0.914 . . . . 0.17999999999999999 109.996 -179.344 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 342' ' ' ARG . . . . . . . . . . . . . 31.8 ttt180 -51.41 -47.59 62.91 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.182 -0.949 . . . . 2.4199999999999999 110.175 -179.5 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 343' ' ' GLU . . . . . . . . . . . . . 9.4 tp10 -60.13 -43.02 96.0 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 120.992 -1.067 . . . . 2.3500000000000001 110.201 -179.379 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 344' ' ' LEU . . . . . . . . . . . . . 52.7 mt -61.28 -37.04 81.72 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.085 -1.01 . . . . 0.17999999999999999 110.03 -179.416 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 345' ' ' ASN . . . . . 0.552 HD22 HD11 ' C' ' 330' ' ' LEU . 46.4 t-20 -58.24 -53.27 60.16 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.166 -0.959 . . . . 1.0900000000000001 109.8 -179.786 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 346' ' ' GLU . . . . . . . . . . . . . 1.2 tt0 -61.29 -30.95 70.79 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.208 -0.932 . . . . 1.6499999999999999 109.768 -179.674 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 347' ' ' ALA . . . . . 0.949 ' HB1' ' HB1' ' B' ' 347' ' ' ALA . . . -61.59 -57.59 11.47 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.236 -0.915 . . . . 0.17999999999999999 110.245 -179.501 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 348' ' ' LEU . . . . . 0.546 HD22 ' N ' ' A' ' 348' ' ' LEU . 3.8 mm? -61.56 -44.78 96.4 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.147 -0.97 . . . . 0.29999999999999999 110.04 -179.324 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 349' ' ' GLU . . . . . . . . . . . . . 76.0 mt-10 -57.99 -35.21 70.9 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.228 -0.92 . . . . 1.9399999999999999 109.95 -179.496 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 350' ' ' LEU . . . . . 0.735 HD22 HD13 ' B' ' 350' ' ' LEU . 6.8 tt -63.89 -48.39 76.82 Favored 'General case' 0 C--N 1.302 -1.474 0 O-C-N 121.098 -1.001 . . . . 0.46000000000000002 109.593 -179.623 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 351' ' ' LYS . . . . . . . . . . . . . 43.4 tttm -59.11 -42.03 89.59 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.307 -0.87 . . . . 1.3999999999999999 109.664 -179.794 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 352' ' ' ASP . . . . . 0.515 ' OD2' ' CZ ' ' C' ' 337' ' ' ARG . 1.0 OUTLIER -58.51 -38.96 78.81 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.084 -1.01 . . . . 1.1599999999999999 109.742 -179.896 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 353' ' ' ALA . . . . . . . . . . . . . . . -67.19 -21.72 65.76 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.289 -0.882 . . . . 0.63 109.94 -179.483 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 354' ' ' GLN . . . . . . . . . . . . . 9.3 mt-30 . . . . . 0 N--CA 1.489 1.489 0 O-C-N 121.174 -0.953 . . . . 1.47 109.361 179.903 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' B' B ' 326' ' ' GLU . . . . . . . . . . . . . 3.8 mt-10 . . . . . 0 N--CA 1.491 1.581 0 CA-C-O 121.342 0.591 . . . . 2.1299999999999999 109.619 . . . . . . . . . 0 0 . 1 . 019 nuclear build core ' B' B ' 327' ' ' TYR . . . . . 0.583 ' CE1' ' CG ' ' D' ' 333' ' ' ARG . 44.7 m-85 -149.55 112.11 4.75 Favored 'General case' 0 N--CA 1.488 1.443 0 O-C-N 121.105 -0.997 . . . . 0.47999999999999998 109.651 -179.907 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 328' ' ' PHE . . . . . . . . . . . . . 80.4 m-85 -113.02 -170.88 1.76 Allowed 'General case' 0 C--N 1.303 -1.444 0 O-C-N 121.27 -0.894 . . . . 0.32000000000000001 109.462 -179.67 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 329' ' ' THR . . . . . 0.413 ' HA ' ' O ' ' D' ' 330' ' ' LEU . 43.6 p -153.61 169.83 22.3 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.25 -0.906 . . . . 0.23000000000000001 109.381 -179.689 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 330' ' ' LEU . . . . . 0.542 HD11 HD22 ' D' ' 345' ' ' ASN . 32.8 tp -152.7 128.83 10.43 Favored 'General case' 0 N--CA 1.489 1.479 0 O-C-N 121.021 -1.049 . . . . 0.28000000000000003 110.198 -179.991 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 331' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -87.58 109.89 19.97 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.404 -0.81 . . . . 0.91000000000000003 108.863 179.131 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 332' ' ' ILE . . . . . . . . . . . . . 20.4 mt -103.24 105.23 17.9 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.488 0 O-C-N 121.157 -0.964 . . . . 0.23999999999999999 109.876 -179.63 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 333' ' ' ARG . . . . . 0.577 ' CG ' ' CE1' ' D' ' 327' ' ' TYR . 0.0 OUTLIER -72.46 151.86 42.29 Favored 'General case' 0 N--CA 1.489 1.486 0 O-C-N 121.324 -0.86 . . . . 2.9300000000000002 109.241 179.735 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' B' B ' 334' ' ' GLY . . . . . . . . . . . . . . . 77.57 128.86 0.42 Allowed Glycine 0 N--CA 1.489 2.175 0 N-CA-C 109.837 -1.305 . . . . 0.40000000000000002 109.837 179.935 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 335' ' ' ARG . . . . . . . . . . . . . 9.3 ttm180 -78.89 -27.05 43.91 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.473 -1.016 . . . . 3.0099999999999998 109.739 -179.917 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 336' ' ' GLU . . . . . . . . . . . . . 18.1 mt-10 -57.48 -68.21 0.26 Allowed 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.205 -0.935 . . . . 2.2799999999999998 109.805 -179.632 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 337' ' ' ARG . . . . . . . . . . . . . 5.7 mpt_? -60.13 -29.42 68.62 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.251 -0.906 . . . . 2.9300000000000002 109.584 -179.844 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 338' ' ' PHE . . . . . . . . . . . . . 69.1 t80 -54.03 -58.25 8.02 Favored 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.317 -0.864 . . . . 0.37 109.608 -179.774 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 339' ' ' GLU . . . . . . . . . . . . . 58.0 mt-10 -51.44 -34.43 35.12 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.381 -0.824 . . . . 1.98 110.2 -179.594 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 340' ' ' MET . . . . . . . . . . . . . 52.0 ttp -65.05 -49.74 68.9 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.204 -0.935 . . . . 0.32000000000000001 110.485 -179.258 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 341' ' ' PHE . . . . . . . . . . . . . 56.4 m-85 -62.1 -40.43 95.85 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.144 -0.972 . . . . 0.17999999999999999 109.942 -179.343 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 342' ' ' ARG . . . . . . . . . . . . . 23.8 ttt180 -50.66 -47.51 58.62 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.217 -0.927 . . . . 2.4199999999999999 110.18 -179.596 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 343' ' ' GLU . . . . . . . . . . . . . 11.8 tp10 -59.96 -42.42 94.07 Favored 'General case' 0 N--CA 1.494 1.759 0 O-C-N 121.218 -0.927 . . . . 2.3500000000000001 110.142 -179.304 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 344' ' ' LEU . . . . . . . . . . . . . 45.2 mt -62.21 -37.1 84.06 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.106 -0.996 . . . . 0.17999999999999999 110.039 -179.5 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 345' ' ' ASN . . . . . 0.54 HD22 HD11 ' D' ' 330' ' ' LEU . 50.8 t-20 -58.17 -53.58 56.61 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.155 -0.965 . . . . 1.0900000000000001 110.008 -179.618 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 346' ' ' GLU . . . . . . . . . . . . . 1.2 tt0 -61.27 -31.2 71.02 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.249 -0.907 . . . . 1.6599999999999999 109.789 -179.611 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 347' ' ' ALA . . . . . 0.949 ' HB1' ' HB1' ' A' ' 347' ' ' ALA . . . -61.14 -57.67 11.54 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.216 -0.928 . . . . 0.17000000000000001 110.308 -179.525 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 348' ' ' LEU . . . . . 0.53 HD22 ' N ' ' B' ' 348' ' ' LEU . 3.8 mm? -60.96 -45.16 95.84 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.257 -0.902 . . . . 0.28999999999999998 110.127 -179.412 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 349' ' ' GLU . . . . . . . . . . . . . 77.9 mt-10 -57.99 -35.36 71.1 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.11 -0.994 . . . . 1.95 110.056 -179.482 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 350' ' ' LEU . . . . . 0.735 HD13 HD22 ' A' ' 350' ' ' LEU . 6.9 tt -63.28 -48.29 78.74 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.145 -0.972 . . . . 0.45000000000000001 109.451 -179.828 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 351' ' ' LYS . . . . . . . . . . . . . 45.9 tttm -59.24 -42.34 90.87 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.275 -0.89 . . . . 1.3799999999999999 109.835 -179.734 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 352' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -58.63 -37.88 76.87 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.167 -0.958 . . . . 1.1599999999999999 109.668 -179.982 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 353' ' ' ALA . . . . . . . . . . . . . . . -67.84 -22.17 65.15 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.362 -0.836 . . . . 0.60999999999999999 109.728 -179.386 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 354' ' ' GLN . . . . . . . . . . . . . 8.5 mt-30 . . . . . 0 N--CA 1.49 1.571 0 O-C-N 121.148 -0.97 . . . . 1.45 109.471 -179.844 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' C' C ' 326' ' ' GLU . . . . . . . . . . . . . 16.7 mt-10 . . . . . 0 N--CA 1.489 1.475 0 N-CA-C 108.884 -0.784 . . . . 2.1699999999999999 108.884 . . . . . . . . . 0 0 . 1 . 019 nuclear build core ' C' C ' 327' ' ' TYR . . . . . 0.629 ' CE1' ' CG ' ' A' ' 333' ' ' ARG . 43.8 m-85 -149.72 113.63 5.1 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.025 -1.047 . . . . 0.47999999999999998 109.827 -179.824 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' C' C ' 328' ' ' PHE . . . . . . . . . . . . . 97.6 m-85 -113.03 -166.53 1.09 Allowed 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.162 -0.961 . . . . 0.33000000000000002 109.726 179.718 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' C' C ' 329' ' ' THR . . . . . 0.405 ' HA ' ' O ' ' A' ' 330' ' ' LEU . 27.2 p -153.32 167.14 30.37 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.212 -0.93 . . . . 0.23000000000000001 109.564 -179.721 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' C' C ' 330' ' ' LEU . . . . . 0.552 HD11 HD22 ' A' ' 345' ' ' ASN . 18.4 tp -150.26 124.93 9.72 Favored 'General case' 0 N--CA 1.488 1.43 0 O-C-N 121.194 -0.941 . . . . 0.28000000000000003 109.707 -179.727 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' C' C ' 331' ' ' GLN . . . . . 0.481 ' OE1' ' O ' ' A' ' 328' ' ' PHE . 7.2 tp-100 -89.23 109.01 19.94 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.245 -0.91 . . . . 1.48 109.14 179.794 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' C' C ' 332' ' ' ILE . . . . . 0.433 HD13 ' CD2' ' C' ' 341' ' ' PHE . 93.9 mt -102.78 113.75 40.35 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.647 0 O-C-N 121.081 -1.012 . . . . 0.23999999999999999 109.737 -179.722 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' C' C ' 333' ' ' ARG . . . . . 0.449 ' HG2' ' CE1' ' A' ' 327' ' ' TYR . 0.6 OUTLIER -73.53 148.75 42.77 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.295 -0.878 . . . . 2.7400000000000002 109.6 179.81 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' C' C ' 334' ' ' GLY . . . . . . . . . . . . . . . 70.89 134.57 0.11 Allowed Glycine 0 N--CA 1.492 2.385 0 N-CA-C 109.677 -1.369 . . . . 0.34999999999999998 109.677 179.958 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' C' C ' 335' ' ' ARG . . . . . 0.55 ' NH1' ' HG2' ' C' ' 335' ' ' ARG . 0.0 OUTLIER -75.34 -26.33 58.51 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.329 -1.1 . . . . 2.5299999999999998 109.622 -179.985 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' C' C ' 336' ' ' GLU . . . . . . . . . . . . . 9.2 tt0 -54.2 -65.06 0.64 Allowed 'General case' 0 C--N 1.301 -1.535 0 O-C-N 121.192 -0.943 . . . . 2.6200000000000001 109.561 -179.509 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' C' C ' 337' ' ' ARG . . . . . 0.515 ' CZ ' ' OD2' ' A' ' 352' ' ' ASP . 2.0 mpt_? -59.58 -28.45 67.16 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.259 -0.9 . . . . 2.8100000000000001 109.206 179.874 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' C' C ' 338' ' ' PHE . . . . . 0.474 ' HB3' ' O ' ' C' ' 335' ' ' ARG . 84.5 t80 -56.53 -64.54 0.83 Allowed 'General case' 0 N--CA 1.489 1.5 0 O-C-N 121.451 -0.781 . . . . 0.40000000000000002 110.026 -179.813 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' C' C ' 339' ' ' GLU . . . . . 0.458 ' OE2' ' HG2' ' C' ' 335' ' ' ARG . 10.6 mt-10 -48.66 -37.0 17.24 Favored 'General case' 0 N--CA 1.495 1.802 0 O-C-N 121.132 -0.98 . . . . 2.0499999999999998 110.398 -179.45 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' C' C ' 340' ' ' MET . . . . . . . . . . . . . 30.9 ttp -61.46 -49.63 76.04 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.054 -1.029 . . . . 0.32000000000000001 109.727 -179.542 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' C' C ' 341' ' ' PHE . . . . . 0.433 ' CD2' HD13 ' C' ' 332' ' ' ILE . 44.2 m-85 -64.16 -41.1 97.29 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.207 -0.933 . . . . 0.17999999999999999 110.161 -179.79 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' C' C ' 342' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -52.47 -48.02 66.15 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.258 -0.901 . . . . 2.9100000000000001 110.032 -179.63 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' C' C ' 343' ' ' GLU . . . . . . . . . . . . . 14.4 tt0 -57.76 -45.93 85.23 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.345 -0.847 . . . . 2.1400000000000001 110.063 -179.593 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' C' C ' 344' ' ' LEU . . . . . 0.432 ' O ' HD23 ' C' ' 348' ' ' LEU . 94.6 mt -63.06 -33.69 75.98 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.09 -1.006 . . . . 0.22 109.693 -179.729 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' C' C ' 345' ' ' ASN . . . . . 0.497 HD22 HD11 ' A' ' 330' ' ' LEU . 50.5 t-20 -59.48 -56.82 17.11 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.126 -0.984 . . . . 1.0800000000000001 109.498 -179.995 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' C' C ' 346' ' ' GLU . . . . . . . . . . . . . 5.9 tp10 -61.97 -26.71 68.37 Favored 'General case' 0 C--N 1.302 -1.475 0 O-C-N 121.202 -0.936 . . . . 2.21 109.515 179.942 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' C' C ' 347' ' ' ALA . . . . . 0.96 ' HB1' ' HB1' ' D' ' 347' ' ' ALA . . . -64.07 -61.27 2.37 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.214 -0.929 . . . . 0.17999999999999999 110.041 -179.799 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' C' C ' 348' ' ' LEU . . . . . 0.585 ' N ' HD22 ' C' ' 348' ' ' LEU . 3.9 mm? -60.5 -50.53 73.18 Favored 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.319 -0.863 . . . . 0.32000000000000001 110.241 -179.051 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' C' C ' 349' ' ' GLU . . . . . . . . . . . . . 16.0 mm-40 -58.87 -34.52 71.71 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.233 -0.917 . . . . 2.1899999999999999 109.998 -179.406 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' C' C ' 350' ' ' LEU . . . . . 0.74 HD21 HD22 ' D' ' 350' ' ' LEU . 3.5 tt -64.66 -37.97 89.39 Favored 'General case' 0 C--N 1.302 -1.493 0 O-C-N 121.049 -1.032 . . . . 0.46000000000000002 109.378 -179.942 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' C' C ' 351' ' ' LYS . . . . . 0.446 ' HE2' ' OE2' ' D' ' 343' ' ' GLU . 11.3 tttp -58.55 -40.2 82.37 Favored 'General case' 0 N--CA 1.488 1.455 0 O-C-N 121.254 -0.904 . . . . 1.3500000000000001 108.884 179.752 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' C' C ' 352' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 -56.63 -43.75 80.57 Favored 'General case' 0 C--N 1.304 -1.403 0 O-C-N 121.432 -0.792 . . . . 1.1899999999999999 109.423 179.612 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' C' C ' 353' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 1.652 0 O-C-N 121.379 -0.825 . . . . 0.56999999999999995 110.047 -179.764 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' D' D ' 326' ' ' GLU . . . . . . . . . . . . . 3.4 mt-10 . . . . . 0 N--CA 1.489 1.513 0 CA-C-O 121.356 0.598 . . . . 2.1299999999999999 109.765 . . . . . . . . . 0 0 . 1 . 019 nuclear build core ' D' D ' 327' ' ' TYR . . . . . 0.577 ' CE1' ' CG ' ' B' ' 333' ' ' ARG . 44.6 m-85 -149.03 112.26 4.94 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.446 -0.784 . . . . 0.46999999999999997 109.476 -179.937 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' D' D ' 328' ' ' PHE . . . . . . . . . . . . . 83.0 m-85 -113.49 -170.85 1.77 Allowed 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.317 -0.864 . . . . 0.29999999999999999 109.426 -179.841 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' D' D ' 329' ' ' THR . . . . . . . . . . . . . 38.6 p -153.4 169.37 23.3 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.241 -0.912 . . . . 0.22 109.598 -179.864 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' D' D ' 330' ' ' LEU . . . . . 0.54 HD11 HD22 ' B' ' 345' ' ' ASN . 33.5 tp -152.56 128.89 10.56 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.228 -0.92 . . . . 0.28000000000000003 110.267 179.968 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' D' D ' 331' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -88.27 109.21 19.77 Favored 'General case' 0 N--CA 1.491 1.602 0 N-CA-C 108.806 -0.813 . . . . 0.93000000000000005 108.806 179.125 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' D' D ' 332' ' ' ILE . . . . . . . . . . . . . 20.2 mt -102.18 104.98 17.24 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.495 0 O-C-N 121.146 -0.971 . . . . 0.25 109.817 -179.646 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' D' D ' 333' ' ' ARG . . . . . 0.583 ' CG ' ' CE1' ' B' ' 327' ' ' TYR . 0.0 OUTLIER -72.23 151.87 42.58 Favored 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.323 -0.861 . . . . 2.9300000000000002 109.141 179.553 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' D' D ' 334' ' ' GLY . . . . . . . . . . . . . . . 78.23 128.57 0.48 Allowed Glycine 0 N--CA 1.49 2.258 0 N-CA-C 109.689 -1.365 . . . . 0.40999999999999998 109.689 179.963 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' D' D ' 335' ' ' ARG . . . . . . . . . . . . . 8.8 ttm180 -78.99 -28.25 43.45 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.414 -1.05 . . . . 3.0299999999999998 109.858 -179.903 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' D' D ' 336' ' ' GLU . . . . . . . . . . . . . 12.8 mt-10 -57.08 -68.05 0.26 Allowed 'General case' 0 N--CA 1.495 1.786 0 O-C-N 121.301 -0.874 . . . . 2.2599999999999998 109.772 -179.551 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' D' D ' 337' ' ' ARG . . . . . . . . . . . . . 5.8 mpt_? -59.87 -29.98 68.69 Favored 'General case' 0 N--CA 1.488 1.446 0 O-C-N 121.271 -0.893 . . . . 2.9199999999999999 109.665 -179.81 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' D' D ' 338' ' ' PHE . . . . . . . . . . . . . 70.5 t80 -54.09 -58.59 6.76 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.256 -0.902 . . . . 0.37 109.566 -179.88 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' D' D ' 339' ' ' GLU . . . . . . . . . . . . . 55.3 mt-10 -51.05 -34.81 31.39 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.333 -0.854 . . . . 1.99 110.059 -179.721 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' D' D ' 340' ' ' MET . . . . . . . . . . . . . 51.9 ttp -64.64 -49.42 71.11 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.156 -0.965 . . . . 0.31 110.26 -179.116 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' D' D ' 341' ' ' PHE . . . . . 0.426 ' HA ' HD12 ' D' ' 344' ' ' LEU . 55.8 m-85 -62.25 -42.82 99.66 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.073 -1.017 . . . . 0.17999999999999999 110.125 -179.403 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' D' D ' 342' ' ' ARG . . . . . . . . . . . . . 23.2 ttt180 -48.8 -47.03 42.43 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.183 -0.948 . . . . 2.4100000000000001 110.166 -179.705 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' D' D ' 343' ' ' GLU . . . . . 0.446 ' OE2' ' HE2' ' C' ' 351' ' ' LYS . 13.9 tp10 -60.05 -42.8 95.26 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.04 -1.038 . . . . 2.3500000000000001 110.012 -179.447 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' D' D ' 344' ' ' LEU . . . . . 0.426 HD12 ' HA ' ' D' ' 341' ' ' PHE . 38.0 mt -61.68 -37.38 83.9 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.128 -0.982 . . . . 0.19 109.956 -179.476 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' D' D ' 345' ' ' ASN . . . . . 0.542 HD22 HD11 ' B' ' 330' ' ' LEU . 51.5 t-20 -58.17 -52.6 64.89 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.071 -1.018 . . . . 1.0900000000000001 109.935 -179.539 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' D' D ' 346' ' ' GLU . . . . . . . . . . . . . 1.3 tt0 -61.44 -32.11 72.07 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.21 -0.931 . . . . 1.6899999999999999 109.862 -179.65 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' D' D ' 347' ' ' ALA . . . . . 0.96 ' HB1' ' HB1' ' C' ' 347' ' ' ALA . . . -60.87 -57.73 11.43 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.219 -0.926 . . . . 0.17999999999999999 110.249 -179.7 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' D' D ' 348' ' ' LEU . . . . . 0.544 HD22 ' N ' ' D' ' 348' ' ' LEU . 3.7 mm? -60.99 -44.24 97.69 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.077 -1.014 . . . . 0.31 110.038 -179.301 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' D' D ' 349' ' ' GLU . . . . . . . . . . . . . 71.8 mt-10 -58.51 -35.01 71.59 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.043 -1.036 . . . . 1.95 110.075 -179.32 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' D' D ' 350' ' ' LEU . . . . . 0.74 HD22 HD21 ' C' ' 350' ' ' LEU . 6.6 tt -63.75 -48.01 78.71 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.011 -1.056 . . . . 0.42999999999999999 109.594 -179.796 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' D' D ' 351' ' ' LYS . . . . . . . . . . . . . 48.4 tttm -58.55 -42.91 88.94 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.32 -0.862 . . . . 1.3999999999999999 109.715 -179.835 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' D' D ' 352' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -58.58 -37.03 74.91 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.093 -1.004 . . . . 1.1699999999999999 109.698 -179.977 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' D' D ' 353' ' ' ALA . . . . . . . . . . . . . . . -68.1 -22.65 64.89 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.204 -0.935 . . . . 0.58999999999999997 110.003 -179.5 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' D' D ' 354' ' ' GLN . . . . . . . . . . . . . 9.5 mt-30 . . . . . 0 N--CA 1.49 1.562 0 O-C-N 121.107 -0.996 . . . . 1.4399999999999999 109.677 -179.707 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 326' ' ' GLU . . . . . . . . . . . . . 2.1 mm-40 . . . . . 0 N--CA 1.489 1.511 0 N-CA-C 109.14 -0.689 . . . . 2.1299999999999999 109.14 . . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 327' ' ' TYR . . . . . 0.607 ' CE1' ' HG3' ' C' ' 333' ' ' ARG . 51.0 m-85 -148.5 108.9 4.14 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.408 -0.808 . . . . 0.47999999999999998 109.411 -179.829 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 328' ' ' PHE . . . . . 0.443 ' O ' HG23 ' A' ' 329' ' ' THR . 83.4 m-85 -113.42 -165.97 1.05 Allowed 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.414 -0.804 . . . . 0.31 109.592 179.98 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 329' ' ' THR . . . . . 0.443 HG23 ' O ' ' A' ' 328' ' ' PHE . 22.2 p -154.75 167.68 29.38 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.295 -0.878 . . . . 0.22 109.432 -179.839 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 330' ' ' LEU . . . . . . . . . . . . . 25.0 tp -150.49 127.05 10.83 Favored 'General case' 0 C--N 1.302 -1.5 0 O-C-N 121.248 -0.907 . . . . 0.28000000000000003 109.917 -179.787 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 331' ' ' GLN . . . . . . . . . . . . . 1.2 tp60 -86.32 108.4 18.41 Favored 'General case' 0 C--N 1.303 -1.451 0 O-C-N 121.257 -0.902 . . . . 0.91000000000000003 108.854 179.144 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 332' ' ' ILE . . . . . 0.423 HG21 ' CD2' ' A' ' 341' ' ' PHE . 21.1 mt -102.83 112.94 38.04 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.516 0 O-C-N 121.311 -0.868 . . . . 0.26000000000000001 109.509 -179.802 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 333' ' ' ARG . . . . . 0.406 ' HG2' ' CE2' ' C' ' 327' ' ' TYR . 54.9 mtm180 -72.84 154.91 40.41 Favored 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.491 -0.756 . . . . 2.9199999999999999 109.535 179.845 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 334' ' ' GLY . . . . . . . . . . . . . . . 75.98 129.28 0.29 Allowed Glycine 0 N--CA 1.49 2.254 0 N-CA-C 109.728 -1.349 . . . . 0.40000000000000002 109.728 179.868 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 335' ' ' ARG . . . . . 0.568 ' HB2' ' CZ ' ' C' ' 328' ' ' PHE . 31.3 ttp180 -78.91 -32.45 45.69 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.107 -1.231 . . . . 3.0099999999999998 109.305 179.705 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 336' ' ' GLU . . . . . . . . . . . . . 1.9 tt0 -57.48 -62.99 1.39 Allowed 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.34 -0.85 . . . . 2.29 109.634 -179.799 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 337' ' ' ARG . . . . . 0.461 ' CG ' ' NH1' ' A' ' 337' ' ' ARG . 0.0 OUTLIER -59.2 -29.05 67.2 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.257 -0.902 . . . . 2.9300000000000002 109.446 -179.651 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 338' ' ' PHE . . . . . 0.444 ' HB3' ' O ' ' A' ' 335' ' ' ARG . 75.5 t80 -54.76 -57.19 12.51 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.37 -0.831 . . . . 0.38 109.833 -179.872 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 339' ' ' GLU . . . . . . . . . . . . . 3.2 mt-10 -52.27 -33.47 42.08 Favored 'General case' 0 N--CA 1.493 1.692 0 O-C-N 121.205 -0.934 . . . . 1.97 109.678 -179.757 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 340' ' ' MET . . . . . . . . . . . . . 31.0 ttp -63.27 -50.2 71.08 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.482 -0.761 . . . . 0.31 109.947 -179.753 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 341' ' ' PHE . . . . . 0.423 ' CD2' HG21 ' A' ' 332' ' ' ILE . 52.4 m-85 -62.46 -44.24 96.88 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.147 -0.97 . . . . 0.17999999999999999 109.792 -179.733 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 342' ' ' ARG . . . . . 0.446 ' CG ' HH11 ' A' ' 342' ' ' ARG . 0.1 OUTLIER -51.82 -43.16 63.01 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.319 -0.863 . . . . 2.4199999999999999 109.866 -179.885 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 343' ' ' GLU . . . . . . . . . . . . . 1.8 tt0 -59.14 -48.37 81.86 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.254 -0.904 . . . . 2.3500000000000001 110.281 -179.597 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 344' ' ' LEU . . . . . 0.403 HD23 ' HA ' ' A' ' 344' ' ' LEU . 74.4 mt -62.07 -32.85 73.43 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.121 -0.987 . . . . 0.17999999999999999 109.244 -179.75 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 345' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -59.68 -52.35 65.87 Favored 'General case' 0 C--N 1.301 -1.523 0 O-C-N 121.364 -0.835 . . . . 1.0900000000000001 109.823 -179.908 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 346' ' ' GLU . . . . . . . . . . . . . 41.9 tt0 -62.44 -27.04 68.83 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.138 -0.976 . . . . 1.6499999999999999 109.568 -179.736 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 347' ' ' ALA . . . . . 0.852 ' HB1' ' HB1' ' B' ' 347' ' ' ALA . . . -62.44 -59.7 4.6 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.441 -0.787 . . . . 0.17999999999999999 109.941 -179.808 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 348' ' ' LEU . . . . . 0.589 HD22 ' N ' ' A' ' 348' ' ' LEU . 3.5 mm? -61.13 -44.03 97.96 Favored 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.144 -0.973 . . . . 0.29999999999999999 109.849 -179.753 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 349' ' ' GLU . . . . . . . . . . . . . 3.5 mm-40 -56.75 -36.32 69.64 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.056 -1.028 . . . . 1.9399999999999999 109.683 -179.753 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 350' ' ' LEU . . . . . 0.579 HD13 HD22 ' B' ' 350' ' ' LEU . 5.9 tt -62.9 -45.05 94.33 Favored 'General case' 0 N--CA 1.489 1.488 0 O-C-N 120.942 -1.099 . . . . 0.46000000000000002 109.354 -179.904 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 351' ' ' LYS . . . . . . . . . . . . . 30.0 tttt -57.88 -48.22 80.48 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.223 -0.923 . . . . 1.3999999999999999 109.584 -179.843 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 352' ' ' ASP . . . . . . . . . . . . . 62.4 m-20 -59.88 -39.03 83.91 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.254 -0.904 . . . . 1.1599999999999999 109.818 -179.809 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 353' ' ' ALA . . . . . . . . . . . . . . . -67.48 -18.16 64.96 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.296 -0.878 . . . . 0.63 110.038 -179.372 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 354' ' ' GLN . . . . . . . . . . . . . 4.1 mt-30 . . . . . 0 N--CA 1.49 1.565 0 O-C-N 121.268 -0.895 . . . . 1.47 109.531 -179.985 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' B' B ' 326' ' ' GLU . . . . . . . . . . . . . 2.2 mm-40 . . . . . 0 N--CA 1.49 1.553 0 CA-C-O 121.439 0.637 . . . . 2.1299999999999999 109.659 . . . . . . . . . 0 0 . 1 . 020 nuclear build core ' B' B ' 327' ' ' TYR . . . . . . . . . . . . . 51.3 m-85 -148.84 109.27 4.17 Favored 'General case' 0 C--N 1.301 -1.531 0 O-C-N 120.998 -1.064 . . . . 0.47999999999999998 109.388 -179.997 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 328' ' ' PHE . . . . . 0.439 ' CE2' ' HB2' ' D' ' 335' ' ' ARG . 79.3 m-85 -113.62 -167.89 1.27 Allowed 'General case' 0 N--CA 1.488 1.443 0 O-C-N 121.217 -0.927 . . . . 0.32000000000000001 109.451 179.898 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 329' ' ' THR . . . . . 0.409 ' HA ' ' O ' ' D' ' 330' ' ' LEU . 27.4 p -152.57 167.25 29.48 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.505 -0.747 . . . . 0.23000000000000001 109.41 179.808 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 330' ' ' LEU . . . . . 0.416 ' O ' ' HA ' ' D' ' 329' ' ' THR . 30.7 tp -149.26 126.22 11.25 Favored 'General case' 0 N--CA 1.488 1.434 0 O-C-N 121.202 -0.936 . . . . 0.28000000000000003 109.817 -179.785 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 331' ' ' GLN . . . . . . . . . . . . . 1.4 tp60 -85.75 107.93 17.83 Favored 'General case' 0 C--N 1.304 -1.41 0 O-C-N 121.211 -0.931 . . . . 0.91000000000000003 108.773 179.325 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 332' ' ' ILE . . . . . . . . . . . . . 24.7 mt -103.17 113.96 41.43 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.493 0 O-C-N 121.094 -1.004 . . . . 0.23999999999999999 109.585 -179.417 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 333' ' ' ARG . . . . . . . . . . . . . 54.7 mtm180 -73.62 153.99 39.94 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.388 -0.82 . . . . 2.9300000000000002 109.648 179.85 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 334' ' ' GLY . . . . . . . . . . . . . . . 77.5 129.47 0.44 Allowed Glycine 0 N--CA 1.488 2.109 0 N-CA-C 109.834 -1.306 . . . . 0.40000000000000002 109.834 179.577 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 335' ' ' ARG . . . . . 0.413 ' O ' ' HB3' ' B' ' 338' ' ' PHE . 32.3 ttp180 -79.82 -32.78 40.67 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.431 -1.04 . . . . 3.0099999999999998 109.303 -179.977 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 336' ' ' GLU . . . . . . . . . . . . . 2.4 tt0 -57.92 -62.2 1.98 Allowed 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.518 -0.739 . . . . 2.2799999999999998 109.795 179.884 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 337' ' ' ARG . . . . . 0.468 ' NH1' ' CG ' ' B' ' 337' ' ' ARG . 0.0 OUTLIER -59.25 -29.0 67.23 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.372 -0.83 . . . . 2.9300000000000002 109.588 179.953 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' B' B ' 338' ' ' PHE . . . . . 0.413 ' HB3' ' O ' ' B' ' 335' ' ' ARG . 73.5 t80 -55.36 -57.21 12.76 Favored 'General case' 0 N--CA 1.487 1.405 0 O-C-N 121.289 -0.882 . . . . 0.37 109.502 -179.941 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 339' ' ' GLU . . . . . . . . . . . . . 3.1 mt-10 -51.95 -33.7 38.8 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.259 -0.901 . . . . 1.98 109.777 -179.719 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 340' ' ' MET . . . . . . . . . . . . . 31.3 ttp -63.18 -50.79 68.95 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.298 -0.876 . . . . 0.32000000000000001 110.23 -179.458 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 341' ' ' PHE . . . . . . . . . . . . . 51.8 m-85 -62.49 -43.35 99.02 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.02 -1.05 . . . . 0.17999999999999999 109.551 -179.484 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 342' ' ' ARG . . . . . 0.45 ' CG ' HH11 ' B' ' 342' ' ' ARG . 0.0 OUTLIER -51.63 -43.82 62.72 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.452 -0.78 . . . . 2.4199999999999999 109.813 -179.887 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' B' B ' 343' ' ' GLU . . . . . . . . . . . . . 2.1 tt0 -59.05 -47.39 85.39 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.43 -0.794 . . . . 2.3500000000000001 110.154 -179.426 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 344' ' ' LEU . . . . . 0.418 ' HA ' HD23 ' B' ' 344' ' ' LEU . 76.3 mt -62.37 -33.38 74.63 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.094 -1.004 . . . . 0.17999999999999999 109.51 -179.913 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 345' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -59.32 -52.89 63.68 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.253 -0.905 . . . . 1.0900000000000001 109.87 -179.98 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 346' ' ' GLU . . . . . . . . . . . . . 45.3 tt0 -61.53 -28.3 69.22 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.101 -1.0 . . . . 1.6599999999999999 109.642 -179.769 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 347' ' ' ALA . . . . . 0.852 ' HB1' ' HB1' ' A' ' 347' ' ' ALA . . . -61.89 -58.59 7.34 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.354 -0.841 . . . . 0.17000000000000001 109.973 -179.829 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 348' ' ' LEU . . . . . 0.56 HD22 ' N ' ' B' ' 348' ' ' LEU . 3.5 mm? -62.38 -43.41 98.89 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.092 -1.005 . . . . 0.28999999999999998 109.715 -179.65 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 349' ' ' GLU . . . . . . . . . . . . . 3.7 mm-40 -56.78 -35.4 68.63 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.182 -0.949 . . . . 1.95 110.125 -179.424 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 350' ' ' LEU . . . . . 0.579 HD22 HD13 ' A' ' 350' ' ' LEU . 6.2 tt -64.04 -46.15 85.68 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.056 -1.028 . . . . 0.45000000000000001 109.704 -179.769 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 351' ' ' LYS . . . . . . . . . . . . . 33.6 tttt -56.77 -49.7 74.52 Favored 'General case' 0 N--CA 1.488 1.45 0 O-C-N 121.429 -0.794 . . . . 1.3799999999999999 109.388 -179.894 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 352' ' ' ASP . . . . . . . . . . . . . 60.6 m-20 -58.45 -39.67 80.52 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.278 -0.889 . . . . 1.1599999999999999 109.888 -179.895 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 353' ' ' ALA . . . . . . . . . . . . . . . -66.48 -20.48 66.05 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.341 -0.849 . . . . 0.60999999999999999 109.814 -179.545 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 354' ' ' GLN . . . . . . . . . . . . . 4.4 mt-30 . . . . . 0 N--CA 1.49 1.527 0 O-C-N 120.893 -1.129 . . . . 1.45 109.424 -179.925 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' C' C ' 326' ' ' GLU . . . . . . . . . . . . . 3.0 mm-40 . . . . . 0 N--CA 1.488 1.467 0 N-CA-C 109.099 -0.704 . . . . 2.1699999999999999 109.099 . . . . . . . . . 0 0 . 1 . 020 nuclear build core ' C' C ' 327' ' ' TYR . . . . . 0.406 ' CE2' ' HG2' ' A' ' 333' ' ' ARG . 47.4 m-85 -147.27 113.43 5.86 Favored 'General case' 0 C--N 1.3 -1.556 0 O-C-N 121.465 -0.772 . . . . 0.47999999999999998 109.003 179.822 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' C' C ' 328' ' ' PHE . . . . . 0.568 ' CZ ' ' HB2' ' A' ' 335' ' ' ARG . 86.3 m-85 -111.61 -167.95 1.25 Allowed 'General case' 0 C--N 1.303 -1.435 0 O-C-N 121.068 -1.02 . . . . 0.33000000000000002 109.578 -179.618 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' C' C ' 329' ' ' THR . . . . . . . . . . . . . 76.4 p -150.37 163.79 37.47 Favored 'General case' 0 N--CA 1.487 1.407 0 O-C-N 121.248 -0.908 . . . . 0.23000000000000001 109.387 -179.831 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' C' C ' 330' ' ' LEU . . . . . . . . . . . . . 29.6 tp -150.07 130.04 13.44 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.434 -0.791 . . . . 0.28000000000000003 109.609 -179.623 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' C' C ' 331' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -85.37 115.14 22.94 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.258 -0.901 . . . . 1.48 109.234 179.847 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' C' C ' 332' ' ' ILE . . . . . 0.911 HG21 ' HA ' ' C' ' 338' ' ' PHE . 50.8 mt -103.88 99.88 9.31 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.482 0 O-C-N 121.165 -0.959 . . . . 0.23999999999999999 109.916 -179.768 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' C' C ' 333' ' ' ARG . . . . . 0.607 ' HG3' ' CE1' ' A' ' 327' ' ' TYR . 0.0 OUTLIER -71.48 144.69 49.59 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.132 -0.98 . . . . 2.7400000000000002 109.527 179.892 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' C' C ' 334' ' ' GLY . . . . . . . . . . . . . . . 86.99 126.75 2.18 Favored Glycine 0 N--CA 1.492 2.394 0 N-CA-C 109.379 -1.488 . . . . 0.34999999999999998 109.379 -179.991 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' C' C ' 335' ' ' ARG . . . . . 0.417 ' CG ' HH11 ' C' ' 335' ' ' ARG . 0.0 OUTLIER -77.86 -32.34 51.98 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.332 -1.099 . . . . 2.5299999999999998 109.848 -179.865 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' C' C ' 336' ' ' GLU . . . . . . . . . . . . . 1.6 mt-10 -59.84 -62.58 1.77 Allowed 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.02 -1.05 . . . . 2.6200000000000001 110.062 -179.672 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' C' C ' 337' ' ' ARG . . . . . . . . . . . . . 10.5 mpt_? -62.08 -29.35 70.25 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.269 -0.895 . . . . 2.8100000000000001 110.263 -179.621 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' C' C ' 338' ' ' PHE . . . . . 0.911 ' HA ' HG21 ' C' ' 332' ' ' ILE . 68.1 t80 -52.4 -60.21 3.49 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.137 -0.977 . . . . 0.40000000000000002 109.621 -179.752 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' C' C ' 339' ' ' GLU . . . . . . . . . . . . . 3.6 mt-10 -51.89 -31.11 26.86 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.382 -0.824 . . . . 2.0499999999999998 109.882 -179.836 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' C' C ' 340' ' ' MET . . . . . . . . . . . . . 38.5 ttp -63.28 -52.72 60.83 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.232 -0.917 . . . . 0.32000000000000001 109.471 -179.847 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' C' C ' 341' ' ' PHE . . . . . . . . . . . . . 40.2 m-85 -60.69 -42.21 96.7 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.148 -0.97 . . . . 0.17999999999999999 109.735 -179.745 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' C' C ' 342' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -52.29 -43.08 64.27 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.215 -0.928 . . . . 2.9100000000000001 109.683 179.928 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' C' C ' 343' ' ' GLU . . . . . . . . . . . . . 7.5 tp10 -59.77 -45.51 92.03 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 120.912 -1.118 . . . . 2.1400000000000001 110.32 -179.49 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' C' C ' 344' ' ' LEU . . . . . . . . . . . . . 48.9 mt -62.5 -42.81 99.75 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.324 -0.86 . . . . 0.22 110.081 -179.387 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' C' C ' 345' ' ' ASN . . . . . . . . . . . . . 22.5 t-20 -54.12 -50.93 65.76 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.211 -0.931 . . . . 1.0800000000000001 109.627 -179.379 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' C' C ' 346' ' ' GLU . . . . . . . . . . . . . 1.2 tt0 -61.03 -36.36 79.35 Favored 'General case' 0 C--N 1.301 -1.514 0 O-C-N 121.521 -0.737 . . . . 2.21 109.919 -179.773 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' C' C ' 347' ' ' ALA . . . . . 0.876 ' HB1' ' HB1' ' D' ' 347' ' ' ALA . . . -58.88 -52.76 64.35 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.075 -1.016 . . . . 0.17999999999999999 110.1 -179.529 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' C' C ' 348' ' ' LEU . . . . . 0.529 ' N ' HD22 ' C' ' 348' ' ' LEU . 2.7 mm? -62.22 -40.6 96.65 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.327 -0.858 . . . . 0.32000000000000001 109.721 -179.768 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' C' C ' 349' ' ' GLU . . . . . . . . . . . . . 4.1 mt-10 -59.73 -36.77 77.26 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.138 -0.976 . . . . 2.1899999999999999 110.653 -179.247 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' C' C ' 350' ' ' LEU . . . . . 0.646 HD13 HD22 ' D' ' 350' ' ' LEU . 5.3 tt -62.61 -45.96 90.49 Favored 'General case' 0 N--CA 1.494 1.74 0 O-C-N 121.126 -0.984 . . . . 0.46000000000000002 109.726 -178.953 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' C' C ' 351' ' ' LYS . . . . . . . . . . . . . 24.2 tttm -59.65 -43.73 93.81 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.111 -0.993 . . . . 1.3500000000000001 109.903 -179.497 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' C' C ' 352' ' ' ASP . . . . . . . . . . . . . 13.2 m-20 -58.58 -32.16 68.69 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.06 -1.025 . . . . 1.1899999999999999 109.417 -179.616 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' C' C ' 353' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.301 -1.504 0 O-C-N 121.234 -0.916 . . . . 0.56999999999999995 110.378 -179.37 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' D' D ' 326' ' ' GLU . . . . . . . . . . . . . 1.6 mm-40 . . . . . 0 N--CA 1.486 1.37 0 N-CA-C 109.162 -0.681 . . . . 2.1299999999999999 109.162 . . . . . . . . . 0 0 . 1 . 020 nuclear build core ' D' D ' 327' ' ' TYR . . . . . . . . . . . . . 54.7 m-85 -148.26 109.42 4.32 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.183 -0.948 . . . . 0.46999999999999997 109.659 -179.854 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' D' D ' 328' ' ' PHE . . . . . . . . . . . . . 68.8 m-85 -114.37 -168.18 1.33 Allowed 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.504 -0.747 . . . . 0.29999999999999999 109.732 -179.878 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' D' D ' 329' ' ' THR . . . . . 0.416 ' HA ' ' O ' ' B' ' 330' ' ' LEU . 32.9 p -152.87 166.25 32.9 Favored 'General case' 0 N--CA 1.489 1.49 0 O-C-N 121.179 -0.95 . . . . 0.22 109.298 -179.829 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' D' D ' 330' ' ' LEU . . . . . 0.409 ' O ' ' HA ' ' B' ' 329' ' ' THR . 24.1 tp -148.32 125.99 11.8 Favored 'General case' 0 N--CA 1.488 1.461 0 O-C-N 121.297 -0.877 . . . . 0.28000000000000003 109.723 -179.734 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' D' D ' 331' ' ' GLN . . . . . . . . . . . . . 1.4 tp60 -85.36 108.69 17.95 Favored 'General case' 0 C--N 1.302 -1.473 0 O-C-N 121.314 -0.866 . . . . 0.93000000000000005 108.75 179.591 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' D' D ' 332' ' ' ILE . . . . . . . . . . . . . 31.9 mt -103.33 114.52 43.16 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.641 0 O-C-N 121.146 -0.971 . . . . 0.25 110.003 -179.498 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' D' D ' 333' ' ' ARG . . . . . . . . . . . . . 53.4 mtm180 -73.83 151.78 40.43 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.2 -0.938 . . . . 2.9300000000000002 109.839 179.932 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' D' D ' 334' ' ' GLY . . . . . . . . . . . . . . . 79.3 128.32 0.6 Allowed Glycine 0 N--CA 1.49 2.273 0 N-CA-C 109.894 -1.282 . . . . 0.40999999999999998 109.894 179.237 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' D' D ' 335' ' ' ARG . . . . . 0.439 ' HB2' ' CE2' ' B' ' 328' ' ' PHE . 33.2 ttp180 -78.75 -32.09 46.51 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.224 -1.162 . . . . 3.0299999999999998 109.356 179.904 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' D' D ' 336' ' ' GLU . . . . . . . . . . . . . 2.1 tt0 -58.02 -62.26 1.95 Allowed 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.344 -0.847 . . . . 2.2599999999999998 109.515 -179.993 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' D' D ' 337' ' ' ARG . . . . . 0.452 ' NH1' ' CG ' ' D' ' 337' ' ' ARG . 0.0 OUTLIER -59.38 -29.62 67.83 Favored 'General case' 0 C--N 1.301 -1.502 0 O-C-N 121.229 -0.919 . . . . 2.9199999999999999 109.719 -179.608 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' D' D ' 338' ' ' PHE . . . . . 0.42 ' HB3' ' O ' ' D' ' 335' ' ' ARG . 68.0 t80 -54.22 -56.44 18.24 Favored 'General case' 0 C--N 1.3 -1.574 0 O-C-N 121.491 -0.756 . . . . 0.37 109.429 179.953 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' D' D ' 339' ' ' GLU . . . . . . . . . . . . . 3.3 mt-10 -52.49 -34.65 50.36 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.022 -1.049 . . . . 1.99 109.924 -179.893 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' D' D ' 340' ' ' MET . . . . . . . . . . . . . 32.4 ttp -62.83 -50.24 71.75 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.137 -0.977 . . . . 0.31 110.143 -179.308 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' D' D ' 341' ' ' PHE . . . . . . . . . . . . . 46.8 m-85 -62.77 -44.24 96.7 Favored 'General case' 0 C--N 1.301 -1.511 0 O-C-N 120.944 -1.097 . . . . 0.17999999999999999 109.669 -179.484 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' D' D ' 342' ' ' ARG . . . . . 0.453 ' CG ' ' NH1' ' D' ' 342' ' ' ARG . 0.0 OUTLIER -51.9 -41.65 62.11 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.236 -0.915 . . . . 2.4100000000000001 109.821 -179.478 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' D' D ' 343' ' ' GLU . . . . . . . . . . . . . 3.6 tt0 -60.4 -46.62 89.32 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.183 -0.948 . . . . 2.3500000000000001 109.84 -179.346 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' D' D ' 344' ' ' LEU . . . . . 0.451 ' HA ' HD23 ' D' ' 344' ' ' LEU . 71.6 mt -62.44 -34.68 77.28 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.283 -0.886 . . . . 0.19 109.469 -179.844 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' D' D ' 345' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -58.49 -52.19 66.68 Favored 'General case' 0 C--N 1.302 -1.492 0 O-C-N 121.319 -0.863 . . . . 1.0900000000000001 109.723 -179.741 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' D' D ' 346' ' ' GLU . . . . . . . . . . . . . 42.7 tt0 -62.27 -29.25 70.29 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.39 -0.819 . . . . 1.6899999999999999 109.678 -179.68 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' D' D ' 347' ' ' ALA . . . . . 0.876 ' HB1' ' HB1' ' C' ' 347' ' ' ALA . . . -61.88 -57.23 12.6 Favored 'General case' 0 N--CA 1.493 1.713 0 O-C-N 121.421 -0.799 . . . . 0.17999999999999999 109.966 -179.614 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' D' D ' 348' ' ' LEU . . . . . 0.552 HD22 ' N ' ' D' ' 348' ' ' LEU . 3.4 mm? -63.16 -44.06 96.55 Favored 'General case' 0 N--CA 1.488 1.472 0 O-C-N 121.186 -0.946 . . . . 0.31 109.762 -179.804 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' D' D ' 349' ' ' GLU . . . . . . . . . . . . . 3.5 mm-40 -57.22 -34.13 68.24 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.109 -0.995 . . . . 1.95 110.066 -179.232 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' D' D ' 350' ' ' LEU . . . . . 0.646 HD22 HD13 ' C' ' 350' ' ' LEU . 6.2 tt -64.08 -46.13 85.64 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.181 -0.95 . . . . 0.42999999999999999 109.413 179.885 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' D' D ' 351' ' ' LYS . . . . . . . . . . . . . 42.0 tttt -57.6 -48.43 79.42 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.252 -0.905 . . . . 1.3999999999999999 109.59 -179.939 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' D' D ' 352' ' ' ASP . . . . . . . . . . . . . 72.4 m-20 -58.66 -38.89 79.13 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.401 -0.812 . . . . 1.1699999999999999 109.462 179.458 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' D' D ' 353' ' ' ALA . . . . . . . . . . . . . . . -67.65 -20.71 65.35 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.485 -0.759 . . . . 0.58999999999999997 109.958 -179.514 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' D' D ' 354' ' ' GLN . . . . . . . . . . . . . 5.5 mt-30 . . . . . 0 N--CA 1.491 1.611 0 O-C-N 121.365 -0.834 . . . . 1.4399999999999999 109.675 -179.887 . . . . . . . . 0 0 . 1 . 021 nuclear build core ' A' A ' 326' ' ' GLU . . . . . . . . . . . . . 7.1 mt-10 . . . . . 0 N--CA 1.49 1.535 0 CA-C-O 121.331 0.586 . . . . 2.1299999999999999 109.634 . . . . . . . . . 0 0 . 1 . 021 nuclear build core ' A' A ' 327' ' ' TYR . . . . . 0.575 ' CE1' ' HG2' ' C' ' 333' ' ' ARG . 41.4 m-85 -149.79 115.52 5.59 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.394 -0.816 . . . . 0.47999999999999998 109.628 179.975 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 328' ' ' PHE . . . . . 0.482 ' CE1' ' HA ' ' C' ' 335' ' ' ARG . 76.6 m-85 -113.51 -170.52 1.71 Allowed 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.36 -0.837 . . . . 0.31 109.385 179.928 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 329' ' ' THR . . . . . 0.405 HG23 ' O ' ' A' ' 328' ' ' PHE . 27.3 p -154.08 167.47 29.69 Favored 'General case' 0 N--CA 1.489 1.483 0 O-C-N 121.302 -0.874 . . . . 0.22 109.39 -179.849 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 330' ' ' LEU . . . . . . . . . . . . . 14.7 tp -148.51 126.9 12.27 Favored 'General case' 0 N--CA 1.489 1.487 0 O-C-N 121.251 -0.906 . . . . 0.28000000000000003 109.359 -179.944 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 331' ' ' GLN . . . . . . . . . . . . . 1.1 tp60 -86.95 111.38 20.78 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.236 -0.915 . . . . 0.91000000000000003 109.473 -179.996 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 332' ' ' ILE . . . . . . . . . . . . . 32.2 mt -103.61 110.26 29.47 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.501 0 O-C-N 121.245 -0.909 . . . . 0.26000000000000001 109.486 -179.946 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 333' ' ' ARG . . . . . 0.406 ' CG ' ' CE2' ' C' ' 327' ' ' TYR . 2.4 mpt_? -72.36 143.44 48.61 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.287 -0.883 . . . . 2.9199999999999999 109.241 179.793 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 334' ' ' GLY . . . . . . . . . . . . . . . 83.74 130.24 1.76 Allowed Glycine 0 N--CA 1.491 2.327 0 N-CA-C 109.525 -1.43 . . . . 0.40000000000000002 109.525 -179.869 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 335' ' ' ARG . . . . . 0.497 ' HB2' ' CZ ' ' C' ' 328' ' ' PHE . 6.1 ttm180 -79.07 -28.48 43.11 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.344 -1.092 . . . . 3.0099999999999998 109.622 -179.834 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 336' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -56.79 -67.16 0.34 Allowed 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.208 -0.933 . . . . 2.29 109.799 -179.701 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 337' ' ' ARG . . . . . 0.45 ' HG2' HH11 ' A' ' 337' ' ' ARG . 0.8 OUTLIER -60.38 -25.79 66.16 Favored 'General case' 0 N--CA 1.488 1.47 0 O-C-N 121.251 -0.905 . . . . 2.9300000000000002 109.68 -179.766 . . . . . . . . 3 3 . 1 . 021 nuclear build core ' A' A ' 338' ' ' PHE . . . . . 0.441 ' HB3' ' O ' ' A' ' 335' ' ' ARG . 67.6 t80 -55.39 -60.59 3.2 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.3 -0.875 . . . . 0.38 109.677 179.982 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 339' ' ' GLU . . . . . . . . . . . . . 79.0 mt-10 -51.36 -31.71 23.16 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.281 -0.887 . . . . 1.97 109.998 -179.738 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 340' ' ' MET . . . . . . . . . . . . . 9.5 ttp -63.27 -52.58 61.49 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.159 -0.963 . . . . 0.31 109.954 -179.575 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 341' ' ' PHE . . . . . . . . . . . . . 48.3 m-85 -61.85 -41.68 98.12 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.226 -0.921 . . . . 0.17999999999999999 109.74 -179.587 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 342' ' ' ARG . . . . . 0.488 ' HG2' ' NH1' ' A' ' 342' ' ' ARG . 0.0 OUTLIER -50.9 -41.73 58.74 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.17 -0.956 . . . . 2.4199999999999999 109.888 -179.867 . . . . . . . . 3 3 . 1 . 021 nuclear build core ' A' A ' 343' ' ' GLU . . . . . . . . . . . . . 28.3 tt0 -59.67 -50.71 72.78 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.235 -0.916 . . . . 2.3500000000000001 110.195 -179.544 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 344' ' ' LEU . . . . . 0.763 HD22 HD22 ' B' ' 344' ' ' LEU . 41.0 mt -61.29 -30.04 70.23 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.121 -0.987 . . . . 0.17999999999999999 109.92 -179.477 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 345' ' ' ASN . . . . . 0.462 ' HB2' HD21 ' C' ' 330' ' ' LEU . 29.3 t-20 -57.52 -56.96 15.18 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.235 -0.916 . . . . 1.0900000000000001 109.993 -179.659 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 346' ' ' GLU . . . . . . . . . . . . . 70.9 tt0 -61.47 -29.47 69.99 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.219 -0.926 . . . . 1.6499999999999999 110.183 -179.452 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 347' ' ' ALA . . . . . 0.896 ' HB1' ' HB1' ' B' ' 347' ' ' ALA . . . -60.07 -55.89 28.37 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.115 -0.991 . . . . 0.17999999999999999 110.066 -179.522 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 348' ' ' LEU . . . . . 0.582 HD22 ' N ' ' A' ' 348' ' ' LEU . 4.2 mm? -61.84 -44.62 96.47 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.257 -0.902 . . . . 0.29999999999999999 110.07 -179.434 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 349' ' ' GLU . . . . . 0.413 ' HG3' ' O ' ' A' ' 345' ' ' ASN . 55.8 mt-10 -57.4 -35.7 70.36 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.077 -1.015 . . . . 1.9399999999999999 109.945 -179.438 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 350' ' ' LEU . . . . . 0.602 HD22 HD22 ' B' ' 350' ' ' LEU . 6.1 tt -64.45 -40.41 95.68 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.208 -0.933 . . . . 0.46000000000000002 109.63 -179.765 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 351' ' ' LYS . . . . . . . . . . . . . 2.3 ttmt -57.67 -56.63 19.43 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.285 -0.884 . . . . 1.3999999999999999 109.895 -179.577 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 352' ' ' ASP . . . . . . . . . . . . . 11.8 m-20 -56.55 -37.54 70.66 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.155 -0.966 . . . . 1.1599999999999999 109.815 -179.842 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 353' ' ' ALA . . . . . . . . . . . . . . . -67.34 -26.35 66.45 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.228 -0.92 . . . . 0.63 110.183 -179.439 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 354' ' ' GLN . . . . . 0.498 ' OE1' HD11 ' B' ' 350' ' ' LEU . 3.3 mt-30 . . . . . 0 N--CA 1.49 1.555 0 O-C-N 121.023 -1.048 . . . . 1.47 109.797 -179.751 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B ' 326' ' ' GLU . . . . . . . . . . . . . 7.1 mt-10 . . . . . 0 N--CA 1.491 1.576 0 CA-C-O 121.338 0.59 . . . . 2.1299999999999999 109.625 . . . . . . . . . 0 0 . 1 . 021 nuclear build core ' B' B ' 327' ' ' TYR . . . . . 0.534 ' CE1' ' CG ' ' D' ' 333' ' ' ARG . 41.7 m-85 -149.84 115.42 5.55 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.339 -0.851 . . . . 0.47999999999999998 109.607 179.96 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' B' B ' 328' ' ' PHE . . . . . 0.482 ' CZ ' ' HB2' ' D' ' 335' ' ' ARG . 75.9 m-85 -113.54 -170.72 1.75 Allowed 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.352 -0.843 . . . . 0.32000000000000001 109.321 179.885 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' B' B ' 329' ' ' THR . . . . . 0.482 ' HA ' ' O ' ' D' ' 330' ' ' LEU . 27.7 p -153.89 167.64 29.02 Favored 'General case' 0 N--CA 1.488 1.471 0 O-C-N 121.311 -0.868 . . . . 0.23000000000000001 109.383 -179.978 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' B' B ' 330' ' ' LEU . . . . . 0.49 ' O ' ' HA ' ' D' ' 329' ' ' THR . 14.5 tp -148.74 126.06 11.54 Favored 'General case' 0 N--CA 1.488 1.45 0 O-C-N 121.207 -0.933 . . . . 0.28000000000000003 109.491 -179.859 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' B' B ' 331' ' ' GLN . . . . . . . . . . . . . 1.1 tt0 -86.24 111.32 20.31 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.243 -0.911 . . . . 0.91000000000000003 109.624 -179.905 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B ' 332' ' ' ILE . . . . . . . . . . . . . 31.9 mt -103.36 110.63 30.39 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.538 0 O-C-N 121.23 -0.919 . . . . 0.23999999999999999 109.564 179.922 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B ' 333' ' ' ARG . . . . . 0.595 ' CG ' ' CE1' ' D' ' 327' ' ' TYR . 2.4 mpt_? -72.57 143.53 48.23 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.19 -0.944 . . . . 2.9300000000000002 109.261 179.822 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' B' B ' 334' ' ' GLY . . . . . . . . . . . . . . . 83.55 130.04 1.67 Allowed Glycine 0 N--CA 1.49 2.254 0 N-CA-C 109.521 -1.431 . . . . 0.40000000000000002 109.521 -179.981 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B ' 335' ' ' ARG . . . . . 0.504 ' HB2' ' CZ ' ' D' ' 328' ' ' PHE . 6.2 ttm180 -78.68 -28.41 45.29 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.289 -1.124 . . . . 3.0099999999999998 109.737 -179.947 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' B' B ' 336' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -56.7 -67.42 0.31 Allowed 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.236 -0.915 . . . . 2.2799999999999998 109.796 -179.714 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' B' B ' 337' ' ' ARG . . . . . 0.438 ' HG2' HH11 ' B' ' 337' ' ' ARG . 0.8 OUTLIER -60.3 -25.52 65.81 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.271 -0.893 . . . . 2.9300000000000002 109.676 -179.798 . . . . . . . . 3 3 . 1 . 021 nuclear build core ' B' B ' 338' ' ' PHE . . . . . 0.437 ' HB3' ' O ' ' B' ' 335' ' ' ARG . 66.8 t80 -55.67 -60.7 3.07 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.221 -0.924 . . . . 0.37 109.517 -179.96 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' B' B ' 339' ' ' GLU . . . . . . . . . . . . . 79.1 mt-10 -51.32 -31.77 22.89 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.365 -0.834 . . . . 1.98 109.965 -179.673 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B ' 340' ' ' MET . . . . . . . . . . . . . 9.4 ttp -63.32 -52.52 61.54 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.149 -0.969 . . . . 0.32000000000000001 110.041 -179.597 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B ' 341' ' ' PHE . . . . . . . . . . . . . 48.3 m-85 -61.64 -42.14 98.48 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.167 -0.958 . . . . 0.17999999999999999 109.761 -179.695 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B ' 342' ' ' ARG . . . . . 0.494 ' NH1' ' HG2' ' B' ' 342' ' ' ARG . 0.0 OUTLIER -50.32 -42.03 52.13 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.334 -0.854 . . . . 2.4199999999999999 109.857 -179.894 . . . . . . . . 3 3 . 1 . 021 nuclear build core ' B' B ' 343' ' ' GLU . . . . . . . . . . . . . 27.3 tt0 -59.55 -50.7 72.88 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.255 -0.903 . . . . 2.3500000000000001 110.258 -179.411 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B ' 344' ' ' LEU . . . . . 0.763 HD22 HD22 ' A' ' 344' ' ' LEU . 40.0 mt -61.38 -29.82 70.15 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.127 -0.983 . . . . 0.17999999999999999 109.929 -179.537 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' B' B ' 345' ' ' ASN . . . . . 0.412 ' O ' ' HG3' ' B' ' 349' ' ' GLU . 29.2 t-20 -57.58 -57.0 14.67 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.245 -0.909 . . . . 1.0900000000000001 110.017 -179.688 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' B' B ' 346' ' ' GLU . . . . . . . . . . . . . 71.0 tt0 -61.5 -29.4 69.96 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.214 -0.928 . . . . 1.6599999999999999 110.246 -179.395 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B ' 347' ' ' ALA . . . . . 0.896 ' HB1' ' HB1' ' A' ' 347' ' ' ALA . . . -60.28 -55.78 29.56 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.136 -0.978 . . . . 0.17000000000000001 110.061 -179.516 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' B' B ' 348' ' ' LEU . . . . . 0.575 HD22 ' N ' ' B' ' 348' ' ' LEU . 4.2 mm? -61.82 -44.59 96.56 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.203 -0.936 . . . . 0.28999999999999998 110.005 -179.468 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' B' B ' 349' ' ' GLU . . . . . 0.412 ' HG3' ' O ' ' B' ' 345' ' ' ASN . 56.4 mt-10 -57.38 -35.78 70.42 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.172 -0.955 . . . . 1.95 109.946 -179.471 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' B' B ' 350' ' ' LEU . . . . . 0.602 HD22 HD22 ' A' ' 350' ' ' LEU . 6.1 tt -64.4 -40.28 95.48 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.269 -0.894 . . . . 0.45000000000000001 109.791 -179.826 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' B' B ' 351' ' ' LYS . . . . . . . . . . . . . 2.3 ttmt -57.87 -56.55 20.48 Favored 'General case' 0 N--CA 1.489 1.525 0 O-C-N 121.192 -0.943 . . . . 1.3799999999999999 109.915 -179.595 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B ' 352' ' ' ASP . . . . . . . . . . . . . 11.5 m-20 -56.69 -37.35 70.75 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.178 -0.951 . . . . 1.1599999999999999 109.791 -179.882 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B ' 353' ' ' ALA . . . . . . . . . . . . . . . -67.33 -26.28 66.42 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.208 -0.933 . . . . 0.60999999999999999 110.049 -179.513 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B ' 354' ' ' GLN . . . . . 0.556 ' OE1' HD11 ' A' ' 350' ' ' LEU . 3.3 mt-30 . . . . . 0 N--CA 1.491 1.594 0 O-C-N 121.05 -1.031 . . . . 1.45 109.936 -179.59 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' C' C ' 326' ' ' GLU . . . . . . . . . . . . . 2.3 mt-10 . . . . . 0 N--CA 1.489 1.51 0 CA-C-O 121.412 0.625 . . . . 2.1699999999999999 109.555 . . . . . . . . . 0 0 . 1 . 021 nuclear build core ' C' C ' 327' ' ' TYR . . . . . 0.406 ' CE2' ' CG ' ' A' ' 333' ' ' ARG . 37.2 m-85 -149.11 114.21 5.47 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.446 -0.784 . . . . 0.47999999999999998 109.463 179.809 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' C' C ' 328' ' ' PHE . . . . . 0.497 ' CZ ' ' HB2' ' A' ' 335' ' ' ARG . 77.0 m-85 -112.56 -170.54 1.68 Allowed 'General case' 0 N--CA 1.487 1.42 0 O-C-N 121.269 -0.895 . . . . 0.33000000000000002 108.951 179.677 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' C' C ' 329' ' ' THR . . . . . 0.423 HG23 ' O ' ' C' ' 328' ' ' PHE . 5.0 p -153.42 170.25 21.17 Favored 'General case' 0 C--N 1.301 -1.512 0 O-C-N 121.27 -0.894 . . . . 0.23000000000000001 109.226 179.957 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' C' C ' 330' ' ' LEU . . . . . 0.462 HD21 ' HB2' ' A' ' 345' ' ' ASN . 49.5 tp -149.12 134.49 18.44 Favored 'General case' 0 C--N 1.303 -1.454 0 O-C-N 121.213 -0.929 . . . . 0.28000000000000003 109.325 -179.77 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' C' C ' 331' ' ' GLN . . . . . . . . . . . . . 9.1 tp-100 -84.95 107.17 16.96 Favored 'General case' 0 N--CA 1.489 1.475 0 O-C-N 121.337 -0.852 . . . . 1.48 109.187 -179.994 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' C' C ' 332' ' ' ILE . . . . . 0.771 HG21 ' HA ' ' C' ' 338' ' ' PHE . 64.2 mt -103.05 100.39 10.31 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.505 0 O-C-N 121.162 -0.961 . . . . 0.23999999999999999 109.424 -179.897 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' C' C ' 333' ' ' ARG . . . . . 0.575 ' HG2' ' CE1' ' A' ' 327' ' ' TYR . 89.2 mtt180 -72.57 159.09 34.46 Favored 'General case' 0 N--CA 1.488 1.456 0 O-C-N 121.311 -0.868 . . . . 2.7400000000000002 109.289 179.725 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' C' C ' 334' ' ' GLY . . . . . . . . . . . . . . . 72.58 129.13 0.11 Allowed Glycine 0 N--CA 1.491 2.36 0 N-CA-C 109.39 -1.484 . . . . 0.34999999999999998 109.39 -179.788 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' C' C ' 335' ' ' ARG . . . . . 0.482 ' HA ' ' CE1' ' A' ' 328' ' ' PHE . 10.1 ttm180 -78.08 -30.89 49.86 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.245 -1.15 . . . . 2.5299999999999998 109.889 -179.769 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' C' C ' 336' ' ' GLU . . . . . . . . . . . . . 1.5 tt0 -58.95 -63.82 1.16 Allowed 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.227 -0.921 . . . . 2.6200000000000001 110.087 -179.591 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' C' C ' 337' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -59.09 -26.11 64.37 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.155 -0.965 . . . . 2.8100000000000001 109.802 -179.43 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' C' C ' 338' ' ' PHE . . . . . 0.771 ' HA ' HG21 ' C' ' 332' ' ' ILE . 81.3 t80 -54.78 -61.12 2.52 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.152 -0.968 . . . . 0.40000000000000002 109.662 -179.944 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' C' C ' 339' ' ' GLU . . . . . . . . . . . . . 22.9 mt-10 -50.97 -31.59 18.38 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.301 -0.874 . . . . 2.0499999999999998 109.995 -179.669 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' C' C ' 340' ' ' MET . . . . . . . . . . . . . 34.6 ttp -63.47 -52.85 59.6 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.173 -0.954 . . . . 0.32000000000000001 109.916 -179.564 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' C' C ' 341' ' ' PHE . . . . . . . . . . . . . 48.9 m-85 -62.08 -42.26 99.02 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.153 -0.967 . . . . 0.17999999999999999 109.848 -179.58 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' C' C ' 342' ' ' ARG . . . . . 0.451 HH11 ' CG ' ' C' ' 342' ' ' ARG . 0.2 OUTLIER -49.94 -45.39 51.19 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.358 -0.839 . . . . 2.9100000000000001 110.177 -179.574 . . . . . . . . 3 3 . 1 . 021 nuclear build core ' C' C ' 343' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -57.82 -48.71 78.97 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.137 -0.977 . . . . 2.1400000000000001 110.025 -179.332 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' C' C ' 344' ' ' LEU . . . . . 0.637 HD22 HD22 ' D' ' 344' ' ' LEU . 32.3 mt -62.69 -31.94 72.93 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.2 -0.938 . . . . 0.22 110.132 -179.549 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' C' C ' 345' ' ' ASN . . . . . . . . . . . . . 20.4 t-20 -57.63 -58.62 7.5 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.213 -0.929 . . . . 1.0800000000000001 109.57 -179.665 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' C' C ' 346' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -61.36 -26.08 67.59 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.317 -0.865 . . . . 2.21 109.669 -179.875 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' C' C ' 347' ' ' ALA . . . . . 0.772 ' HB1' ' HB1' ' D' ' 347' ' ' ALA . . . -60.42 -58.63 7.7 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.173 -0.954 . . . . 0.17999999999999999 109.772 -179.984 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' C' C ' 348' ' ' LEU . . . . . 0.579 ' N ' HD22 ' C' ' 348' ' ' LEU . 4.3 mm? -62.23 -40.54 96.47 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.237 -0.915 . . . . 0.32000000000000001 109.86 -179.658 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' C' C ' 349' ' ' GLU . . . . . . . . . . . . . 68.0 mm-40 -57.46 -37.09 72.31 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.186 -0.946 . . . . 2.1899999999999999 109.726 -179.63 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' C' C ' 350' ' ' LEU . . . . . 0.675 HD13 HD22 ' D' ' 350' ' ' LEU . 5.3 tt -63.02 -38.79 92.62 Favored 'General case' 0 N--CA 1.489 1.481 0 O-C-N 121.109 -0.994 . . . . 0.46000000000000002 109.065 179.929 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' C' C ' 351' ' ' LYS . . . . . . . . . . . . . 20.3 tttt -60.15 -37.12 79.15 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.351 -0.843 . . . . 1.3500000000000001 109.164 179.765 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' C' C ' 352' ' ' ASP . . . . . . . . . . . . . 8.5 m-20 -56.93 -41.91 79.07 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.31 -0.869 . . . . 1.1899999999999999 109.539 179.926 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' C' C ' 353' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 1.54 0 O-C-N 121.272 -0.892 . . . . 0.56999999999999995 109.575 -179.897 . . . . . . . . 0 0 . 1 . 021 nuclear build core ' D' D ' 326' ' ' GLU . . . . . . . . . . . . . 7.3 mt-10 . . . . . 0 N--CA 1.488 1.47 0 CA-C-O 121.324 0.583 . . . . 2.1299999999999999 109.655 . . . . . . . . . 0 0 . 1 . 021 nuclear build core ' D' D ' 327' ' ' TYR . . . . . 0.595 ' CE1' ' CG ' ' B' ' 333' ' ' ARG . 41.2 m-85 -149.96 115.52 5.53 Favored 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.354 -0.841 . . . . 0.46999999999999997 109.422 -179.973 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' D' D ' 328' ' ' PHE . . . . . 0.504 ' CZ ' ' HB2' ' B' ' 335' ' ' ARG . 76.4 m-85 -113.49 -170.71 1.74 Allowed 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.317 -0.864 . . . . 0.29999999999999999 109.313 179.934 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' D' D ' 329' ' ' THR . . . . . 0.49 ' HA ' ' O ' ' B' ' 330' ' ' LEU . 26.9 p -153.74 167.79 28.44 Favored 'General case' 0 N--CA 1.489 1.499 0 O-C-N 121.221 -0.924 . . . . 0.22 109.428 179.986 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' D' D ' 330' ' ' LEU . . . . . 0.482 ' O ' ' HA ' ' B' ' 329' ' ' THR . 14.7 tp -148.95 126.12 11.41 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.193 -0.942 . . . . 0.28000000000000003 109.478 -179.946 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' D' D ' 331' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -86.28 111.52 20.52 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.218 -0.926 . . . . 0.93000000000000005 109.55 -179.976 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' D' D ' 332' ' ' ILE . . . . . . . . . . . . . 31.8 mt -103.6 110.54 30.29 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.532 0 O-C-N 121.176 -0.953 . . . . 0.25 109.573 179.827 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' D' D ' 333' ' ' ARG . . . . . 0.534 ' CG ' ' CE1' ' B' ' 327' ' ' TYR . 2.4 mpt_? -72.69 143.22 48.16 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.313 -0.867 . . . . 2.9300000000000002 109.239 179.847 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' D' D ' 334' ' ' GLY . . . . . . . . . . . . . . . 84.21 129.91 1.86 Allowed Glycine 0 N--CA 1.49 2.274 0 N-CA-C 109.539 -1.425 . . . . 0.40999999999999998 109.539 -179.856 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' D' D ' 335' ' ' ARG . . . . . 0.482 ' HB2' ' CZ ' ' B' ' 328' ' ' PHE . 6.1 ttm180 -78.79 -28.65 44.63 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.193 -1.18 . . . . 3.0299999999999998 109.6 -179.949 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' D' D ' 336' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -56.53 -67.17 0.33 Allowed 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.201 -0.937 . . . . 2.2599999999999998 109.881 -179.779 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' D' D ' 337' ' ' ARG . . . . . 0.442 ' HG2' HH11 ' D' ' 337' ' ' ARG . 0.8 OUTLIER -60.53 -25.79 66.39 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.216 -0.927 . . . . 2.9199999999999999 109.651 -179.669 . . . . . . . . 3 3 . 1 . 021 nuclear build core ' D' D ' 338' ' ' PHE . . . . . 0.433 ' HB3' ' O ' ' D' ' 335' ' ' ARG . 67.8 t80 -55.47 -60.53 3.29 Favored 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.124 -0.985 . . . . 0.37 109.628 -179.968 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' D' D ' 339' ' ' GLU . . . . . . . . . . . . . 77.2 mt-10 -51.35 -31.84 23.51 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.305 -0.872 . . . . 1.99 109.998 -179.725 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' D' D ' 340' ' ' MET . . . . . . . . . . . . . 9.4 ttp -63.25 -52.65 61.24 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.132 -0.98 . . . . 0.31 109.959 -179.604 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' D' D ' 341' ' ' PHE . . . . . . . . . . . . . 48.6 m-85 -61.57 -41.86 98.01 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.183 -0.948 . . . . 0.17999999999999999 109.786 -179.633 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' D' D ' 342' ' ' ARG . . . . . 0.48 ' NH1' ' HG2' ' D' ' 342' ' ' ARG . 0.0 OUTLIER -50.72 -41.96 56.76 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.241 -0.912 . . . . 2.4100000000000001 109.845 -179.809 . . . . . . . . 3 3 . 1 . 021 nuclear build core ' D' D ' 343' ' ' GLU . . . . . . . . . . . . . 28.3 tt0 -59.54 -50.56 73.44 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.258 -0.901 . . . . 2.3500000000000001 110.251 -179.478 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' D' D ' 344' ' ' LEU . . . . . 0.637 HD22 HD22 ' C' ' 344' ' ' LEU . 40.3 mt -61.47 -29.85 70.22 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.143 -0.973 . . . . 0.19 109.834 -179.463 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' D' D ' 345' ' ' ASN . . . . . 0.417 ' O ' ' HG3' ' D' ' 349' ' ' GLU . 29.3 t-20 -57.59 -57.02 14.53 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.173 -0.954 . . . . 1.0900000000000001 110.002 -179.659 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' D' D ' 346' ' ' GLU . . . . . . . . . . . . . 70.6 tt0 -61.47 -29.56 70.04 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.182 -0.949 . . . . 1.6899999999999999 110.203 -179.427 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' D' D ' 347' ' ' ALA . . . . . 0.772 ' HB1' ' HB1' ' C' ' 347' ' ' ALA . . . -60.07 -55.69 30.89 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.059 -1.026 . . . . 0.17999999999999999 110.096 -179.562 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' D' D ' 348' ' ' LEU . . . . . 0.578 HD22 ' N ' ' D' ' 348' ' ' LEU . 4.2 mm? -62.07 -44.43 96.69 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.234 -0.916 . . . . 0.31 110.074 -179.409 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' D' D ' 349' ' ' GLU . . . . . 0.417 ' HG3' ' O ' ' D' ' 345' ' ' ASN . 56.9 mt-10 -57.64 -35.65 70.79 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.209 -0.932 . . . . 1.95 109.953 -179.479 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' D' D ' 350' ' ' LEU . . . . . 0.675 HD22 HD13 ' C' ' 350' ' ' LEU . 6.1 tt -64.49 -40.07 94.98 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.211 -0.93 . . . . 0.42999999999999999 109.736 -179.847 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' D' D ' 351' ' ' LYS . . . . . . . . . . . . . 2.3 ttmt -58.02 -56.35 23.2 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.282 -0.886 . . . . 1.3999999999999999 109.829 -179.633 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' D' D ' 352' ' ' ASP . . . . . . . . . . . . . 11.9 m-20 -56.97 -37.33 71.42 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.145 -0.972 . . . . 1.1699999999999999 109.773 -179.769 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' D' D ' 353' ' ' ALA . . . . . . . . . . . . . . . -67.4 -26.26 66.35 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.226 -0.921 . . . . 0.58999999999999997 110.065 -179.493 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' D' D ' 354' ' ' GLN . . . . . 0.433 ' OE1' HD11 ' C' ' 350' ' ' LEU . 3.3 mt-30 . . . . . 0 N--CA 1.491 1.619 0 O-C-N 121.042 -1.036 . . . . 1.4399999999999999 109.915 -179.723 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 326' ' ' GLU . . . . . . . . . . . . . 7.1 mt-10 . . . . . 0 N--CA 1.49 1.537 0 N-CA-C 109.404 -0.591 . . . . 2.1299999999999999 109.404 . . . . . . . . . 0 0 . 1 . 022 nuclear build core ' A' A ' 327' ' ' TYR . . . . . 0.611 ' CE1' ' HG2' ' C' ' 333' ' ' ARG . 45.4 m-85 -149.85 112.28 4.71 Favored 'General case' 0 N--CA 1.489 1.491 0 O-C-N 121.249 -0.907 . . . . 0.47999999999999998 109.838 -179.997 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 328' ' ' PHE . . . . . 0.409 ' C ' HG23 ' A' ' 329' ' ' THR . 75.5 m-85 -113.71 -173.85 2.35 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.341 -0.85 . . . . 0.31 109.171 179.709 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 329' ' ' THR . . . . . 0.409 HG23 ' C ' ' A' ' 328' ' ' PHE . 73.2 p -153.38 164.21 38.56 Favored 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.184 -0.948 . . . . 0.22 109.268 -179.891 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 330' ' ' LEU . . . . . . . . . . . . . 15.4 tp -149.74 125.93 10.7 Favored 'General case' 0 N--CA 1.488 1.46 0 O-C-N 121.207 -0.933 . . . . 0.28000000000000003 109.666 -179.853 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 331' ' ' GLN . . . . . . . . . . . . . 1.6 tt0 -87.4 114.44 24.01 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.302 -0.874 . . . . 0.91000000000000003 109.321 179.817 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 332' ' ' ILE . . . . . 0.484 HG21 ' HA ' ' A' ' 338' ' ' PHE . 57.9 mt -103.37 104.42 16.62 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.592 0 O-C-N 121.261 -0.9 . . . . 0.26000000000000001 109.739 -179.867 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 333' ' ' ARG . . . . . . . . . . . . . 9.9 mtm180 -72.05 139.17 48.36 Favored 'General case' 0 N--CA 1.488 1.456 0 O-C-N 121.322 -0.861 . . . . 2.9199999999999999 109.246 179.64 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 334' ' ' GLY . . . . . . . . . . . . . . . 92.89 131.53 5.77 Favored Glycine 0 N--CA 1.49 2.298 0 N-CA-C 109.407 -1.477 . . . . 0.40000000000000002 109.407 -179.789 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 335' ' ' ARG . . . . . . . . . . . . . 2.0 ttt180 -78.21 -32.92 50.19 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.303 -1.116 . . . . 3.0099999999999998 109.488 -179.855 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 336' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -58.17 -61.5 2.52 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.133 -0.979 . . . . 2.29 109.696 -179.895 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 337' ' ' ARG . . . . . . . . . . . . . 5.3 mtt180 -60.45 -34.56 74.18 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.173 -0.955 . . . . 2.9300000000000002 109.705 -179.889 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 338' ' ' PHE . . . . . 0.484 ' HA ' HG21 ' A' ' 332' ' ' ILE . 78.8 t80 -54.05 -60.45 3.32 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.222 -0.924 . . . . 0.38 109.631 -179.704 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 339' ' ' GLU . . . . . . . . . . . . . 95.7 mt-10 -50.89 -33.88 25.94 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.216 -0.928 . . . . 1.97 109.999 -179.615 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 340' ' ' MET . . . . . . . . . . . . . 32.2 ttp -64.01 -50.98 66.36 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.068 -1.02 . . . . 0.31 110.063 -179.635 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 341' ' ' PHE . . . . . . . . . . . . . 37.1 m-85 -61.57 -47.56 84.94 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.128 -0.983 . . . . 0.17999999999999999 109.78 -179.497 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 342' ' ' ARG . . . . . . . . . . . . . 1.4 ttt180 -49.46 -39.4 33.3 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.173 -0.954 . . . . 2.4199999999999999 109.598 -179.913 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 343' ' ' GLU . . . . . . . . . . . . . 2.7 tt0 -58.51 -49.47 77.28 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.14 -0.975 . . . . 2.3500000000000001 109.437 -179.95 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 344' ' ' LEU . . . . . 0.722 HD22 ' CD2' ' B' ' 344' ' ' LEU . 73.9 mt -62.3 -29.7 70.62 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.278 -0.889 . . . . 0.17999999999999999 109.334 179.824 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 345' ' ' ASN . . . . . . . . . . . . . 11.2 t-20 -57.77 -54.17 49.92 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.323 -0.861 . . . . 1.0900000000000001 109.581 179.907 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 346' ' ' GLU . . . . . . . . . . . . . 1.2 tp10 -62.13 -28.68 69.81 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.279 -0.888 . . . . 1.6499999999999999 109.785 -179.768 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 347' ' ' ALA . . . . . 1.08 ' HB1' ' HB1' ' B' ' 347' ' ' ALA . . . -61.76 -62.2 1.97 Allowed 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.116 -0.99 . . . . 0.17999999999999999 110.032 -179.632 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 348' ' ' LEU . . . . . 0.546 HD22 ' N ' ' A' ' 348' ' ' LEU . 3.9 mm? -61.36 -44.61 96.87 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.259 -0.901 . . . . 0.29999999999999999 110.112 -179.369 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 349' ' ' GLU . . . . . . . . . . . . . 3.1 mt-10 -56.9 -35.77 69.36 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.188 -0.945 . . . . 1.9399999999999999 109.83 -179.388 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 350' ' ' LEU . . . . . 0.698 HD13 HD22 ' B' ' 350' ' ' LEU . 5.9 tt -64.93 -45.67 84.84 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.243 -0.91 . . . . 0.46000000000000002 109.669 -179.962 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 351' ' ' LYS . . . . . . . . . . . . . 22.0 tttt -59.06 -41.21 87.39 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.246 -0.909 . . . . 1.3999999999999999 109.303 -179.983 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 352' ' ' ASP . . . . . . . . . . . . . 11.9 m-20 -56.39 -50.22 72.22 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.33 -0.856 . . . . 1.1599999999999999 109.494 179.855 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 353' ' ' ALA . . . . . . . . . . . . . . . -68.63 -15.8 63.64 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.375 -0.828 . . . . 0.63 109.566 179.987 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 354' ' ' GLN . . . . . . . . . . . . . 2.2 mt-30 . . . . . 0 N--CA 1.491 1.6 0 O-C-N 121.21 -0.931 . . . . 1.47 109.58 -179.968 . . . . . . . . 0 0 . 1 . 022 nuclear build core ' B' B ' 326' ' ' GLU . . . . . . . . . . . . . 7.2 mt-10 . . . . . 0 N--CA 1.49 1.55 0 CA-C-O 121.317 0.58 . . . . 2.1299999999999999 109.536 . . . . . . . . . 0 0 . 1 . 022 nuclear build core ' B' B ' 327' ' ' TYR . . . . . . . . . . . . . 44.2 m-85 -149.76 112.26 4.73 Favored 'General case' 0 N--CA 1.489 1.493 0 O-C-N 121.272 -0.893 . . . . 0.47999999999999998 109.732 -179.97 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' B' B ' 328' ' ' PHE . . . . . 0.481 ' HB2' ' CD1' ' D' ' 338' ' ' PHE . 75.8 m-85 -113.74 -173.72 2.33 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.323 -0.861 . . . . 0.32000000000000001 109.146 179.676 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' B' B ' 329' ' ' THR . . . . . 0.42 HG23 ' C ' ' B' ' 328' ' ' PHE . 71.6 p -153.47 164.51 38.07 Favored 'General case' 0 N--CA 1.488 1.429 0 O-C-N 121.272 -0.892 . . . . 0.23000000000000001 109.363 179.921 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' B' B ' 330' ' ' LEU . . . . . . . . . . . . . 15.8 tp -149.89 126.47 10.93 Favored 'General case' 0 C--N 1.302 -1.457 0 O-C-N 121.215 -0.928 . . . . 0.28000000000000003 109.556 -179.842 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' B' B ' 331' ' ' GLN . . . . . . . . . . . . . 1.6 tt0 -87.85 114.6 24.62 Favored 'General case' 0 N--CA 1.489 1.493 0 O-C-N 121.258 -0.901 . . . . 0.91000000000000003 109.276 179.829 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' B' B ' 332' ' ' ILE . . . . . 0.498 HG21 ' HA ' ' B' ' 338' ' ' PHE . 57.8 mt -103.41 104.59 16.9 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.493 0 O-C-N 121.217 -0.927 . . . . 0.23999999999999999 109.709 -179.878 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' B' B ' 333' ' ' ARG . . . . . . . . . . . . . 10.3 mtm180 -72.25 139.06 47.9 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.237 -0.914 . . . . 2.9300000000000002 109.12 179.717 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' B' B ' 334' ' ' GLY . . . . . . . . . . . . . . . 92.94 131.94 5.93 Favored Glycine 0 N--CA 1.491 2.326 0 N-CA-C 109.392 -1.483 . . . . 0.40000000000000002 109.392 -179.776 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' B' B ' 335' ' ' ARG . . . . . 0.454 ' HA ' ' CE1' ' D' ' 328' ' ' PHE . 2.0 ttt180 -78.53 -32.93 48.21 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.209 -1.171 . . . . 3.0099999999999998 109.587 -179.855 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' B' B ' 336' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -58.08 -61.75 2.32 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.235 -0.916 . . . . 2.2799999999999998 109.633 -179.983 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' B' B ' 337' ' ' ARG . . . . . . . . . . . . . 5.0 mtt180 -60.2 -34.79 74.11 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.242 -0.911 . . . . 2.9300000000000002 109.695 -179.756 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' B' B ' 338' ' ' PHE . . . . . 0.524 ' CD1' ' HB2' ' D' ' 328' ' ' PHE . 79.9 t80 -53.87 -60.55 3.18 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.319 -0.863 . . . . 0.37 109.763 -179.833 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' B' B ' 339' ' ' GLU . . . . . . . . . . . . . 95.0 mt-10 -50.94 -33.76 25.8 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.233 -0.917 . . . . 1.98 110.114 -179.632 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' B' B ' 340' ' ' MET . . . . . . . . . . . . . 32.7 ttp -64.34 -50.44 67.77 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.101 -0.999 . . . . 0.32000000000000001 109.975 -179.607 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' B' B ' 341' ' ' PHE . . . . . . . . . . . . . 37.4 m-85 -61.87 -47.2 86.06 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.174 -0.954 . . . . 0.17999999999999999 110.0 -179.69 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' B' B ' 342' ' ' ARG . . . . . . . . . . . . . 1.5 ttt180 -49.84 -39.3 38.53 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.155 -0.966 . . . . 2.4199999999999999 109.605 179.947 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' B' B ' 343' ' ' GLU . . . . . . . . . . . . . 2.7 tt0 -58.52 -49.68 76.49 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.292 -0.88 . . . . 2.3500000000000001 109.352 -179.991 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' B' B ' 344' ' ' LEU . . . . . 0.722 ' CD2' HD22 ' A' ' 344' ' ' LEU . 74.6 mt -62.25 -29.59 70.51 Favored 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.298 -0.876 . . . . 0.17999999999999999 109.295 179.884 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' B' B ' 345' ' ' ASN . . . . . . . . . . . . . 11.4 t-20 -57.96 -54.07 51.04 Favored 'General case' 0 N--CA 1.488 1.472 0 O-C-N 121.283 -0.886 . . . . 1.0900000000000001 109.462 -179.946 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' B' B ' 346' ' ' GLU . . . . . . . . . . . . . 1.2 tp10 -62.15 -28.93 69.99 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.287 -0.883 . . . . 1.6599999999999999 109.765 -179.75 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' B' B ' 347' ' ' ALA . . . . . 1.08 ' HB1' ' HB1' ' A' ' 347' ' ' ALA . . . -61.76 -61.85 2.21 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.191 -0.943 . . . . 0.17000000000000001 110.209 -179.625 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' B' B ' 348' ' ' LEU . . . . . 0.555 HD22 ' N ' ' B' ' 348' ' ' LEU . 3.9 mm? -61.66 -44.56 96.73 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.151 -0.968 . . . . 0.28999999999999998 110.074 -179.445 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' B' B ' 349' ' ' GLU . . . . . . . . . . . . . 3.1 mt-10 -56.7 -35.98 69.13 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.167 -0.958 . . . . 1.95 109.848 -179.444 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' B' B ' 350' ' ' LEU . . . . . 0.698 HD22 HD13 ' A' ' 350' ' ' LEU . 6.0 tt -64.72 -45.78 85.08 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.177 -0.952 . . . . 0.45000000000000001 109.596 -179.946 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' B' B ' 351' ' ' LYS . . . . . . . . . . . . . 22.1 tttt -58.93 -41.21 86.81 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.365 -0.834 . . . . 1.3799999999999999 109.283 -179.922 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' B' B ' 352' ' ' ASP . . . . . . . . . . . . . 12.1 m-20 -56.28 -50.45 71.34 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.31 -0.869 . . . . 1.1599999999999999 109.422 179.862 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' B' B ' 353' ' ' ALA . . . . . . . . . . . . . . . -68.68 -15.63 63.58 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.287 -0.883 . . . . 0.60999999999999999 109.501 -179.909 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' B' B ' 354' ' ' GLN . . . . . . . . . . . . . 2.1 mt-30 . . . . . 0 N--CA 1.49 1.571 0 O-C-N 121.193 -0.942 . . . . 1.45 109.561 -179.957 . . . . . . . . 0 0 . 1 . 022 nuclear build core ' C' C ' 326' ' ' GLU . . . . . . . . . . . . . 3.6 mp0 . . . . . 0 N--CA 1.489 1.505 0 N-CA-C 109.355 -0.609 . . . . 2.1699999999999999 109.355 . . . . . . . . . 0 0 . 1 . 022 nuclear build core ' C' C ' 327' ' ' TYR . . . . . . . . . . . . . 38.4 m-85 -150.18 105.56 3.38 Favored 'General case' 0 N--CA 1.488 1.451 0 O-C-N 121.234 -0.916 . . . . 0.47999999999999998 110.085 179.922 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' C' C ' 328' ' ' PHE . . . . . 0.42 ' HB3' ' CE1' ' A' ' 338' ' ' PHE . 87.8 m-85 -113.97 -174.42 2.47 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.455 -0.778 . . . . 0.33000000000000002 108.94 179.531 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' C' C ' 329' ' ' THR . . . . . . . . . . . . . 19.8 p -151.55 164.41 36.89 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.108 -0.995 . . . . 0.23000000000000001 109.466 -179.942 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' C' C ' 330' ' ' LEU . . . . . . . . . . . . . 15.1 tp -150.86 130.52 13.12 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.151 -0.968 . . . . 0.28000000000000003 109.824 -179.742 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' C' C ' 331' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -88.51 112.48 23.05 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.342 -0.849 . . . . 1.48 109.394 179.691 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' C' C ' 332' ' ' ILE . . . . . 0.415 HD13 ' CD2' ' C' ' 341' ' ' PHE . 64.5 mt -103.68 102.81 14.22 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.653 0 O-C-N 121.138 -0.976 . . . . 0.23999999999999999 109.994 -179.83 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' C' C ' 333' ' ' ARG . . . . . 0.611 ' HG2' ' CE1' ' A' ' 327' ' ' TYR . 2.4 mtp180 -72.69 156.32 39.07 Favored 'General case' 0 N--CA 1.488 1.47 0 O-C-N 121.262 -0.899 . . . . 2.7400000000000002 109.201 179.518 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' C' C ' 334' ' ' GLY . . . . . . . . . . . . . . . 80.06 128.92 0.75 Allowed Glycine 0 N--CA 1.491 2.329 0 N-CA-C 109.66 -1.376 . . . . 0.34999999999999998 109.66 179.856 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' C' C ' 335' ' ' ARG . . . . . . . . . . . . . 20.8 ttt180 -79.28 -33.03 43.76 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.401 -1.058 . . . . 2.5299999999999998 109.508 -179.999 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' C' C ' 336' ' ' GLU . . . . . 0.469 ' HA ' ' OE1' ' C' ' 339' ' ' GLU . 0.0 OUTLIER -58.08 -62.05 2.1 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.189 -0.944 . . . . 2.6200000000000001 109.773 -179.781 . . . . . . . . 3 3 . 1 . 022 nuclear build core ' C' C ' 337' ' ' ARG . . . . . 0.551 ' HG2' ' NH1' ' C' ' 337' ' ' ARG . 0.1 OUTLIER -59.85 -30.88 69.26 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.235 -0.916 . . . . 2.8100000000000001 109.843 -179.672 . . . . . . . . 3 3 . 1 . 022 nuclear build core ' C' C ' 338' ' ' PHE . . . . . . . . . . . . . 72.4 t80 -55.53 -54.87 38.59 Favored 'General case' 0 N--CA 1.488 1.457 0 O-C-N 121.158 -0.963 . . . . 0.40000000000000002 109.681 -179.911 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' C' C ' 339' ' ' GLU . . . . . 0.469 ' OE1' ' HA ' ' C' ' 336' ' ' GLU . 3.0 mt-10 -52.58 -39.24 61.37 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.204 -0.935 . . . . 2.0499999999999998 110.325 -179.582 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' C' C ' 340' ' ' MET . . . . . . . . . . . . . 36.3 ttp -62.35 -46.25 89.53 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.157 -0.965 . . . . 0.32000000000000001 110.0 -179.334 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' C' C ' 341' ' ' PHE . . . . . 0.415 ' CD2' HD13 ' C' ' 332' ' ' ILE . 32.7 m-85 -63.14 -43.22 98.95 Favored 'General case' 0 N--CA 1.489 1.5 0 O-C-N 121.174 -0.954 . . . . 0.17999999999999999 110.021 -179.609 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' C' C ' 342' ' ' ARG . . . . . . . . . . . . . 39.7 ttt180 -51.96 -42.92 63.26 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.216 -0.927 . . . . 2.9100000000000001 110.028 -179.773 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' C' C ' 343' ' ' GLU . . . . . . . . . . . . . 2.5 tt0 -57.32 -48.27 79.4 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.145 -0.972 . . . . 2.1400000000000001 109.461 -179.649 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' C' C ' 344' ' ' LEU . . . . . 0.471 ' CD2' HD22 ' D' ' 344' ' ' LEU . 37.0 mt -62.96 -30.55 71.66 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.205 -0.935 . . . . 0.22 109.357 179.866 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' C' C ' 345' ' ' ASN . . . . . 0.444 ' O ' ' HG3' ' C' ' 349' ' ' GLU . 18.1 t-20 -59.07 -61.35 2.7 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.311 -0.868 . . . . 1.0800000000000001 109.687 -179.829 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' C' C ' 346' ' ' GLU . . . . . . . . . . . . . 17.0 tp10 -61.22 -25.69 67.23 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.317 -0.864 . . . . 2.21 109.866 -179.608 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' C' C ' 347' ' ' ALA . . . . . 0.982 ' HB1' ' HB1' ' D' ' 347' ' ' ALA . . . -61.39 -58.34 8.6 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.215 -0.928 . . . . 0.17999999999999999 109.987 -179.697 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' C' C ' 348' ' ' LEU . . . . . 0.535 ' N ' HD22 ' C' ' 348' ' ' LEU . 3.8 mm? -62.4 -44.39 96.56 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.208 -0.932 . . . . 0.32000000000000001 110.147 -179.288 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' C' C ' 349' ' ' GLU . . . . . 0.444 ' HG3' ' O ' ' C' ' 345' ' ' ASN . 22.0 mt-10 -56.08 -38.6 70.91 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.141 -0.974 . . . . 2.1899999999999999 109.887 -179.32 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' C' C ' 350' ' ' LEU . . . . . 0.689 HD22 HD13 ' D' ' 350' ' ' LEU . 6.1 tt -62.78 -40.37 97.11 Favored 'General case' 0 N--CA 1.489 1.493 0 O-C-N 121.156 -0.965 . . . . 0.46000000000000002 109.537 -179.739 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' C' C ' 351' ' ' LYS . . . . . . . . . . . . . 11.3 tttt -60.19 -39.98 88.4 Favored 'General case' 0 N--CA 1.489 1.482 0 O-C-N 121.235 -0.915 . . . . 1.3500000000000001 109.585 179.999 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' C' C ' 352' ' ' ASP . . . . . 0.456 ' N ' ' OD1' ' C' ' 352' ' ' ASP . 4.6 m-20 -59.25 -42.36 90.95 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.249 -0.907 . . . . 1.1899999999999999 109.763 -179.99 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' C' C ' 353' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 1.651 0 O-C-N 121.251 -0.906 . . . . 0.56999999999999995 110.081 -179.358 . . . . . . . . 0 0 . 1 . 022 nuclear build core ' D' D ' 326' ' ' GLU . . . . . . . . . . . . . 6.9 mt-10 . . . . . 0 N--CA 1.491 1.578 0 N-CA-C 109.485 -0.561 . . . . 2.1299999999999999 109.485 . . . . . . . . . 0 0 . 1 . 022 nuclear build core ' D' D ' 327' ' ' TYR . . . . . . . . . . . . . 44.5 m-85 -150.0 112.45 4.71 Favored 'General case' 0 N--CA 1.489 1.485 0 O-C-N 121.23 -0.919 . . . . 0.46999999999999997 109.737 -179.935 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' D' D ' 328' ' ' PHE . . . . . 0.524 ' HB2' ' CD1' ' B' ' 338' ' ' PHE . 75.3 m-85 -113.78 -173.55 2.3 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.377 -0.827 . . . . 0.29999999999999999 109.173 179.673 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' D' D ' 329' ' ' THR . . . . . 0.41 HG23 ' C ' ' D' ' 328' ' ' PHE . 67.3 p -153.41 164.4 38.23 Favored 'General case' 0 N--CA 1.488 1.445 0 O-C-N 121.249 -0.907 . . . . 0.22 109.28 179.987 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' D' D ' 330' ' ' LEU . . . . . . . . . . . . . 15.4 tp -150.04 125.96 10.5 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.218 -0.926 . . . . 0.28000000000000003 109.551 -179.837 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' D' D ' 331' ' ' GLN . . . . . . . . . . . . . 1.5 tt0 -87.24 114.7 24.08 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.367 -0.833 . . . . 0.93000000000000005 109.327 179.799 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' D' D ' 332' ' ' ILE . . . . . 0.506 HG21 ' HA ' ' D' ' 338' ' ' PHE . 58.2 mt -103.3 104.55 16.82 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.514 0 O-C-N 121.089 -1.007 . . . . 0.25 109.741 -179.912 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' D' D ' 333' ' ' ARG . . . . . . . . . . . . . 10.4 mtm180 -72.34 138.67 47.46 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.176 -0.953 . . . . 2.9300000000000002 109.243 179.728 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' D' D ' 334' ' ' GLY . . . . . . . . . . . . . . . 92.93 131.1 5.63 Favored Glycine 0 N--CA 1.49 2.3 0 N-CA-C 109.482 -1.447 . . . . 0.40999999999999998 109.482 -179.78 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' D' D ' 335' ' ' ARG . . . . . 0.441 ' HA ' ' CE1' ' B' ' 328' ' ' PHE . 2.0 ttt180 -77.33 -33.15 55.55 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.225 -1.162 . . . . 3.0299999999999998 109.675 -179.858 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' D' D ' 336' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -58.13 -61.13 2.78 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.129 -0.982 . . . . 2.2599999999999998 109.722 -179.79 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' D' D ' 337' ' ' ARG . . . . . . . . . . . . . 5.4 mtt180 -60.97 -34.11 74.25 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.296 -0.878 . . . . 2.9199999999999999 109.61 -179.812 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' D' D ' 338' ' ' PHE . . . . . 0.506 ' HA ' HG21 ' D' ' 332' ' ' ILE . 80.3 t80 -54.3 -60.41 3.37 Favored 'General case' 0 N--CA 1.488 1.453 0 O-C-N 121.221 -0.925 . . . . 0.37 109.725 -179.777 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' D' D ' 339' ' ' GLU . . . . . . . . . . . . . 94.2 mt-10 -51.15 -33.47 27.06 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.3 -0.875 . . . . 1.99 110.039 -179.673 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' D' D ' 340' ' ' MET . . . . . . . . . . . . . 33.1 ttp -64.45 -50.76 66.26 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.082 -1.011 . . . . 0.31 109.931 -179.587 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' D' D ' 341' ' ' PHE . . . . . . . . . . . . . 36.9 m-85 -61.56 -47.23 86.47 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.168 -0.957 . . . . 0.17999999999999999 109.868 -179.525 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' D' D ' 342' ' ' ARG . . . . . . . . . . . . . 1.5 ttt180 -49.92 -39.49 40.33 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.157 -0.964 . . . . 2.4100000000000001 109.558 -179.902 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' D' D ' 343' ' ' GLU . . . . . . . . . . . . . 2.8 tt0 -58.28 -49.8 75.87 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.294 -0.879 . . . . 2.3500000000000001 109.398 -179.998 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' D' D ' 344' ' ' LEU . . . . . 0.471 HD22 ' CD2' ' C' ' 344' ' ' LEU . 75.9 mt -62.25 -29.5 70.44 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.184 -0.948 . . . . 0.19 109.293 179.761 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' D' D ' 345' ' ' ASN . . . . . . . . . . . . . 11.3 t-20 -58.0 -54.37 47.72 Favored 'General case' 0 C--N 1.303 -1.414 0 O-C-N 121.398 -0.813 . . . . 1.0900000000000001 109.45 179.968 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' D' D ' 346' ' ' GLU . . . . . . . . . . . . . 1.2 tt0 -61.81 -29.06 69.9 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.308 -0.87 . . . . 1.6899999999999999 109.827 -179.857 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' D' D ' 347' ' ' ALA . . . . . 0.982 ' HB1' ' HB1' ' C' ' 347' ' ' ALA . . . -61.73 -62.01 2.11 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.201 -0.937 . . . . 0.17999999999999999 110.122 -179.66 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' D' D ' 348' ' ' LEU . . . . . 0.547 HD22 ' N ' ' D' ' 348' ' ' LEU . 3.9 mm? -61.52 -44.71 96.57 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.159 -0.963 . . . . 0.31 110.119 -179.394 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' D' D ' 349' ' ' GLU . . . . . . . . . . . . . 3.1 mt-10 -56.64 -35.54 68.46 Favored 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.13 -0.982 . . . . 1.95 109.859 -179.507 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' D' D ' 350' ' ' LEU . . . . . 0.689 HD13 HD22 ' C' ' 350' ' ' LEU . 6.0 tt -65.02 -45.75 84.17 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.154 -0.966 . . . . 0.42999999999999999 109.576 -179.865 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' D' D ' 351' ' ' LYS . . . . . . . . . . . . . 21.8 tttt -59.03 -41.09 86.96 Favored 'General case' 0 C--N 1.304 -1.404 0 O-C-N 121.258 -0.901 . . . . 1.3999999999999999 109.381 -179.877 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' D' D ' 352' ' ' ASP . . . . . . . . . . . . . 11.7 m-20 -56.38 -50.47 71.46 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.328 -0.858 . . . . 1.1699999999999999 109.484 179.886 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' D' D ' 353' ' ' ALA . . . . . . . . . . . . . . . -68.68 -15.4 63.51 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.232 -0.918 . . . . 0.58999999999999997 109.543 -179.953 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' D' D ' 354' ' ' GLN . . . . . . . . . . . . . 2.2 mt-30 . . . . . 0 N--CA 1.49 1.564 0 O-C-N 121.154 -0.966 . . . . 1.4399999999999999 109.52 -179.991 . . . . . . . . 0 0 . 1 . 023 nuclear build core ' A' A ' 326' ' ' GLU . . . . . . . . . . . . . 59.2 mm-40 . . . . . 0 N--CA 1.488 1.475 0 N-CA-C 108.945 -0.761 . . . . 2.1299999999999999 108.945 . . . . . . . . . 0 0 . 1 . 023 nuclear build core ' A' A ' 327' ' ' TYR . . . . . 0.507 ' CE2' ' HG2' ' C' ' 333' ' ' ARG . 38.4 m-85 -148.64 105.36 3.57 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.169 -0.957 . . . . 0.47999999999999998 109.634 179.697 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 328' ' ' PHE . . . . . . . . . . . . . 98.2 m-85 -107.33 -166.92 1.2 Allowed 'General case' 0 C--N 1.303 -1.445 0 N-CA-C 108.851 -0.796 . . . . 0.31 108.851 179.68 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 329' ' ' THR . . . . . . . . . . . . . 68.1 p -151.07 164.71 35.82 Favored 'General case' 0 C--N 1.301 -1.517 0 O-C-N 121.139 -0.976 . . . . 0.22 109.27 -179.984 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 330' ' ' LEU . . . . . . . . . . . . . 16.1 tp -148.76 131.77 16.25 Favored 'General case' 0 C--N 1.302 -1.474 0 O-C-N 121.236 -0.915 . . . . 0.28000000000000003 109.377 -179.635 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 331' ' ' GLN . . . . . . . . . . . . . 1.6 tp60 -85.87 113.97 22.43 Favored 'General case' 0 N--CA 1.488 1.464 0 O-C-N 121.388 -0.82 . . . . 0.91000000000000003 109.151 179.955 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 332' ' ' ILE . . . . . 0.651 HG21 ' HA ' ' A' ' 338' ' ' PHE . 53.9 mt -102.83 102.23 13.31 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.497 0 O-C-N 121.295 -0.878 . . . . 0.26000000000000001 109.38 -179.827 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 333' ' ' ARG . . . . . . . . . . . . . 79.9 mtt180 -72.18 154.64 40.93 Favored 'General case' 0 N--CA 1.489 1.479 0 O-C-N 121.343 -0.848 . . . . 2.9199999999999999 109.37 179.992 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 334' ' ' GLY . . . . . . . . . . . . . . . 80.07 134.24 1.23 Allowed Glycine 0 N--CA 1.491 2.339 0 N-CA-C 109.598 -1.401 . . . . 0.40000000000000002 109.598 -179.86 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 335' ' ' ARG . . . . . 0.51 ' NH1' ' HG2' ' A' ' 335' ' ' ARG . 1.3 ttt-85 -79.93 -50.58 10.24 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.271 -1.135 . . . . 3.0099999999999998 109.83 -179.782 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 336' ' ' GLU . . . . . . . . . . . . . 1.4 pt-20 -55.61 -48.29 75.13 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.179 -0.95 . . . . 2.29 109.611 -179.689 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 337' ' ' ARG . . . . . 0.442 ' CG ' ' NH1' ' A' ' 337' ' ' ARG . 0.0 OUTLIER -60.1 -35.08 74.44 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.209 -0.932 . . . . 2.9300000000000002 109.474 179.97 . . . . . . . . 3 3 . 1 . 023 nuclear build core ' A' A ' 338' ' ' PHE . . . . . 0.651 ' HA ' HG21 ' A' ' 332' ' ' ILE . 61.9 t80 -55.64 -55.69 29.19 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.321 -0.862 . . . . 0.38 109.531 179.998 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 339' ' ' GLU . . . . . . . . . . . . . 3.6 mm-40 -51.03 -32.68 22.34 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.339 -0.851 . . . . 1.97 110.118 -179.547 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 340' ' ' MET . . . . . . . . . . . . . 19.5 ttp -64.36 -52.92 55.95 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.151 -0.968 . . . . 0.31 110.198 -179.425 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 341' ' ' PHE . . . . . . . . . . . . . 39.8 m-85 -62.46 -46.08 90.14 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.195 -0.941 . . . . 0.17999999999999999 110.208 -179.274 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 342' ' ' ARG . . . . . . . . . . . . . 10.0 ttp180 -48.51 -41.19 29.24 Favored 'General case' 0 N--CA 1.491 1.625 0 O-C-N 121.061 -1.025 . . . . 2.4199999999999999 109.813 -179.827 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 343' ' ' GLU . . . . . . . . . . . . . 9.1 tp10 -59.31 -45.46 91.23 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.259 -0.901 . . . . 2.3500000000000001 109.967 -179.709 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 344' ' ' LEU . . . . . 0.404 ' O ' HD23 ' A' ' 348' ' ' LEU . 53.1 mt -62.77 -44.64 95.66 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.256 -0.903 . . . . 0.17999999999999999 110.024 -179.704 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 345' ' ' ASN . . . . . 0.425 HD22 HD11 ' C' ' 330' ' ' LEU . 54.7 t-20 -55.38 -49.52 72.12 Favored 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.172 -0.955 . . . . 1.0900000000000001 109.872 -179.823 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 346' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -61.06 -36.16 78.86 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.243 -0.91 . . . . 1.6499999999999999 109.585 -179.812 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 347' ' ' ALA . . . . . 0.872 ' HB1' ' HB1' ' B' ' 347' ' ' ALA . . . -60.14 -50.06 75.19 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.235 -0.915 . . . . 0.17999999999999999 109.962 -179.806 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 348' ' ' LEU . . . . . 0.55 HD12 ' NH2' ' C' ' 337' ' ' ARG . 3.6 mm? -62.24 -48.95 77.67 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.124 -0.985 . . . . 0.29999999999999999 109.87 -179.63 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 349' ' ' GLU . . . . . . . . . . . . . 76.3 mt-10 -55.53 -35.41 65.63 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.162 -0.961 . . . . 1.9399999999999999 109.7 -179.479 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 350' ' ' LEU . . . . . 0.783 HD13 HD22 ' B' ' 350' ' ' LEU . 5.6 tt -62.91 -45.3 93.17 Favored 'General case' 0 N--CA 1.488 1.472 0 O-C-N 121.266 -0.896 . . . . 0.46000000000000002 109.216 179.843 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 351' ' ' LYS . . . . . . . . . . . . . 19.1 tttm -56.37 -38.66 71.74 Favored 'General case' 0 N--CA 1.488 1.469 0 O-C-N 121.365 -0.834 . . . . 1.3999999999999999 109.481 179.982 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 352' ' ' ASP . . . . . . . . . . . . . 4.7 m-20 -55.61 -45.97 77.39 Favored 'General case' 0 N--CA 1.489 1.495 0 O-C-N 121.223 -0.923 . . . . 1.1599999999999999 109.429 179.784 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 353' ' ' ALA . . . . . . . . . . . . . . . -67.98 -28.26 67.28 Favored 'General case' 0 N--CA 1.489 1.494 0 O-C-N 121.309 -0.869 . . . . 0.63 109.172 179.734 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 354' ' ' GLN . . . . . . . . . . . . . 12.0 tt0 . . . . . 0 N--CA 1.49 1.541 0 O-C-N 121.321 -0.862 . . . . 1.47 109.471 179.756 . . . . . . . . 0 0 . 1 . 023 nuclear build core ' B' B ' 326' ' ' GLU . . . . . . . . . . . . . 60.4 mm-40 . . . . . 0 N--CA 1.487 1.38 0 N-CA-C 108.96 -0.756 . . . . 2.1299999999999999 108.96 . . . . . . . . . 0 0 . 1 . 023 nuclear build core ' B' B ' 327' ' ' TYR . . . . . 0.442 ' CE2' ' HG2' ' D' ' 333' ' ' ARG . 39.2 m-85 -148.35 105.4 3.61 Favored 'General case' 0 C--N 1.301 -1.517 0 O-C-N 121.156 -0.965 . . . . 0.47999999999999998 109.614 179.846 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' B' B ' 328' ' ' PHE . . . . . . . . . . . . . 98.2 m-85 -107.54 -166.91 1.19 Allowed 'General case' 0 N--CA 1.488 1.455 0 N-CA-C 108.772 -0.825 . . . . 0.32000000000000001 108.772 179.752 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' B' B ' 329' ' ' THR . . . . . . . . . . . . . 69.7 p -151.04 164.89 35.39 Favored 'General case' 0 C--N 1.301 -1.52 0 O-C-N 121.151 -0.968 . . . . 0.23000000000000001 109.235 -179.988 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' B' B ' 330' ' ' LEU . . . . . . . . . . . . . 15.7 tp -148.95 131.6 15.9 Favored 'General case' 0 C--N 1.303 -1.445 0 O-C-N 121.189 -0.945 . . . . 0.28000000000000003 109.386 -179.689 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' B' B ' 331' ' ' GLN . . . . . . . . . . . . . 1.6 tp60 -85.62 113.87 22.17 Favored 'General case' 0 C--N 1.303 -1.432 0 O-C-N 121.347 -0.845 . . . . 0.91000000000000003 109.203 179.943 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' B' B ' 332' ' ' ILE . . . . . 0.661 HG21 ' HA ' ' B' ' 338' ' ' PHE . 52.4 mt -102.68 102.57 13.78 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.484 0 O-C-N 121.172 -0.955 . . . . 0.23999999999999999 109.44 -179.967 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' B' B ' 333' ' ' ARG . . . . . . . . . . . . . 80.2 mtt180 -72.39 154.71 40.76 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.458 -0.776 . . . . 2.9300000000000002 109.434 -179.911 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' B' B ' 334' ' ' GLY . . . . . . . . . . . . . . . 79.85 134.54 1.21 Allowed Glycine 0 N--CA 1.491 2.316 0 N-CA-C 109.437 -1.465 . . . . 0.40000000000000002 109.437 -179.899 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' B' B ' 335' ' ' ARG . . . . . 0.511 ' NH1' ' HG2' ' B' ' 335' ' ' ARG . 1.4 ttt-85 -80.15 -50.37 10.38 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.287 -1.125 . . . . 3.0099999999999998 109.868 -179.866 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' B' B ' 336' ' ' GLU . . . . . . . . . . . . . 1.3 pt-20 -55.54 -48.12 75.23 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.218 -0.926 . . . . 2.2799999999999998 109.644 -179.715 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' B' B ' 337' ' ' ARG . . . . . 0.441 ' CG ' ' NH1' ' B' ' 337' ' ' ARG . 0.0 OUTLIER -60.27 -35.22 75.03 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.199 -0.938 . . . . 2.9300000000000002 109.453 179.966 . . . . . . . . 3 3 . 1 . 023 nuclear build core ' B' B ' 338' ' ' PHE . . . . . 0.661 ' HA ' HG21 ' B' ' 332' ' ' ILE . 62.3 t80 -55.55 -55.95 25.96 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.246 -0.909 . . . . 0.37 109.563 -179.998 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' B' B ' 339' ' ' GLU . . . . . . . . . . . . . 3.5 mm-40 -50.92 -32.37 20.49 Favored 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.233 -0.917 . . . . 1.98 110.113 -179.6 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' B' B ' 340' ' ' MET . . . . . . . . . . . . . 19.4 ttp -64.56 -52.97 54.88 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.146 -0.972 . . . . 0.32000000000000001 110.155 -179.457 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' B' B ' 341' ' ' PHE . . . . . . . . . . . . . 40.1 m-85 -62.56 -46.07 90.01 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.166 -0.959 . . . . 0.17999999999999999 110.254 -179.246 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' B' B ' 342' ' ' ARG . . . . . . . . . . . . . 10.1 ttp180 -48.46 -41.13 28.64 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.046 -1.034 . . . . 2.4199999999999999 109.771 -179.752 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' B' B ' 343' ' ' GLU . . . . . . . . . . . . . 9.2 tp10 -59.35 -45.55 91.09 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.238 -0.914 . . . . 2.3500000000000001 109.908 -179.668 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' B' B ' 344' ' ' LEU . . . . . . . . . . . . . 49.2 mt -62.91 -44.57 95.72 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.288 -0.883 . . . . 0.17999999999999999 109.968 -179.607 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' B' B ' 345' ' ' ASN . . . . . 0.498 HD22 HD11 ' D' ' 330' ' ' LEU . 55.7 t-20 -55.4 -49.68 71.75 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.22 -0.925 . . . . 1.0900000000000001 109.685 -179.704 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' B' B ' 346' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -60.81 -36.16 78.34 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.215 -0.928 . . . . 1.6599999999999999 109.599 -179.773 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' B' B ' 347' ' ' ALA . . . . . 0.872 ' HB1' ' HB1' ' A' ' 347' ' ' ALA . . . -60.34 -49.92 75.68 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.153 -0.967 . . . . 0.17000000000000001 109.926 -179.816 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' B' B ' 348' ' ' LEU . . . . . 0.525 HD22 ' N ' ' B' ' 348' ' ' LEU . 3.7 mm? -62.25 -49.04 77.28 Favored 'General case' 0 N--CA 1.493 1.692 0 O-C-N 121.182 -0.949 . . . . 0.28999999999999998 109.834 -179.67 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' B' B ' 349' ' ' GLU . . . . . . . . . . . . . 77.5 mt-10 -55.43 -35.58 65.57 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.251 -0.906 . . . . 1.95 109.642 -179.479 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' B' B ' 350' ' ' LEU . . . . . 0.783 HD22 HD13 ' A' ' 350' ' ' LEU . 5.7 tt -62.88 -45.18 93.76 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.255 -0.903 . . . . 0.45000000000000001 109.247 179.905 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' B' B ' 351' ' ' LYS . . . . . . . . . . . . . 19.2 tttm -56.38 -38.64 71.73 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.309 -0.869 . . . . 1.3799999999999999 109.412 179.922 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' B' B ' 352' ' ' ASP . . . . . . . . . . . . . 4.9 m-20 -55.6 -46.03 77.36 Favored 'General case' 0 N--CA 1.489 1.482 0 O-C-N 121.211 -0.931 . . . . 1.1599999999999999 109.38 179.866 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' B' B ' 353' ' ' ALA . . . . . . . . . . . . . . . -67.96 -27.88 66.97 Favored 'General case' 0 N--CA 1.489 1.497 0 O-C-N 121.251 -0.906 . . . . 0.60999999999999999 109.179 179.684 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' B' B ' 354' ' ' GLN . . . . . . . . . . . . . 11.6 tt0 . . . . . 0 N--CA 1.489 1.518 0 O-C-N 121.343 -0.848 . . . . 1.45 109.466 179.747 . . . . . . . . 0 0 . 1 . 023 nuclear build core ' C' C ' 326' ' ' GLU . . . . . . . . . . . . . 2.3 mp0 . . . . . 0 N--CA 1.489 1.491 0 N-CA-C 109.057 -0.72 . . . . 2.1699999999999999 109.057 . . . . . . . . . 0 0 . 1 . 023 nuclear build core ' C' C ' 327' ' ' TYR . . . . . . . . . . . . . 38.7 m-85 -148.88 108.1 3.92 Favored 'General case' 0 C--N 1.302 -1.467 0 O-C-N 121.121 -0.987 . . . . 0.47999999999999998 109.865 179.973 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' C' C ' 328' ' ' PHE . . . . . 0.417 ' CE1' ' HA ' ' A' ' 335' ' ' ARG . 88.8 m-85 -112.55 -166.71 1.1 Allowed 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.457 -0.777 . . . . 0.33000000000000002 108.929 179.743 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' C' C ' 329' ' ' THR . . . . . . . . . . . . . 21.2 p -152.67 165.09 36.36 Favored 'General case' 0 N--CA 1.489 1.48 0 O-C-N 121.089 -1.007 . . . . 0.23000000000000001 109.608 179.966 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' C' C ' 330' ' ' LEU . . . . . 0.425 HD11 HD22 ' A' ' 345' ' ' ASN . 51.5 tp -150.68 126.18 10.16 Favored 'General case' 0 N--CA 1.488 1.453 0 O-C-N 121.258 -0.901 . . . . 0.28000000000000003 109.448 179.77 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' C' C ' 331' ' ' GLN . . . . . . . . . . . . . 4.4 tp-100 -86.74 117.37 25.45 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.325 -0.859 . . . . 1.48 109.3 179.883 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' C' C ' 332' ' ' ILE . . . . . 0.521 HD12 ' HD1' ' C' ' 338' ' ' PHE . 21.8 mt -103.49 110.12 28.99 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.554 0 O-C-N 121.119 -0.988 . . . . 0.23999999999999999 109.684 179.949 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' C' C ' 333' ' ' ARG . . . . . 0.507 ' HG2' ' CE2' ' A' ' 327' ' ' TYR . 11.8 mtm180 -73.71 143.44 46.17 Favored 'General case' 0 N--CA 1.488 1.469 0 O-C-N 121.174 -0.954 . . . . 2.7400000000000002 109.046 179.355 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' C' C ' 334' ' ' GLY . . . . . . . . . . . . . . . 90.16 134.67 5.71 Favored Glycine 0 N--CA 1.489 2.219 0 N-CA-C 109.618 -1.393 . . . . 0.34999999999999998 109.618 179.931 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' C' C ' 335' ' ' ARG . . . . . 0.486 ' CG ' ' NH1' ' C' ' 335' ' ' ARG . 0.0 OUTLIER -79.49 -46.09 18.09 Favored 'General case' 0 N--CA 1.488 1.466 0 O-C-N 121.374 -1.074 . . . . 2.5299999999999998 109.752 -179.939 . . . . . . . . 3 3 . 1 . 023 nuclear build core ' C' C ' 336' ' ' GLU . . . . . . . . . . . . . 3.8 mt-10 -57.34 -48.52 78.79 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.274 -0.891 . . . . 2.6200000000000001 109.687 -179.747 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' C' C ' 337' ' ' ARG . . . . . 0.55 ' NH2' HD12 ' A' ' 348' ' ' LEU . 1.9 mtp180 -59.31 -34.93 72.91 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.36 -0.837 . . . . 2.8100000000000001 109.788 -179.712 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' C' C ' 338' ' ' PHE . . . . . 0.521 ' HD1' HD12 ' C' ' 332' ' ' ILE . 51.4 t80 -55.81 -54.06 49.14 Favored 'General case' 0 N--CA 1.489 1.501 0 O-C-N 121.219 -0.926 . . . . 0.40000000000000002 110.296 -179.65 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' C' C ' 339' ' ' GLU . . . . . . . . . . . . . 7.9 mt-10 -51.27 -34.71 34.04 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.186 -0.946 . . . . 2.0499999999999998 110.705 -179.161 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' C' C ' 340' ' ' MET . . . . . . . . . . . . . 38.1 ttp -64.78 -55.02 22.28 Favored 'General case' 0 N--CA 1.493 1.722 0 O-C-N 120.962 -1.087 . . . . 0.32000000000000001 110.626 -179.094 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' C' C ' 341' ' ' PHE . . . . . . . . . . . . . 49.3 m-85 -59.87 -44.8 93.98 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.143 -0.973 . . . . 0.17999999999999999 110.126 -179.053 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' C' C ' 342' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -50.24 -42.86 52.52 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.164 -0.96 . . . . 2.9100000000000001 110.27 -179.562 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' C' C ' 343' ' ' GLU . . . . . . . . . . . . . 1.8 tt0 -58.06 -48.93 78.64 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.154 -0.966 . . . . 2.1400000000000001 110.072 -179.362 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' C' C ' 344' ' ' LEU . . . . . 0.45 ' O ' HD23 ' C' ' 348' ' ' LEU . 66.2 mt -61.79 -36.63 81.65 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.125 -0.984 . . . . 0.22 109.763 -179.714 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' C' C ' 345' ' ' ASN . . . . . . . . . . . . . 23.0 t-20 -57.89 -57.19 13.89 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.228 -0.92 . . . . 1.0800000000000001 109.785 -179.814 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' C' C ' 346' ' ' GLU . . . . . . . . . . . . . 2.0 tm-20 -60.6 -29.3 69.13 Favored 'General case' 0 N--CA 1.489 1.525 0 O-C-N 121.291 -0.881 . . . . 2.21 109.752 -179.651 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' C' C ' 347' ' ' ALA . . . . . 0.757 ' HB1' ' HB1' ' D' ' 347' ' ' ALA . . . -62.08 -52.93 61.91 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.289 -0.882 . . . . 0.17999999999999999 109.934 -179.864 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' C' C ' 348' ' ' LEU . . . . . 0.528 ' N ' HD22 ' C' ' 348' ' ' LEU . 3.8 mm? -61.26 -52.33 65.19 Favored 'General case' 0 N--CA 1.492 1.675 0 O-C-N 121.223 -0.923 . . . . 0.32000000000000001 109.915 -179.487 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' C' C ' 349' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -56.57 -31.64 64.41 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.217 -0.927 . . . . 2.1899999999999999 109.588 -179.568 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' C' C ' 350' ' ' LEU . . . . . 0.81 ' CD2' HD13 ' D' ' 350' ' ' LEU . 10.0 tt -64.92 -44.2 90.33 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.236 -0.915 . . . . 0.46000000000000002 109.24 179.816 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' C' C ' 351' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -57.53 -40.84 79.67 Favored 'General case' 0 N--CA 1.488 1.47 0 O-C-N 121.466 -0.771 . . . . 1.3500000000000001 109.128 179.878 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' C' C ' 352' ' ' ASP . . . . . . . . . . . . . 30.0 m-20 -57.56 -34.71 69.47 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.358 -0.839 . . . . 1.1899999999999999 109.352 179.7 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' C' C ' 353' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 1.605 0 O-C-N 121.334 -0.854 . . . . 0.56999999999999995 109.53 -179.857 . . . . . . . . 0 0 . 1 . 023 nuclear build core ' D' D ' 326' ' ' GLU . . . . . . . . . . . . . 61.6 mm-40 . . . . . 0 N--CA 1.486 1.37 0 N-CA-C 108.87 -0.789 . . . . 2.1299999999999999 108.87 . . . . . . . . . 0 0 . 1 . 023 nuclear build core ' D' D ' 327' ' ' TYR . . . . . . . . . . . . . 38.7 m-85 -148.88 105.4 3.54 Favored 'General case' 0 C--N 1.301 -1.525 0 O-C-N 121.151 -0.968 . . . . 0.46999999999999997 109.57 179.874 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' D' D ' 328' ' ' PHE . . . . . . . . . . . . . 98.1 m-85 -107.47 -166.92 1.2 Allowed 'General case' 0 C--N 1.302 -1.464 0 N-CA-C 108.953 -0.758 . . . . 0.29999999999999999 108.953 179.815 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' D' D ' 329' ' ' THR . . . . . . . . . . . . . 66.8 p -151.24 164.54 36.36 Favored 'General case' 0 C--N 1.301 -1.539 0 O-C-N 121.204 -0.935 . . . . 0.22 109.212 -179.965 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' D' D ' 330' ' ' LEU . . . . . 0.498 HD11 HD22 ' B' ' 345' ' ' ASN . 15.8 tp -148.68 131.52 16.09 Favored 'General case' 0 C--N 1.302 -1.475 0 O-C-N 121.192 -0.943 . . . . 0.28000000000000003 109.437 -179.557 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' D' D ' 331' ' ' GLN . . . . . . . . . . . . . 1.6 tp60 -85.43 114.22 22.31 Favored 'General case' 0 C--N 1.303 -1.429 0 O-C-N 121.338 -0.852 . . . . 0.93000000000000005 109.167 179.868 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' D' D ' 332' ' ' ILE . . . . . 0.655 HG21 ' HA ' ' D' ' 338' ' ' PHE . 53.0 mt -102.98 102.52 13.73 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.513 0 O-C-N 121.272 -0.892 . . . . 0.25 109.38 -179.962 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' D' D ' 333' ' ' ARG . . . . . 0.442 ' HG2' ' CE2' ' B' ' 327' ' ' TYR . 80.5 mtt180 -72.46 154.88 40.63 Favored 'General case' 0 N--CA 1.489 1.477 0 O-C-N 121.256 -0.903 . . . . 2.9300000000000002 109.517 -179.9 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' D' D ' 334' ' ' GLY . . . . . . . . . . . . . . . 79.6 134.57 1.14 Allowed Glycine 0 N--CA 1.49 2.262 0 N-CA-C 109.512 -1.435 . . . . 0.40999999999999998 109.512 -179.918 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' D' D ' 335' ' ' ARG . . . . . 0.52 ' NH1' ' HG2' ' D' ' 335' ' ' ARG . 1.4 ttt-85 -80.0 -50.4 10.45 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.208 -1.172 . . . . 3.0299999999999998 109.79 -179.731 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' D' D ' 336' ' ' GLU . . . . . . . . . . . . . 1.2 pt-20 -55.38 -48.11 74.81 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.178 -0.951 . . . . 2.2599999999999998 109.631 -179.618 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' D' D ' 337' ' ' ARG . . . . . 0.457 ' CG ' HH11 ' D' ' 337' ' ' ARG . 0.0 OUTLIER -60.41 -34.98 74.72 Favored 'General case' 0 N--CA 1.489 1.488 0 O-C-N 121.137 -0.977 . . . . 2.9199999999999999 109.507 179.914 . . . . . . . . 3 3 . 1 . 023 nuclear build core ' D' D ' 338' ' ' PHE . . . . . 0.655 ' HA ' HG21 ' D' ' 332' ' ' ILE . 62.5 t80 -55.55 -56.02 25.12 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.298 -0.876 . . . . 0.37 109.656 179.937 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' D' D ' 339' ' ' GLU . . . . . . . . . . . . . 3.4 mm-40 -51.02 -32.22 20.75 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.199 -0.938 . . . . 1.99 110.163 -179.643 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' D' D ' 340' ' ' MET . . . . . . . . . . . . . 19.3 ttp -64.45 -53.36 49.5 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.162 -0.961 . . . . 0.31 110.175 -179.433 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' D' D ' 341' ' ' PHE . . . . . . . . . . . . . 40.2 m-85 -62.47 -46.37 88.81 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.123 -0.986 . . . . 0.17999999999999999 110.166 -179.188 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' D' D ' 342' ' ' ARG . . . . . . . . . . . . . 10.7 ttp180 -48.15 -41.13 25.9 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.08 -1.013 . . . . 2.4100000000000001 109.787 -179.765 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' D' D ' 343' ' ' GLU . . . . . . . . . . . . . 9.3 tp10 -59.25 -45.77 90.3 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.292 -0.88 . . . . 2.3500000000000001 109.933 -179.697 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' D' D ' 344' ' ' LEU . . . . . 0.43 HD22 HD22 ' C' ' 344' ' ' LEU . 46.3 mt -62.76 -44.56 95.88 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.164 -0.96 . . . . 0.19 110.013 -179.639 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' D' D ' 345' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -55.37 -49.45 72.25 Favored 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.204 -0.935 . . . . 1.0900000000000001 109.64 -179.643 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' D' D ' 346' ' ' GLU . . . . . . . . . . . . . 1.1 tt0 -61.15 -35.92 78.38 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.236 -0.915 . . . . 1.6899999999999999 109.652 -179.878 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' D' D ' 347' ' ' ALA . . . . . 0.757 ' HB1' ' HB1' ' C' ' 347' ' ' ALA . . . -60.25 -50.25 74.38 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.182 -0.949 . . . . 0.17999999999999999 109.89 -179.892 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' D' D ' 348' ' ' LEU . . . . . 0.529 HD22 ' N ' ' D' ' 348' ' ' LEU . 3.7 mm? -62.04 -48.96 77.94 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.146 -0.971 . . . . 0.31 109.889 -179.685 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' D' D ' 349' ' ' GLU . . . . . . . . . . . . . 77.2 mt-10 -55.64 -35.04 65.49 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.114 -0.991 . . . . 1.95 109.81 -179.538 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' D' D ' 350' ' ' LEU . . . . . 0.81 HD13 ' CD2' ' C' ' 350' ' ' LEU . 5.8 tt -63.38 -44.47 94.65 Favored 'General case' 0 N--CA 1.489 1.479 0 O-C-N 121.267 -0.895 . . . . 0.42999999999999999 109.233 179.943 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' D' D ' 351' ' ' LYS . . . . . . . . . . . . . 19.2 tttm -57.16 -38.28 73.34 Favored 'General case' 0 N--CA 1.489 1.481 0 O-C-N 121.446 -0.784 . . . . 1.3999999999999999 109.416 179.879 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' D' D ' 352' ' ' ASP . . . . . . . . . . . . . 5.2 m-20 -55.85 -45.9 78.33 Favored 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.242 -0.911 . . . . 1.1699999999999999 109.355 179.696 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' D' D ' 353' ' ' ALA . . . . . . . . . . . . . . . -68.04 -27.94 66.96 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.201 -0.937 . . . . 0.58999999999999997 109.179 179.67 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' D' D ' 354' ' ' GLN . . . . . . . . . . . . . 11.2 tt0 . . . . . 0 N--CA 1.49 1.564 0 O-C-N 121.392 -0.818 . . . . 1.4399999999999999 109.49 179.791 . . . . . . . . 0 0 . 1 . 024 nuclear build core ' A' A ' 326' ' ' GLU . . . . . . . . . . . . . 2.2 mm-40 . . . . . 0 N--CA 1.492 1.653 0 CA-C-O 121.31 0.576 . . . . 2.1299999999999999 109.627 . . . . . . . . . 0 0 . 1 . 024 nuclear build core ' A' A ' 327' ' ' TYR . . . . . 0.525 ' CE1' ' HG2' ' C' ' 333' ' ' ARG . 43.2 m-85 -149.83 112.18 4.69 Favored 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.297 -0.877 . . . . 0.47999999999999998 109.737 179.889 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 328' ' ' PHE . . . . . 0.504 ' CE1' ' HA ' ' C' ' 335' ' ' ARG . 71.0 m-85 -113.93 -168.81 1.4 Allowed 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.252 -0.905 . . . . 0.31 109.187 179.69 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 329' ' ' THR . . . . . 0.403 HG23 ' O ' ' A' ' 328' ' ' PHE . 40.3 p -154.58 167.54 29.77 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.2 -0.938 . . . . 0.22 109.451 -179.992 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 330' ' ' LEU . . . . . . . . . . . . . 24.2 tp -150.37 131.42 14.36 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.254 -0.904 . . . . 0.28000000000000003 109.477 -179.888 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 331' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -87.13 111.94 21.44 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.3 -0.875 . . . . 0.91000000000000003 109.436 179.861 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 332' ' ' ILE . . . . . 0.534 HG21 ' HA ' ' A' ' 338' ' ' PHE . 97.0 mt -103.56 104.03 16.07 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.592 0 O-C-N 121.232 -0.918 . . . . 0.26000000000000001 109.529 -179.986 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 333' ' ' ARG . . . . . 0.596 ' HG2' ' CE2' ' C' ' 327' ' ' TYR . 13.3 mtp180 -72.53 149.99 43.59 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.259 -0.9 . . . . 2.9199999999999999 109.479 179.868 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 334' ' ' GLY . . . . . . . . . . . . . . . 86.37 131.14 2.86 Favored Glycine 0 N--CA 1.493 2.438 0 N-CA-C 109.84 -1.304 . . . . 0.40000000000000002 109.84 179.606 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 335' ' ' ARG . . . . . 0.457 ' O ' ' HB3' ' A' ' 338' ' ' PHE . 0.0 OUTLIER -80.26 -39.07 29.66 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.33 -1.1 . . . . 3.0099999999999998 109.586 179.874 . . . . . . . . 3 3 . 1 . 024 nuclear build core ' A' A ' 336' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -57.99 -61.74 2.32 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.17 -0.956 . . . . 2.29 110.106 -179.561 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 337' ' ' ARG . . . . . 0.497 ' NE ' HD12 ' C' ' 348' ' ' LEU . 0.0 OUTLIER -59.96 -26.37 65.94 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.137 -0.977 . . . . 2.9300000000000002 109.788 -179.509 . . . . . . . . 3 3 . 1 . 024 nuclear build core ' A' A ' 338' ' ' PHE . . . . . 0.534 ' HA ' HG21 ' A' ' 332' ' ' ILE . 50.8 t80 -55.67 -58.6 7.13 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.149 -0.969 . . . . 0.38 109.732 -179.869 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 339' ' ' GLU . . . . . . . . . . . . . 55.9 mt-10 -50.71 -32.94 20.97 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.269 -0.894 . . . . 1.97 109.876 -179.653 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 340' ' ' MET . . . . . . . . . . . . . 23.0 ttp -63.56 -51.19 66.44 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.107 -0.996 . . . . 0.31 110.044 -179.509 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 341' ' ' PHE . . . . . 0.434 ' HB2' HD13 ' A' ' 332' ' ' ILE . 36.7 m-85 -62.0 -45.84 91.85 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.166 -0.959 . . . . 0.17999999999999999 110.081 -179.557 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 342' ' ' ARG . . . . . 0.473 ' NH1' ' HG3' ' A' ' 342' ' ' ARG . 0.0 OUTLIER -49.58 -42.55 44.78 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.14 -0.975 . . . . 2.4199999999999999 110.047 -179.499 . . . . . . . . 3 3 . 1 . 024 nuclear build core ' A' A ' 343' ' ' GLU . . . . . . . . . . . . . 1.6 tt0 -58.61 -47.93 82.69 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.099 -1.0 . . . . 2.3500000000000001 109.817 -179.57 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 344' ' ' LEU . . . . . 0.592 ' CD2' HD22 ' B' ' 344' ' ' LEU . 50.3 mt -61.39 -33.28 73.4 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.163 -0.961 . . . . 0.17999999999999999 109.536 -179.794 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 345' ' ' ASN . . . . . . . . . . . . . 21.6 t-20 -57.82 -59.25 5.52 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.249 -0.907 . . . . 1.0900000000000001 109.807 -179.944 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 346' ' ' GLU . . . . . . . . . . . . . 72.4 tt0 -62.16 -28.19 69.48 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.284 -0.885 . . . . 1.6499999999999999 110.136 -179.592 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 347' ' ' ALA . . . . . 0.769 ' HB1' ' HB1' ' B' ' 347' ' ' ALA . . . -60.71 -56.91 15.64 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.11 -0.994 . . . . 0.17999999999999999 110.006 -179.64 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 348' ' ' LEU . . . . . 0.539 HD22 ' N ' ' A' ' 348' ' ' LEU . 4.0 mm? -61.92 -46.49 89.13 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.13 -0.981 . . . . 0.29999999999999999 110.134 -179.56 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 349' ' ' GLU . . . . . . . . . . . . . 33.3 mm-40 -57.17 -33.22 67.21 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.196 -0.94 . . . . 1.9399999999999999 109.973 -179.452 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 350' ' ' LEU . . . . . 0.782 HD13 HD22 ' B' ' 350' ' ' LEU . 5.8 tt -64.66 -48.54 74.4 Favored 'General case' 0 N--CA 1.489 1.482 0 O-C-N 121.133 -0.98 . . . . 0.46000000000000002 109.516 -179.883 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 351' ' ' LYS . . . . . . . . . . . . . 22.1 tttm -58.1 -39.57 78.98 Favored 'General case' 0 N--CA 1.488 1.469 0 O-C-N 121.343 -0.848 . . . . 1.3999999999999999 109.413 -179.916 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 352' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -57.82 -52.5 65.21 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.295 -0.878 . . . . 1.1599999999999999 109.856 179.975 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 353' ' ' ALA . . . . . . . . . . . . . . . -66.47 -10.01 40.04 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.26 -0.9 . . . . 0.63 109.823 -179.547 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 354' ' ' GLN . . . . . . . . . . . . . 3.5 tt0 . . . . . 0 N--CA 1.49 1.548 0 O-C-N 121.132 -0.98 . . . . 1.47 109.692 -179.98 . . . . . . . . 0 0 . 1 . 024 nuclear build core ' B' B ' 326' ' ' GLU . . . . . . . . . . . . . 2.2 mm-40 . . . . . 0 N--CA 1.492 1.628 0 CA-C-O 121.357 0.599 . . . . 2.1299999999999999 109.696 . . . . . . . . . 0 0 . 1 . 024 nuclear build core ' B' B ' 327' ' ' TYR . . . . . 0.597 ' CE1' ' HG2' ' D' ' 333' ' ' ARG . 42.5 m-85 -149.93 112.11 4.64 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.298 -0.876 . . . . 0.47999999999999998 109.755 179.977 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' B' B ' 328' ' ' PHE . . . . . 0.463 ' CE1' ' HA ' ' D' ' 335' ' ' ARG . 71.3 m-85 -113.81 -168.75 1.39 Allowed 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.242 -0.911 . . . . 0.32000000000000001 109.252 179.754 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' B' B ' 329' ' ' THR . . . . . 0.405 HG23 ' O ' ' B' ' 328' ' ' PHE . 40.1 p -154.6 167.3 30.59 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.269 -0.894 . . . . 0.23000000000000001 109.379 179.981 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' B' B ' 330' ' ' LEU . . . . . . . . . . . . . 24.2 tp -150.25 131.29 14.35 Favored 'General case' 0 N--CA 1.489 1.497 0 O-C-N 121.158 -0.964 . . . . 0.28000000000000003 109.483 -179.867 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' B' B ' 331' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -87.02 111.95 21.37 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.3 -0.875 . . . . 0.91000000000000003 109.428 179.927 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' B' B ' 332' ' ' ILE . . . . . 0.527 HG21 ' HA ' ' B' ' 338' ' ' PHE . 97.0 mt -103.51 103.88 15.83 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.534 0 O-C-N 121.226 -0.921 . . . . 0.23999999999999999 109.602 179.937 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' B' B ' 333' ' ' ARG . . . . . 0.545 ' HG2' ' CE1' ' D' ' 327' ' ' TYR . 12.9 mtp180 -72.5 150.32 43.35 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.364 -0.835 . . . . 2.9300000000000002 109.544 179.835 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' B' B ' 334' ' ' GLY . . . . . . . . . . . . . . . 86.07 131.0 2.71 Favored Glycine 0 N--CA 1.492 2.41 0 N-CA-C 109.812 -1.315 . . . . 0.40000000000000002 109.812 179.679 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' B' B ' 335' ' ' ARG . . . . . 0.462 ' O ' ' HB3' ' B' ' 338' ' ' PHE . 0.0 OUTLIER -80.31 -38.85 29.87 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.301 -1.117 . . . . 3.0099999999999998 109.625 179.905 . . . . . . . . 3 3 . 1 . 024 nuclear build core ' B' B ' 336' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -58.02 -61.83 2.26 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.21 -0.932 . . . . 2.2799999999999998 110.056 -179.622 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' B' B ' 337' ' ' ARG . . . . . 0.481 ' NH1' ' HG2' ' B' ' 337' ' ' ARG . 0.0 OUTLIER -59.83 -26.55 65.88 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.067 -1.021 . . . . 2.9300000000000002 109.818 -179.559 . . . . . . . . 3 3 . 1 . 024 nuclear build core ' B' B ' 338' ' ' PHE . . . . . 0.527 ' HA ' HG21 ' B' ' 332' ' ' ILE . 50.5 t80 -55.41 -58.85 6.06 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.11 -0.993 . . . . 0.37 109.692 -179.858 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' B' B ' 339' ' ' GLU . . . . . . . . . . . . . 56.8 mt-10 -50.62 -32.7 19.7 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.348 -0.845 . . . . 1.98 110.045 -179.666 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' B' B ' 340' ' ' MET . . . . . . . . . . . . . 23.9 ttp -63.79 -51.12 66.23 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.126 -0.983 . . . . 0.32000000000000001 110.013 -179.54 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' B' B ' 341' ' ' PHE . . . . . 0.426 ' HB2' HD13 ' B' ' 332' ' ' ILE . 36.4 m-85 -62.09 -45.84 91.72 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.169 -0.957 . . . . 0.17999999999999999 109.988 -179.569 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' B' B ' 342' ' ' ARG . . . . . 0.458 ' NH1' ' HG3' ' B' ' 342' ' ' ARG . 0.0 OUTLIER -49.59 -42.67 45.17 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.127 -0.983 . . . . 2.4199999999999999 110.065 -179.578 . . . . . . . . 3 3 . 1 . 024 nuclear build core ' B' B ' 343' ' ' GLU . . . . . . . . . . . . . 1.6 tt0 -58.61 -47.95 82.64 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.072 -1.017 . . . . 2.3500000000000001 109.856 -179.575 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' B' B ' 344' ' ' LEU . . . . . 0.592 HD22 ' CD2' ' A' ' 344' ' ' LEU . 50.4 mt -61.32 -33.24 73.28 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.155 -0.966 . . . . 0.17999999999999999 109.544 -179.848 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' B' B ' 345' ' ' ASN . . . . . . . . . . . . . 21.5 t-20 -57.93 -59.28 5.5 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.225 -0.922 . . . . 1.0900000000000001 109.731 -179.952 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' B' B ' 346' ' ' GLU . . . . . . . . . . . . . 71.8 tt0 -62.05 -28.53 69.66 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.267 -0.896 . . . . 1.6599999999999999 110.076 -179.605 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' B' B ' 347' ' ' ALA . . . . . 0.769 ' HB1' ' HB1' ' A' ' 347' ' ' ALA . . . -60.42 -56.94 15.38 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.09 -1.006 . . . . 0.17000000000000001 109.992 -179.567 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' B' B ' 348' ' ' LEU . . . . . 0.53 HD22 ' N ' ' B' ' 348' ' ' LEU . 4.0 mm? -61.95 -46.64 88.41 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.179 -0.95 . . . . 0.28999999999999998 110.131 -179.491 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' B' B ' 349' ' ' GLU . . . . . . . . . . . . . 32.7 mm-40 -56.98 -33.26 66.93 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.133 -0.979 . . . . 1.95 110.092 -179.469 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' B' B ' 350' ' ' LEU . . . . . 0.782 HD22 HD13 ' A' ' 350' ' ' LEU . 5.8 tt -64.65 -48.42 74.86 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.17 -0.956 . . . . 0.45000000000000001 109.48 -179.919 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' B' B ' 351' ' ' LYS . . . . . . . . . . . . . 22.2 tttm -58.27 -39.33 78.97 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.349 -0.844 . . . . 1.3799999999999999 109.359 -179.907 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' B' B ' 352' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -58.01 -52.47 65.38 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.313 -0.867 . . . . 1.1599999999999999 109.88 -179.984 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' B' B ' 353' ' ' ALA . . . . . . . . . . . . . . . -66.55 -9.94 40.09 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.298 -0.877 . . . . 0.60999999999999999 109.847 -179.56 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' B' B ' 354' ' ' GLN . . . . . . . . . . . . . 3.5 tt0 . . . . . 0 N--CA 1.49 1.547 0 O-C-N 121.125 -0.984 . . . . 1.45 109.621 179.955 . . . . . . . . 0 0 . 1 . 024 nuclear build core ' C' C ' 326' ' ' GLU . . . . . 0.421 ' O ' ' CD1' ' C' ' 327' ' ' TYR . 30.6 mm-40 . . . . . 0 N--CA 1.491 1.589 0 N-CA-C 109.402 -0.592 . . . . 2.1699999999999999 109.402 . . . . . . . . . 1 1 . 1 . 024 nuclear build core ' C' C ' 327' ' ' TYR . . . . . 0.596 ' CE2' ' HG2' ' A' ' 333' ' ' ARG . 44.1 m-85 -149.36 114.31 5.41 Favored 'General case' 0 N--CA 1.488 1.437 0 O-C-N 121.254 -0.904 . . . . 0.47999999999999998 109.819 -179.878 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' C' C ' 328' ' ' PHE . . . . . 0.44 ' CE2' ' HA ' ' A' ' 335' ' ' ARG . 86.5 m-85 -113.27 -173.54 2.28 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.316 -0.865 . . . . 0.33000000000000002 109.132 179.595 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' C' C ' 329' ' ' THR . . . . . . . . . . . . . 22.6 p -152.38 165.2 35.74 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.12 -0.987 . . . . 0.23000000000000001 109.664 -179.851 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' C' C ' 330' ' ' LEU . . . . . . . . . . . . . 14.4 tp -151.32 129.23 11.7 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.339 -0.851 . . . . 0.28000000000000003 109.508 -179.853 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' C' C ' 331' ' ' GLN . . . . . 0.417 ' OE1' ' HB3' ' A' ' 327' ' ' TYR . 0.0 OUTLIER -89.13 116.56 27.48 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.174 -0.954 . . . . 1.48 109.837 -179.971 . . . . . . . . 3 3 . 1 . 024 nuclear build core ' C' C ' 332' ' ' ILE . . . . . 0.431 HD13 ' CD2' ' C' ' 341' ' ' PHE . 87.6 mt -104.06 112.36 37.3 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.621 0 O-C-N 121.201 -0.937 . . . . 0.23999999999999999 109.555 179.661 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' C' C ' 333' ' ' ARG . . . . . 0.525 ' HG2' ' CE1' ' A' ' 327' ' ' TYR . 46.2 mtt180 -72.02 144.04 48.94 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.12 -0.988 . . . . 2.7400000000000002 109.321 179.711 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' C' C ' 334' ' ' GLY . . . . . . . . . . . . . . . 89.15 128.34 3.27 Favored Glycine 0 N--CA 1.492 2.385 0 N-CA-C 109.48 -1.448 . . . . 0.34999999999999998 109.48 -179.846 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' C' C ' 335' ' ' ARG . . . . . 0.504 ' HA ' ' CE1' ' A' ' 328' ' ' PHE . 37.1 ttp180 -78.98 -35.59 42.75 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.19 -1.183 . . . . 2.5299999999999998 109.676 -179.88 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' C' C ' 336' ' ' GLU . . . . . . . . . . . . . 2.0 tt0 -57.0 -60.4 3.64 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.247 -0.908 . . . . 2.6200000000000001 109.678 -179.808 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' C' C ' 337' ' ' ARG . . . . . 0.45 ' CG ' HH11 ' C' ' 337' ' ' ARG . 0.0 OUTLIER -59.51 -28.31 66.94 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.308 -0.87 . . . . 2.8100000000000001 109.553 -179.811 . . . . . . . . 3 3 . 1 . 024 nuclear build core ' C' C ' 338' ' ' PHE . . . . . 0.467 ' HB3' ' O ' ' C' ' 335' ' ' ARG . 58.1 t80 -54.07 -55.37 28.14 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.249 -0.907 . . . . 0.40000000000000002 109.352 -179.962 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' C' C ' 339' ' ' GLU . . . . . . . . . . . . . 41.5 mt-10 -52.42 -32.08 37.46 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.242 -0.911 . . . . 2.0499999999999998 109.755 -179.997 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' C' C ' 340' ' ' MET . . . . . 0.436 ' HB3' ' O ' ' C' ' 337' ' ' ARG . 3.8 ttp -63.92 -55.03 25.62 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.227 -0.921 . . . . 0.32000000000000001 110.285 -179.402 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' C' C ' 341' ' ' PHE . . . . . 0.431 ' CD2' HD13 ' C' ' 332' ' ' ILE . 48.5 m-85 -61.0 -46.16 91.9 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.167 -0.958 . . . . 0.17999999999999999 109.701 -179.448 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' C' C ' 342' ' ' ARG . . . . . 0.404 ' CG ' HH11 ' C' ' 342' ' ' ARG . 0.2 OUTLIER -47.72 -41.47 22.96 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.287 -0.883 . . . . 2.9100000000000001 109.278 179.761 . . . . . . . . 3 3 . 1 . 024 nuclear build core ' C' C ' 343' ' ' GLU . . . . . . . . . . . . . 43.3 tt0 -61.17 -48.74 80.18 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.245 -0.909 . . . . 2.1400000000000001 109.951 -179.869 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' C' C ' 344' ' ' LEU . . . . . . . . . . . . . 35.4 mt -60.88 -30.14 69.97 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.135 -0.978 . . . . 0.22 109.828 -179.517 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' C' C ' 345' ' ' ASN . . . . . . . . . . . . . 25.8 t-20 -57.77 -58.31 8.91 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.261 -0.9 . . . . 1.0800000000000001 109.488 179.879 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' C' C ' 346' ' ' GLU . . . . . 0.434 ' O ' ' HB2' ' C' ' 350' ' ' LEU . 20.1 tt0 -61.67 -25.63 67.51 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.301 -0.875 . . . . 2.21 109.922 -179.71 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' C' C ' 347' ' ' ALA . . . . . 0.469 ' O ' ' HB3' ' C' ' 350' ' ' LEU . . . -62.41 -55.62 26.07 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.106 -0.996 . . . . 0.17999999999999999 109.715 -179.815 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' C' C ' 348' ' ' LEU . . . . . 0.622 ' N ' HD22 ' C' ' 348' ' ' LEU . 4.1 mm? -63.19 -55.91 21.11 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.131 -0.981 . . . . 0.32000000000000001 109.969 -179.557 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' C' C ' 349' ' ' GLU . . . . . 0.426 ' OE2' ' HD3' ' A' ' 333' ' ' ARG . 41.6 mt-10 -56.61 -25.89 54.23 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.103 -0.998 . . . . 2.1899999999999999 109.24 -179.782 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' C' C ' 350' ' ' LEU . . . . . 1.132 HD11 HD22 ' D' ' 350' ' ' LEU . 0.5 OUTLIER -65.62 -49.45 68.66 Favored 'General case' 0 C--N 1.301 -1.516 0 N-CA-C 108.811 -0.811 . . . . 0.46000000000000002 108.811 179.813 . . . . . . . . 3 3 . 1 . 024 nuclear build core ' C' C ' 351' ' ' LYS . . . . . 0.546 ' N ' HD13 ' C' ' 350' ' ' LEU . 6.3 tttt -62.27 -41.95 98.92 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.291 -0.881 . . . . 1.3500000000000001 109.298 179.319 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' C' C ' 352' ' ' ASP . . . . . . . . . . . . . 43.3 m-20 -56.06 -28.19 56.56 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.341 -0.849 . . . . 1.1899999999999999 109.836 -179.867 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' C' C ' 353' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 1.638 0 O-C-N 121.227 -0.92 . . . . 0.56999999999999995 109.78 -179.645 . . . . . . . . 0 0 . 1 . 024 nuclear build core ' D' D ' 326' ' ' GLU . . . . . . . . . . . . . 2.2 mm-40 . . . . . 0 N--CA 1.491 1.601 0 CA-C-O 121.335 0.588 . . . . 2.1299999999999999 109.551 . . . . . . . . . 0 0 . 1 . 024 nuclear build core ' D' D ' 327' ' ' TYR . . . . . 0.545 ' CE1' ' HG2' ' B' ' 333' ' ' ARG . 43.0 m-85 -149.71 112.34 4.76 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.367 -0.833 . . . . 0.46999999999999997 109.74 179.936 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' D' D ' 328' ' ' PHE . . . . . 0.404 ' O ' HG23 ' D' ' 329' ' ' THR . 71.8 m-85 -113.94 -168.68 1.39 Allowed 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.277 -0.889 . . . . 0.29999999999999999 109.201 179.737 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' D' D ' 329' ' ' THR . . . . . 0.404 HG23 ' O ' ' D' ' 328' ' ' PHE . 39.5 p -154.59 167.34 30.43 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.19 -0.944 . . . . 0.22 109.41 179.987 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' D' D ' 330' ' ' LEU . . . . . . . . . . . . . 24.6 tp -150.24 131.36 14.43 Favored 'General case' 0 N--CA 1.488 1.472 0 O-C-N 121.239 -0.913 . . . . 0.28000000000000003 109.512 -179.878 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' D' D ' 331' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -87.13 111.85 21.35 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.351 -0.843 . . . . 0.93000000000000005 109.434 179.971 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' D' D ' 332' ' ' ILE . . . . . 0.545 HG21 ' HA ' ' D' ' 338' ' ' PHE . 97.0 mt -103.46 103.8 15.7 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.533 0 O-C-N 121.145 -0.972 . . . . 0.25 109.708 179.994 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' D' D ' 333' ' ' ARG . . . . . 0.597 ' HG2' ' CE1' ' B' ' 327' ' ' TYR . 13.2 mtp180 -72.57 150.11 43.42 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.256 -0.903 . . . . 2.9300000000000002 109.458 179.887 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' D' D ' 334' ' ' GLY . . . . . . . . . . . . . . . 86.31 130.94 2.8 Favored Glycine 0 N--CA 1.491 2.333 0 N-CA-C 109.815 -1.314 . . . . 0.40999999999999998 109.815 179.723 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' D' D ' 335' ' ' ARG . . . . . 0.463 ' HA ' ' CE1' ' B' ' 328' ' ' PHE . 0.0 OUTLIER -80.28 -38.94 29.83 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.308 -1.113 . . . . 3.0299999999999998 109.575 179.883 . . . . . . . . 3 3 . 1 . 024 nuclear build core ' D' D ' 336' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -58.08 -61.79 2.29 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.241 -0.912 . . . . 2.2599999999999998 110.031 -179.597 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' D' D ' 337' ' ' ARG . . . . . 0.474 ' NH1' ' HG2' ' D' ' 337' ' ' ARG . 0.0 OUTLIER -59.86 -26.38 65.79 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.175 -0.953 . . . . 2.9199999999999999 109.862 -179.579 . . . . . . . . 3 3 . 1 . 024 nuclear build core ' D' D ' 338' ' ' PHE . . . . . 0.545 ' HA ' HG21 ' D' ' 332' ' ' ILE . 51.0 t80 -55.58 -58.7 6.71 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.195 -0.941 . . . . 0.37 109.725 -179.869 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' D' D ' 339' ' ' GLU . . . . . . . . . . . . . 55.6 mt-10 -50.63 -32.7 19.72 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.301 -0.874 . . . . 1.99 110.067 -179.711 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' D' D ' 340' ' ' MET . . . . . . . . . . . . . 23.2 ttp -63.78 -51.18 65.99 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.181 -0.95 . . . . 0.31 110.008 -179.62 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' D' D ' 341' ' ' PHE . . . . . 0.449 ' HB2' HD13 ' D' ' 332' ' ' ILE . 36.6 m-85 -62.01 -45.88 91.66 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.224 -0.922 . . . . 0.17999999999999999 110.064 -179.55 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' D' D ' 342' ' ' ARG . . . . . 0.461 ' NH1' ' HG3' ' D' ' 342' ' ' ARG . 0.0 OUTLIER -49.58 -42.42 44.39 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.086 -1.009 . . . . 2.4100000000000001 110.094 -179.513 . . . . . . . . 3 3 . 1 . 024 nuclear build core ' D' D ' 343' ' ' GLU . . . . . . . . . . . . . 1.6 tt0 -58.81 -47.69 83.93 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.018 -1.051 . . . . 2.3500000000000001 109.886 -179.538 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' D' D ' 344' ' ' LEU . . . . . . . . . . . . . 49.5 mt -61.59 -33.13 73.35 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.106 -0.996 . . . . 0.19 109.435 -179.776 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' D' D ' 345' ' ' ASN . . . . . . . . . . . . . 21.7 t-20 -58.03 -59.14 5.73 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.299 -0.875 . . . . 1.0900000000000001 109.716 -179.851 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' D' D ' 346' ' ' GLU . . . . . . . . . . . . . 72.1 tt0 -62.11 -28.61 69.75 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.337 -0.852 . . . . 1.6899999999999999 110.059 -179.641 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' D' D ' 347' ' ' ALA . . . . . . . . . . . . . . . -60.24 -57.05 14.45 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.084 -1.01 . . . . 0.17999999999999999 110.063 -179.641 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' D' D ' 348' ' ' LEU . . . . . 0.533 HD22 ' N ' ' D' ' 348' ' ' LEU . 4.0 mm? -61.92 -46.59 88.69 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.246 -0.909 . . . . 0.31 110.106 -179.426 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' D' D ' 349' ' ' GLU . . . . . . . . . . . . . 33.6 mm-40 -56.97 -33.41 67.06 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.187 -0.946 . . . . 1.95 109.964 -179.397 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' D' D ' 350' ' ' LEU . . . . . 1.132 HD22 HD11 ' C' ' 350' ' ' LEU . 5.8 tt -64.64 -48.19 75.74 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.15 -0.969 . . . . 0.42999999999999999 109.666 -179.921 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' D' D ' 351' ' ' LYS . . . . . . . . . . . . . 22.3 tttm -58.43 -39.49 79.94 Favored 'General case' 0 N--CA 1.487 1.414 0 O-C-N 121.24 -0.913 . . . . 1.3999999999999999 109.349 -179.874 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' D' D ' 352' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -57.97 -52.39 65.72 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.28 -0.887 . . . . 1.1699999999999999 109.829 179.929 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' D' D ' 353' ' ' ALA . . . . . . . . . . . . . . . -66.58 -9.93 40.33 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.21 -0.931 . . . . 0.58999999999999997 109.783 -179.483 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' D' D ' 354' ' ' GLN . . . . . . . . . . . . . 2.5 tt0 . . . . . 0 N--CA 1.49 1.569 0 O-C-N 121.134 -0.979 . . . . 1.4399999999999999 109.613 179.996 . . . . . . . . 0 0 . 1 . 025 nuclear build core ' A' A ' 326' ' ' GLU . . . . . . . . . . . . . 3.0 mm-40 . . . . . 0 N--CA 1.49 1.551 0 N-CA-C 109.371 -0.603 . . . . 2.1299999999999999 109.371 . . . . . . . . . 0 0 . 1 . 025 nuclear build core ' A' A ' 327' ' ' TYR . . . . . 0.417 ' CE1' ' HG2' ' C' ' 333' ' ' ARG . 48.4 m-85 -148.92 106.28 3.63 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.163 -0.96 . . . . 0.47999999999999998 109.629 -179.919 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 328' ' ' PHE . . . . . . . . . . . . . 68.6 m-85 -112.97 -164.08 0.89 Allowed 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.23 -0.919 . . . . 0.31 109.55 179.834 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 329' ' ' THR . . . . . . . . . . . . . 20.9 p -153.83 173.96 15.21 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.228 -0.92 . . . . 0.22 109.227 179.833 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 330' ' ' LEU . . . . . 0.447 HD21 HD22 ' C' ' 345' ' ' ASN . 28.8 tp -152.16 131.95 13.25 Favored 'General case' 0 N--CA 1.489 1.476 0 O-C-N 120.94 -1.1 . . . . 0.28000000000000003 109.833 -179.891 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 331' ' ' GLN . . . . . . . . . . . . . 6.4 tp-100 -88.97 107.34 18.97 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.354 -0.841 . . . . 0.91000000000000003 109.192 179.533 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 332' ' ' ILE . . . . . . . . . . . . . 36.9 mt -103.3 107.21 21.64 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.624 0 O-C-N 121.112 -0.993 . . . . 0.26000000000000001 109.778 -179.792 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 333' ' ' ARG . . . . . 0.601 ' HG2' ' CE2' ' C' ' 327' ' ' TYR . 0.0 OUTLIER -73.45 155.88 38.82 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.39 -0.819 . . . . 2.9199999999999999 109.393 179.702 . . . . . . . . 3 3 . 1 . 025 nuclear build core ' A' A ' 334' ' ' GLY . . . . . . . . . . . . . . . 77.13 128.23 0.35 Allowed Glycine 0 N--CA 1.492 2.433 0 N-CA-C 109.898 -1.281 . . . . 0.40000000000000002 109.898 179.584 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 335' ' ' ARG . . . . . 0.56 ' HG3' ' CE2' ' C' ' 328' ' ' PHE . 1.7 ttt-85 -80.0 -36.1 36.44 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.371 -1.076 . . . . 3.0099999999999998 109.543 179.862 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 336' ' ' GLU . . . . . . . . . . . . . 2.2 tm-20 -56.22 -64.84 0.73 Allowed 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.27 -0.893 . . . . 2.29 109.723 -179.84 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 337' ' ' ARG . . . . . 0.714 ' HE ' HD12 ' C' ' 348' ' ' LEU . 0.0 OUTLIER -60.78 -28.9 69.09 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.339 -0.851 . . . . 2.9300000000000002 109.542 -179.675 . . . . . . . . 3 3 . 1 . 025 nuclear build core ' A' A ' 338' ' ' PHE . . . . . . . . . . . . . 52.3 t80 -55.52 -60.17 3.8 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.163 -0.96 . . . . 0.38 109.462 -179.925 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 339' ' ' GLU . . . . . . . . . . . . . 65.0 mm-40 -51.24 -30.09 16.45 Favored 'General case' 0 N--CA 1.488 1.456 0 O-C-N 121.357 -0.839 . . . . 1.97 109.757 -179.903 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 340' ' ' MET . . . . . 0.432 ' HB3' ' O ' ' A' ' 337' ' ' ARG . 7.6 ttp -64.19 -50.45 68.03 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.175 -0.953 . . . . 0.31 109.575 -179.95 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 341' ' ' PHE . . . . . . . . . . . . . 45.5 m-85 -63.0 -45.7 91.14 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.33 -0.856 . . . . 0.17999999999999999 109.981 -179.703 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 342' ' ' ARG . . . . . . . . . . . . . 5.4 ttm180 -49.29 -40.99 36.82 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.122 -0.986 . . . . 2.4199999999999999 109.915 -179.535 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 343' ' ' GLU . . . . . . . . . . . . . 1.4 tt0 -58.71 -43.78 90.18 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.145 -0.972 . . . . 2.3500000000000001 109.806 -179.714 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 344' ' ' LEU . . . . . 0.762 HD22 HD22 ' B' ' 344' ' ' LEU . 42.9 mt -63.28 -46.15 88.17 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.239 -0.913 . . . . 0.17999999999999999 109.876 -179.749 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 345' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -55.61 -46.95 77.27 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.115 -0.991 . . . . 1.0900000000000001 109.923 -179.481 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 346' ' ' GLU . . . . . . . . . . . . . 1.4 tp10 -60.72 -36.39 78.72 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.179 -0.951 . . . . 1.6499999999999999 109.776 -179.66 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 347' ' ' ALA . . . . . 1.04 ' HB1' ' HB1' ' B' ' 347' ' ' ALA . . . -59.4 -51.1 71.37 Favored 'General case' 0 N--CA 1.493 1.692 0 O-C-N 121.222 -0.924 . . . . 0.17999999999999999 109.944 -179.712 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 348' ' ' LEU . . . . . 0.597 HD22 ' N ' ' A' ' 348' ' ' LEU . 4.1 mm? -61.78 -43.86 98.01 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.237 -0.914 . . . . 0.29999999999999999 109.658 -179.721 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 349' ' ' GLU . . . . . . . . . . . . . 2.2 mm-40 -59.17 -34.16 71.77 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.199 -0.938 . . . . 1.9399999999999999 110.244 -179.551 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 350' ' ' LEU . . . . . 0.604 HD22 HD13 ' B' ' 350' ' ' LEU . 6.7 tt -63.12 -43.72 97.63 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.074 -1.016 . . . . 0.46000000000000002 109.465 -179.773 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 351' ' ' LYS . . . . . . . . . . . . . 25.5 tttm -56.67 -42.73 79.51 Favored 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.22 -0.925 . . . . 1.3999999999999999 109.861 -179.679 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 352' ' ' ASP . . . . . . . . . . . . . 36.2 m-20 -58.69 -49.92 75.78 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.186 -0.946 . . . . 1.1599999999999999 109.817 179.974 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 353' ' ' ALA . . . . . . . . . . . . . . . -67.65 -10.27 50.73 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.27 -0.894 . . . . 0.63 109.534 -179.776 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 354' ' ' GLN . . . . . 0.448 ' OE1' HD11 ' B' ' 350' ' ' LEU . 8.1 tt0 . . . . . 0 C--N 1.302 -1.473 0 O-C-N 121.25 -0.906 . . . . 1.47 109.767 -179.917 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' B' B ' 326' ' ' GLU . . . . . . . . . . . . . 3.0 mm-40 . . . . . 0 N--CA 1.488 1.452 0 N-CA-C 109.349 -0.611 . . . . 2.1299999999999999 109.349 . . . . . . . . . 0 0 . 1 . 025 nuclear build core ' B' B ' 327' ' ' TYR . . . . . 0.59 ' CE1' ' HG2' ' D' ' 333' ' ' ARG . 47.6 m-85 -148.55 106.16 3.67 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.224 -0.923 . . . . 0.47999999999999998 109.633 -179.841 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' B' B ' 328' ' ' PHE . . . . . 0.416 ' CZ ' ' HG3' ' D' ' 335' ' ' ARG . 66.7 m-85 -113.22 -164.5 0.92 Allowed 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.287 -0.883 . . . . 0.32000000000000001 109.546 179.797 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' B' B ' 329' ' ' THR . . . . . . . . . . . . . 20.8 p -153.4 174.41 14.39 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.297 -0.877 . . . . 0.23000000000000001 109.276 -179.956 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' B' B ' 330' ' ' LEU . . . . . . . . . . . . . 28.3 tp -152.75 131.53 12.41 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.062 -1.024 . . . . 0.28000000000000003 109.917 -179.826 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' B' B ' 331' ' ' GLN . . . . . 0.43 ' NE2' ' O ' ' D' ' 328' ' ' PHE . 45.8 tp60 -88.81 107.91 19.23 Favored 'General case' 0 N--CA 1.489 1.48 0 O-C-N 121.33 -0.857 . . . . 0.91000000000000003 109.135 179.507 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' B' B ' 332' ' ' ILE . . . . . . . . . . . . . 35.2 mt -103.84 107.15 21.62 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.584 0 O-C-N 121.136 -0.977 . . . . 0.23999999999999999 109.618 -179.728 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' B' B ' 333' ' ' ARG . . . . . 0.529 ' HG2' ' CE1' ' D' ' 327' ' ' TYR . 0.0 OUTLIER -73.66 155.05 39.42 Favored 'General case' 0 N--CA 1.488 1.46 0 O-C-N 121.293 -0.879 . . . . 2.9300000000000002 109.347 179.695 . . . . . . . . 3 3 . 1 . 025 nuclear build core ' B' B ' 334' ' ' GLY . . . . . . . . . . . . . . . 78.05 128.39 0.45 Allowed Glycine 0 N--CA 1.492 2.369 0 N-CA-C 109.965 -1.254 . . . . 0.40000000000000002 109.965 179.702 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' B' B ' 335' ' ' ARG . . . . . 0.499 ' NH1' ' HG2' ' B' ' 335' ' ' ARG . 1.7 ttt-85 -80.01 -35.8 36.83 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.308 -1.113 . . . . 3.0099999999999998 109.467 179.845 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' B' B ' 336' ' ' GLU . . . . . . . . . . . . . 2.3 tm-20 -56.49 -65.43 0.61 Allowed 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.333 -0.854 . . . . 2.2799999999999998 109.725 -179.699 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' B' B ' 337' ' ' ARG . . . . . 0.582 ' HE ' HD12 ' D' ' 348' ' ' LEU . 0.0 OUTLIER -60.18 -29.25 68.57 Favored 'General case' 0 N--CA 1.488 1.463 0 O-C-N 121.283 -0.886 . . . . 2.9300000000000002 109.647 -179.789 . . . . . . . . 3 3 . 1 . 025 nuclear build core ' B' B ' 338' ' ' PHE . . . . . . . . . . . . . 53.1 t80 -55.03 -59.83 4.2 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.243 -0.911 . . . . 0.37 109.542 -179.949 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' B' B ' 339' ' ' GLU . . . . . . . . . . . . . 62.4 mm-40 -51.6 -30.08 19.8 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.34 -0.85 . . . . 1.98 109.71 -179.963 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' B' B ' 340' ' ' MET . . . . . 0.44 ' HB3' ' O ' ' B' ' 337' ' ' ARG . 7.0 ttp -64.16 -50.91 66.32 Favored 'General case' 0 N--CA 1.489 1.499 0 O-C-N 121.192 -0.942 . . . . 0.32000000000000001 109.592 -179.732 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' B' B ' 341' ' ' PHE . . . . . . . . . . . . . 47.0 m-85 -62.46 -46.24 89.41 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.231 -0.918 . . . . 0.17999999999999999 109.939 -179.822 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' B' B ' 342' ' ' ARG . . . . . . . . . . . . . 5.4 ttm180 -48.98 -41.04 32.91 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.182 -0.949 . . . . 2.4199999999999999 109.9 -179.437 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' B' B ' 343' ' ' GLU . . . . . . . . . . . . . 1.4 tt0 -58.91 -43.92 91.15 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.171 -0.956 . . . . 2.3500000000000001 109.673 -179.641 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' B' B ' 344' ' ' LEU . . . . . 0.762 HD22 HD22 ' A' ' 344' ' ' LEU . 41.3 mt -62.95 -46.27 88.54 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.217 -0.927 . . . . 0.17999999999999999 109.939 -179.8 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' B' B ' 345' ' ' ASN . . . . . . . . . . . . . 41.7 t-20 -55.42 -46.85 76.63 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.253 -0.904 . . . . 1.0900000000000001 109.823 -179.527 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' B' B ' 346' ' ' GLU . . . . . . . . . . . . . 1.4 tp10 -60.76 -36.66 79.49 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.239 -0.913 . . . . 1.6599999999999999 109.825 -179.714 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' B' B ' 347' ' ' ALA . . . . . 1.04 ' HB1' ' HB1' ' A' ' 347' ' ' ALA . . . -59.23 -51.46 69.88 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.177 -0.952 . . . . 0.17000000000000001 109.886 -179.731 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' B' B ' 348' ' ' LEU . . . . . 0.603 HD22 ' N ' ' B' ' 348' ' ' LEU . 4.1 mm? -61.21 -44.36 97.4 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.234 -0.917 . . . . 0.28999999999999998 109.723 -179.751 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' B' B ' 349' ' ' GLU . . . . . . . . . . . . . 2.3 mm-40 -58.51 -34.75 71.29 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.257 -0.902 . . . . 1.95 110.214 -179.584 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' B' B ' 350' ' ' LEU . . . . . 0.604 HD13 HD22 ' A' ' 350' ' ' LEU . 6.4 tt -62.53 -44.14 97.09 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.058 -1.026 . . . . 0.45000000000000001 109.579 -179.888 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' B' B ' 351' ' ' LYS . . . . . . . . . . . . . 26.3 tttm -56.5 -43.24 79.51 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.312 -0.867 . . . . 1.3799999999999999 109.797 -179.728 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' B' B ' 352' ' ' ASP . . . . . . . . . . . . . 35.0 m-20 -58.0 -50.41 73.5 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.218 -0.926 . . . . 1.1599999999999999 109.712 179.972 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' B' B ' 353' ' ' ALA . . . . . . . . . . . . . . . -67.08 -10.96 55.55 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.087 -1.008 . . . . 0.60999999999999999 109.62 -179.662 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' B' B ' 354' ' ' GLN . . . . . 0.409 ' OE1' HD11 ' A' ' 350' ' ' LEU . 8.6 tt0 . . . . . 0 N--CA 1.489 1.497 0 O-C-N 121.324 -0.86 . . . . 1.45 109.781 -179.774 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' C' C ' 326' ' ' GLU . . . . . . . . . . . . . 42.1 mm-40 . . . . . 0 N--CA 1.489 1.513 0 CA-C-O 121.415 0.626 . . . . 2.1699999999999999 109.653 . . . . . . . . . 0 0 . 1 . 025 nuclear build core ' C' C ' 327' ' ' TYR . . . . . 0.601 ' CE2' ' HG2' ' A' ' 333' ' ' ARG . 47.7 m-85 -149.66 101.88 3.11 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.325 -0.859 . . . . 0.47999999999999998 109.258 -179.956 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' C' C ' 328' ' ' PHE . . . . . 0.56 ' CE2' ' HG3' ' A' ' 335' ' ' ARG . 71.1 m-85 -110.15 -161.34 0.75 Allowed 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.164 -0.96 . . . . 0.33000000000000002 110.075 -179.799 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' C' C ' 329' ' ' THR . . . . . 0.441 HG23 ' C ' ' C' ' 328' ' ' PHE . 33.8 p -154.95 169.76 23.31 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.482 -0.761 . . . . 0.23000000000000001 109.071 179.834 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' C' C ' 330' ' ' LEU . . . . . . . . . . . . . 16.8 tp -149.89 127.23 11.43 Favored 'General case' 0 N--CA 1.489 1.494 0 O-C-N 121.219 -0.925 . . . . 0.28000000000000003 109.851 -179.924 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' C' C ' 331' ' ' GLN . . . . . . . . . . . . . 12.5 tp60 -87.76 113.2 23.21 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.401 -0.812 . . . . 1.48 109.162 179.658 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' C' C ' 332' ' ' ILE . . . . . . . . . . . . . 32.1 mt -103.14 110.11 28.79 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.6 0 O-C-N 121.117 -0.99 . . . . 0.23999999999999999 109.782 -179.789 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' C' C ' 333' ' ' ARG . . . . . 0.417 ' HG2' ' CE1' ' A' ' 327' ' ' TYR . 18.7 mtt180 -73.08 148.13 44.32 Favored 'General case' 0 N--CA 1.488 1.435 0 O-C-N 121.368 -0.833 . . . . 2.7400000000000002 109.3 179.594 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' C' C ' 334' ' ' GLY . . . . . . . . . . . . . . . 80.07 128.6 0.73 Allowed Glycine 0 N--CA 1.489 2.221 0 N-CA-C 109.749 -1.34 . . . . 0.34999999999999998 109.749 179.945 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' C' C ' 335' ' ' ARG . . . . . 0.445 ' CG ' ' NH1' ' C' ' 335' ' ' ARG . 0.1 OUTLIER -78.38 -30.25 47.77 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.323 -1.104 . . . . 2.5299999999999998 109.478 179.919 . . . . . . . . 3 3 . 1 . 025 nuclear build core ' C' C ' 336' ' ' GLU . . . . . . . . . . . . . 24.6 mt-10 -58.26 -66.02 0.55 Allowed 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.309 -0.869 . . . . 2.6200000000000001 109.751 -179.924 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' C' C ' 337' ' ' ARG . . . . . . . . . . . . . 1.2 mtp180 -59.26 -26.92 65.33 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.211 -0.931 . . . . 2.8100000000000001 109.614 -179.805 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' C' C ' 338' ' ' PHE . . . . . 0.426 ' HB3' ' O ' ' C' ' 335' ' ' ARG . 74.3 t80 -56.03 -59.1 5.4 Favored 'General case' 0 N--CA 1.489 1.476 0 O-C-N 121.154 -0.966 . . . . 0.40000000000000002 109.808 -179.88 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' C' C ' 339' ' ' GLU . . . . . . . . . . . . . 4.2 mt-10 -50.5 -33.89 23.1 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.208 -0.932 . . . . 2.0499999999999998 110.09 -179.512 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' C' C ' 340' ' ' MET . . . . . . . . . . . . . 31.2 ttp -63.72 -51.56 64.43 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.195 -0.941 . . . . 0.32000000000000001 110.101 -179.498 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' C' C ' 341' ' ' PHE . . . . . . . . . . . . . 47.8 m-85 -61.22 -46.58 89.84 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.114 -0.991 . . . . 0.17999999999999999 110.012 -179.417 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' C' C ' 342' ' ' ARG . . . . . 0.49 ' NH1' ' HG3' ' C' ' 342' ' ' ARG . 0.0 OUTLIER -48.31 -42.52 31.3 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.246 -0.909 . . . . 2.9100000000000001 110.252 -179.508 . . . . . . . . 3 3 . 1 . 025 nuclear build core ' C' C ' 343' ' ' GLU . . . . . . . . . . . . . 44.4 tt0 -58.5 -47.37 84.31 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.165 -0.959 . . . . 2.1400000000000001 110.095 -179.459 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' C' C ' 344' ' ' LEU . . . . . 0.779 HD22 HD22 ' D' ' 344' ' ' LEU . 92.6 mt -61.14 -44.58 97.1 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.119 -0.988 . . . . 0.22 109.952 -179.58 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' C' C ' 345' ' ' ASN . . . . . 0.447 HD22 HD21 ' A' ' 330' ' ' LEU . 64.7 t-20 -56.04 -51.72 66.79 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.218 -0.927 . . . . 1.0800000000000001 110.045 -179.557 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' C' C ' 346' ' ' GLU . . . . . . . . . . . . . 7.7 tp10 -61.36 -31.95 71.84 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.059 -1.025 . . . . 2.21 109.553 -179.898 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' C' C ' 347' ' ' ALA . . . . . 1.037 ' HB1' ' HB1' ' D' ' 347' ' ' ALA . . . -59.97 -54.48 45.57 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.16 -0.962 . . . . 0.17999999999999999 109.96 179.954 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' C' C ' 348' ' ' LEU . . . . . 0.714 HD12 ' HE ' ' A' ' 337' ' ' ARG . 4.0 mm? -61.11 -40.68 94.68 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.177 -0.952 . . . . 0.32000000000000001 109.791 -179.839 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' C' C ' 349' ' ' GLU . . . . . . . . . . . . . 11.7 mm-40 -57.74 -38.83 76.01 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.277 -0.89 . . . . 2.1899999999999999 110.01 -179.469 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' C' C ' 350' ' ' LEU . . . . . 0.589 HD22 HD13 ' D' ' 350' ' ' LEU . 6.7 tt -63.18 -39.9 95.98 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.113 -0.992 . . . . 0.46000000000000002 109.612 -179.839 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' C' C ' 351' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -59.16 -50.64 73.26 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.19 -0.944 . . . . 1.3500000000000001 109.484 -179.843 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' C' C ' 352' ' ' ASP . . . . . . . . . . . . . 73.5 m-20 -55.69 -38.41 69.63 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.344 -0.847 . . . . 1.1899999999999999 109.864 179.953 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' C' C ' 353' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.493 1.686 0 O-C-N 121.33 -0.856 . . . . 0.56999999999999995 110.554 -179.328 . . . . . . . . 0 0 . 1 . 025 nuclear build core ' D' D ' 326' ' ' GLU . . . . . . . . . . . . . 3.1 mm-40 . . . . . 0 N--CA 1.489 1.478 0 N-CA-C 109.379 -0.601 . . . . 2.1299999999999999 109.379 . . . . . . . . . 0 0 . 1 . 025 nuclear build core ' D' D ' 327' ' ' TYR . . . . . 0.529 ' CE1' ' HG2' ' B' ' 333' ' ' ARG . 48.7 m-85 -148.99 105.76 3.57 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.201 -0.937 . . . . 0.46999999999999997 109.676 -179.8 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' D' D ' 328' ' ' PHE . . . . . 0.43 ' O ' ' NE2' ' B' ' 331' ' ' GLN . 67.3 m-85 -112.8 -163.9 0.88 Allowed 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.281 -0.887 . . . . 0.29999999999999999 109.613 179.782 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' D' D ' 329' ' ' THR . . . . . . . . . . . . . 21.1 p -153.97 174.17 15.01 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.178 -0.951 . . . . 0.22 109.192 179.94 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' D' D ' 330' ' ' LEU . . . . . . . . . . . . . 29.1 tp -152.29 132.07 13.22 Favored 'General case' 0 N--CA 1.489 1.494 0 O-C-N 121.166 -0.959 . . . . 0.28000000000000003 109.852 -179.864 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' D' D ' 331' ' ' GLN . . . . . 0.408 ' NE2' ' O ' ' B' ' 328' ' ' PHE . 46.3 tp60 -89.31 107.98 19.37 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.355 -0.841 . . . . 0.93000000000000005 109.095 179.463 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' D' D ' 332' ' ' ILE . . . . . . . . . . . . . 33.5 mt -103.67 106.98 21.21 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.518 0 O-C-N 121.195 -0.94 . . . . 0.25 109.766 -179.855 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' D' D ' 333' ' ' ARG . . . . . 0.59 ' HG2' ' CE1' ' B' ' 327' ' ' TYR . 0.0 OUTLIER -73.58 154.35 39.84 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.37 -0.831 . . . . 2.9300000000000002 109.402 179.693 . . . . . . . . 3 3 . 1 . 025 nuclear build core ' D' D ' 334' ' ' GLY . . . . . . . . . . . . . . . 78.93 128.42 0.55 Allowed Glycine 0 N--CA 1.492 2.403 0 N-CA-C 109.94 -1.264 . . . . 0.40999999999999998 109.94 179.607 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' D' D ' 335' ' ' ARG . . . . . 0.495 ' NH1' ' HG2' ' D' ' 335' ' ' ARG . 1.6 ttt-85 -80.24 -35.19 36.44 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.371 -1.076 . . . . 3.0299999999999998 109.453 179.93 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' D' D ' 336' ' ' GLU . . . . . . . . . . . . . 2.4 tm-20 -57.19 -65.5 0.61 Allowed 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.311 -0.868 . . . . 2.2599999999999998 109.685 -179.663 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' D' D ' 337' ' ' ARG . . . . . 0.55 ' HE ' HD12 ' B' ' 348' ' ' LEU . 0.0 OUTLIER -60.19 -29.11 68.49 Favored 'General case' 0 N--CA 1.489 1.486 0 O-C-N 121.392 -0.818 . . . . 2.9199999999999999 109.543 -179.924 . . . . . . . . 3 3 . 1 . 025 nuclear build core ' D' D ' 338' ' ' PHE . . . . . . . . . . . . . 54.9 t80 -54.84 -60.04 3.9 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.246 -0.909 . . . . 0.37 109.554 179.883 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' D' D ' 339' ' ' GLU . . . . . . . . . . . . . 60.7 mm-40 -51.63 -29.59 18.27 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.287 -0.883 . . . . 1.99 109.838 -179.813 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' D' D ' 340' ' ' MET . . . . . 0.424 ' HB3' ' O ' ' D' ' 337' ' ' ARG . 6.6 ttp -64.6 -50.61 66.52 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.15 -0.969 . . . . 0.31 109.58 -179.818 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' D' D ' 341' ' ' PHE . . . . . . . . . . . . . 46.5 m-85 -62.8 -46.26 88.78 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.347 -0.846 . . . . 0.17999999999999999 109.954 -179.735 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' D' D ' 342' ' ' ARG . . . . . . . . . . . . . 5.5 ttm180 -49.09 -41.38 35.35 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.262 -0.899 . . . . 2.4100000000000001 109.922 -179.429 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' D' D ' 343' ' ' GLU . . . . . . . . . . . . . 1.4 tt0 -58.66 -44.02 90.01 Favored 'General case' 0 N--CA 1.489 1.5 0 O-C-N 121.215 -0.928 . . . . 2.3500000000000001 109.543 -179.621 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' D' D ' 344' ' ' LEU . . . . . 0.779 HD22 HD22 ' C' ' 344' ' ' LEU . 40.1 mt -62.92 -46.22 88.81 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.346 -0.846 . . . . 0.19 110.025 -179.743 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' D' D ' 345' ' ' ASN . . . . . . . . . . . . . 41.6 t-20 -55.59 -46.56 77.25 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.159 -0.963 . . . . 1.0900000000000001 109.837 -179.519 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' D' D ' 346' ' ' GLU . . . . . . . . . . . . . 1.4 tp10 -60.67 -36.75 79.5 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.152 -0.967 . . . . 1.6899999999999999 109.774 -179.806 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' D' D ' 347' ' ' ALA . . . . . 1.037 ' HB1' ' HB1' ' C' ' 347' ' ' ALA . . . -59.05 -50.95 72.14 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.091 -1.006 . . . . 0.17999999999999999 110.025 -179.737 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' D' D ' 348' ' ' LEU . . . . . 0.604 HD22 ' N ' ' D' ' 348' ' ' LEU . 4.0 mm? -61.89 -43.84 98.02 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.129 -0.982 . . . . 0.31 109.829 -179.791 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' D' D ' 349' ' ' GLU . . . . . . . . . . . . . 2.3 mm-40 -59.05 -34.47 71.97 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.318 -0.864 . . . . 1.95 110.085 -179.531 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' D' D ' 350' ' ' LEU . . . . . 0.589 HD13 HD22 ' C' ' 350' ' ' LEU . 6.2 tt -62.83 -43.8 97.84 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.135 -0.978 . . . . 0.42999999999999999 109.518 -179.87 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' D' D ' 351' ' ' LYS . . . . . . . . . . . . . 27.2 tttm -56.98 -42.7 80.69 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.352 -0.842 . . . . 1.3999999999999999 109.728 -179.676 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' D' D ' 352' ' ' ASP . . . . . . . . . . . . . 33.7 m-20 -58.55 -50.36 74.07 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.118 -0.989 . . . . 1.1699999999999999 109.613 -179.969 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' D' D ' 353' ' ' ALA . . . . . . . . . . . . . . . -66.93 -11.01 55.03 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.28 -0.888 . . . . 0.58999999999999997 109.634 -179.794 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' D' D ' 354' ' ' GLN . . . . . . . . . . . . . 9.1 tt0 . . . . . 0 C--N 1.3 -1.552 0 O-C-N 121.281 -0.887 . . . . 1.4399999999999999 109.775 -179.774 . . . . . . . . 0 0 . 1 . 026 nuclear build core ' A' A ' 326' ' ' GLU . . . . . . . . . . . . . 32.4 mp0 . . . . . 0 N--CA 1.489 1.515 0 CA-C-O 121.338 0.59 . . . . 2.1299999999999999 109.611 . . . . . . . . . 0 0 . 1 . 026 nuclear build core ' A' A ' 327' ' ' TYR . . . . . 0.584 ' CE1' ' HG2' ' C' ' 333' ' ' ARG . 41.5 m-85 -148.78 112.6 5.11 Favored 'General case' 0 N--CA 1.489 1.5 0 O-C-N 121.373 -0.829 . . . . 0.47999999999999998 109.555 180.0 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 328' ' ' PHE . . . . . . . . . . . . . 98.0 m-85 -113.88 -169.43 1.51 Allowed 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.258 -0.901 . . . . 0.31 109.369 179.804 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 329' ' ' THR . . . . . . . . . . . . . 20.8 p -153.29 168.95 24.32 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.302 -0.874 . . . . 0.22 109.665 -179.761 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 330' ' ' LEU . . . . . . . . . . . . . 41.7 tp -152.19 129.11 10.98 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.29 -0.881 . . . . 0.28000000000000003 109.591 -179.856 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 331' ' ' GLN . . . . . . . . . . . . . 1.4 tt0 -87.13 114.61 23.89 Favored 'General case' 0 N--CA 1.488 1.429 0 O-C-N 121.403 -0.81 . . . . 0.91000000000000003 109.14 179.537 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 332' ' ' ILE . . . . . 0.653 HG21 ' HA ' ' A' ' 338' ' ' PHE . 45.8 mt -103.32 104.3 16.44 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.54 0 O-C-N 121.095 -1.003 . . . . 0.26000000000000001 109.487 -179.933 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 333' ' ' ARG . . . . . 0.482 ' HG2' ' CE2' ' C' ' 327' ' ' TYR . 49.4 mtt180 -72.82 143.58 47.82 Favored 'General case' 0 N--CA 1.488 1.433 0 O-C-N 121.306 -0.871 . . . . 2.9199999999999999 109.108 179.822 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 334' ' ' GLY . . . . . . . . . . . . . . . 89.2 125.72 2.7 Favored Glycine 0 N--CA 1.491 2.342 0 N-CA-C 109.423 -1.471 . . . . 0.40000000000000002 109.423 -179.93 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 335' ' ' ARG . . . . . . . . . . . . . 15.1 ttt180 -76.41 -40.39 50.97 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.202 -1.175 . . . . 3.0099999999999998 109.742 -179.897 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 336' ' ' GLU . . . . . . . . . . . . . 20.0 tt0 -58.09 -58.76 7.03 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.42 -0.8 . . . . 2.29 109.928 -179.746 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 337' ' ' ARG . . . . . 0.433 ' CG ' ' NH1' ' A' ' 337' ' ' ARG . 0.0 OUTLIER -61.18 -32.51 72.25 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.229 -0.919 . . . . 2.9300000000000002 109.509 -179.833 . . . . . . . . 3 3 . 1 . 026 nuclear build core ' A' A ' 338' ' ' PHE . . . . . 0.653 ' HA ' HG21 ' A' ' 332' ' ' ILE . 53.0 t80 -55.75 -53.88 51.25 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.303 -0.873 . . . . 0.38 109.392 179.908 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 339' ' ' GLU . . . . . . . . . . . . . 43.1 mt-10 -50.8 -32.49 20.18 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.247 -0.908 . . . . 1.97 109.861 -179.644 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 340' ' ' MET . . . . . . . . . . . . . 19.6 ttp -63.1 -51.64 65.77 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.088 -1.007 . . . . 0.31 109.79 -179.551 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 341' ' ' PHE . . . . . . . . . . . . . 37.3 m-85 -62.06 -41.47 98.19 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.133 -0.98 . . . . 0.17999999999999999 109.816 -179.829 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 342' ' ' ARG . . . . . . . . . . . . . 6.1 tpt180 -49.1 -43.46 41.32 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.261 -0.899 . . . . 2.4199999999999999 110.105 -179.497 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 343' ' ' GLU . . . . . . . . . . . . . 1.3 tt0 -59.95 -46.02 90.75 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.202 -0.936 . . . . 2.3500000000000001 109.639 -179.757 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 344' ' ' LEU . . . . . . . . . . . . . 57.6 mt -62.04 -30.28 70.87 Favored 'General case' 0 N--CA 1.488 1.467 0 O-C-N 121.315 -0.866 . . . . 0.17999999999999999 109.372 -179.954 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 345' ' ' ASN . . . . . . . . . . . . . 12.4 t-20 -59.24 -58.09 10.14 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.346 -0.846 . . . . 1.0900000000000001 109.965 -179.725 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 346' ' ' GLU . . . . . . . . . . . . . 15.8 tt0 -61.74 -28.15 69.23 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.212 -0.93 . . . . 1.6499999999999999 109.731 -179.555 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 347' ' ' ALA . . . . . 0.704 ' HB1' ' HB1' ' B' ' 347' ' ' ALA . . . -60.9 -61.71 2.38 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.099 -1.001 . . . . 0.17999999999999999 110.011 -179.607 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 348' ' ' LEU . . . . . 0.603 HD22 ' N ' ' A' ' 348' ' ' LEU . 3.8 mm? -61.52 -45.65 93.3 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.278 -0.889 . . . . 0.29999999999999999 110.21 -179.396 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 349' ' ' GLU . . . . . 0.433 ' OE2' ' HD2' ' C' ' 333' ' ' ARG . 3.5 mt-10 -57.69 -32.93 67.84 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.226 -0.921 . . . . 1.9399999999999999 110.072 -179.339 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 350' ' ' LEU . . . . . 0.69 HD22 HD22 ' B' ' 350' ' ' LEU . 7.8 tt -65.75 -43.99 87.24 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.032 -1.043 . . . . 0.46000000000000002 109.391 -179.91 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 351' ' ' LYS . . . . . . . . . . . . . 13.3 tttt -59.07 -50.95 72.11 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.381 -0.824 . . . . 1.3999999999999999 109.352 -179.937 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 352' ' ' ASP . . . . . . . . . . . . . 2.3 m-20 -56.24 -31.23 63.36 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.205 -0.934 . . . . 1.1599999999999999 109.82 -179.922 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 353' ' ' ALA . . . . . . . . . . . . . . . -67.25 -33.25 74.93 Favored 'General case' 0 N--CA 1.495 1.776 0 O-C-N 121.13 -0.981 . . . . 0.63 110.072 -179.731 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 354' ' ' GLN . . . . . . . . . . . . . 63.6 mt-30 . . . . . 0 N--CA 1.491 1.6 0 O-C-N 121.128 -0.983 . . . . 1.47 109.576 -179.696 . . . . . . . . 0 0 . 1 . 026 nuclear build core ' B' B ' 326' ' ' GLU . . . . . . . . . . . . . 34.5 mp0 . . . . . 0 N--CA 1.491 1.611 0 CA-C-O 121.326 0.584 . . . . 2.1299999999999999 109.768 . . . . . . . . . 0 0 . 1 . 026 nuclear build core ' B' B ' 327' ' ' TYR . . . . . . . . . . . . . 41.8 m-85 -149.37 112.2 4.83 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.354 -0.841 . . . . 0.47999999999999998 109.898 -179.994 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' B' B ' 328' ' ' PHE . . . . . 0.451 ' CE2' ' HA ' ' D' ' 335' ' ' ARG . 97.3 m-85 -113.52 -169.51 1.51 Allowed 'General case' 0 N--CA 1.487 1.411 0 O-C-N 121.342 -0.849 . . . . 0.32000000000000001 109.503 179.942 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' B' B ' 329' ' ' THR . . . . . . . . . . . . . 18.0 p -152.94 169.27 23.28 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.182 -0.948 . . . . 0.23000000000000001 109.792 -179.661 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' B' B ' 330' ' ' LEU . . . . . . . . . . . . . 39.6 tp -152.4 129.31 10.99 Favored 'General case' 0 N--CA 1.489 1.478 0 O-C-N 121.365 -0.835 . . . . 0.28000000000000003 109.668 179.998 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' B' B ' 331' ' ' GLN . . . . . . . . . . . . . 1.3 tt0 -87.01 115.27 24.28 Favored 'General case' 0 N--CA 1.488 1.475 0 O-C-N 121.36 -0.837 . . . . 0.91000000000000003 109.115 179.504 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' B' B ' 332' ' ' ILE . . . . . 0.668 HG21 ' HA ' ' B' ' 338' ' ' PHE . 42.6 mt -103.48 103.59 15.38 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.599 0 O-C-N 120.945 -1.097 . . . . 0.23999999999999999 109.7 179.964 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' B' B ' 333' ' ' ARG . . . . . . . . . . . . . 50.3 mtt180 -72.4 142.75 48.7 Favored 'General case' 0 C--N 1.302 -1.463 0 O-C-N 121.085 -1.01 . . . . 2.9300000000000002 109.261 179.759 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' B' B ' 334' ' ' GLY . . . . . . . . . . . . . . . 89.79 125.6 2.86 Favored Glycine 0 N--CA 1.49 2.29 0 N-CA-C 109.583 -1.407 . . . . 0.40000000000000002 109.583 -179.821 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' B' B ' 335' ' ' ARG . . . . . . . . . . . . . 16.6 ttt180 -76.45 -40.37 50.69 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.151 -1.206 . . . . 3.0099999999999998 109.72 -179.928 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' B' B ' 336' ' ' GLU . . . . . . . . . . . . . 24.1 tt0 -58.23 -59.31 5.51 Favored 'General case' 0 N--CA 1.489 1.49 0 O-C-N 121.083 -1.011 . . . . 2.2799999999999998 109.69 -179.577 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' B' B ' 337' ' ' ARG . . . . . 0.455 HH11 ' CG ' ' B' ' 337' ' ' ARG . 0.0 OUTLIER -60.26 -32.42 71.14 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.12 -0.987 . . . . 2.9300000000000002 109.766 -179.795 . . . . . . . . 3 3 . 1 . 026 nuclear build core ' B' B ' 338' ' ' PHE . . . . . 0.668 ' HA ' HG21 ' B' ' 332' ' ' ILE . 52.4 t80 -55.93 -52.94 62.36 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.226 -0.921 . . . . 0.37 109.625 -179.895 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' B' B ' 339' ' ' GLU . . . . . . . . . . . . . 35.3 mt-10 -51.12 -33.03 24.71 Favored 'General case' 0 N--CA 1.488 1.461 0 O-C-N 121.35 -0.844 . . . . 1.98 109.848 -179.574 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' B' B ' 340' ' ' MET . . . . . . . . . . . . . 20.0 ttp -62.83 -51.36 67.32 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.115 -0.99 . . . . 0.32000000000000001 109.924 -179.512 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' B' B ' 341' ' ' PHE . . . . . . . . . . . . . 35.6 m-85 -62.41 -41.72 98.9 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.128 -0.982 . . . . 0.17999999999999999 109.796 -179.834 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' B' B ' 342' ' ' ARG . . . . . . . . . . . . . 5.7 tpt180 -48.88 -44.32 39.82 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.383 -0.823 . . . . 2.4199999999999999 109.68 -179.806 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' B' B ' 343' ' ' GLU . . . . . . . . . . . . . 1.3 tt0 -58.44 -47.42 84.04 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.085 -1.009 . . . . 2.3500000000000001 109.705 -179.85 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' B' B ' 344' ' ' LEU . . . . . . . . . . . . . 51.6 mt -61.01 -30.52 70.35 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.158 -0.964 . . . . 0.17999999999999999 109.684 -179.831 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' B' B ' 345' ' ' ASN . . . . . . . . . . . . . 12.1 t-20 -58.91 -58.33 9.12 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.314 -0.866 . . . . 1.0900000000000001 110.132 -179.837 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' B' B ' 346' ' ' GLU . . . . . . . . . . . . . 17.7 tt0 -61.65 -28.44 69.38 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.112 -0.993 . . . . 1.6599999999999999 109.568 -179.464 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' B' B ' 347' ' ' ALA . . . . . 0.704 ' HB1' ' HB1' ' A' ' 347' ' ' ALA . . . -60.59 -61.14 2.81 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.248 -0.908 . . . . 0.17000000000000001 110.199 -179.778 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' B' B ' 348' ' ' LEU . . . . . 0.599 HD22 ' N ' ' B' ' 348' ' ' LEU . 3.8 mm? -62.36 -46.05 90.44 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.307 -0.871 . . . . 0.28999999999999998 110.023 -179.279 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' B' B ' 349' ' ' GLU . . . . . . . . . . . . . 3.9 mt-10 -57.09 -33.2 67.07 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.025 -1.047 . . . . 1.95 110.099 -179.48 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' B' B ' 350' ' ' LEU . . . . . 0.69 HD22 HD22 ' A' ' 350' ' ' LEU . 7.8 tt -65.41 -44.3 87.87 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.159 -0.963 . . . . 0.45000000000000001 109.442 -179.923 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' B' B ' 351' ' ' LYS . . . . . . . . . . . . . 15.0 tttt -58.74 -50.65 73.12 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.233 -0.917 . . . . 1.3799999999999999 109.454 -179.984 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' B' B ' 352' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 -56.35 -31.92 64.23 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.224 -0.922 . . . . 1.1599999999999999 109.841 -179.85 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' B' B ' 353' ' ' ALA . . . . . . . . . . . . . . . -66.82 -33.0 74.65 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.194 -0.941 . . . . 0.60999999999999999 109.896 -179.661 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' B' B ' 354' ' ' GLN . . . . . . . . . . . . . 63.4 mt-30 . . . . . 0 N--CA 1.493 1.687 0 O-C-N 121.107 -0.995 . . . . 1.45 109.515 -179.914 . . . . . . . . 0 0 . 1 . 026 nuclear build core ' C' C ' 326' ' ' GLU . . . . . 0.408 ' O ' ' CD1' ' C' ' 327' ' ' TYR . 3.5 mt-10 . . . . . 0 N--CA 1.49 1.566 0 N-CA-C 109.382 -0.599 . . . . 2.1699999999999999 109.382 . . . . . . . . . 1 1 . 1 . 026 nuclear build core ' C' C ' 327' ' ' TYR . . . . . 0.482 ' CE2' ' HG2' ' A' ' 333' ' ' ARG . 33.7 m-85 -149.33 112.09 4.81 Favored 'General case' 0 N--CA 1.488 1.45 0 O-C-N 121.375 -0.828 . . . . 0.47999999999999998 110.458 179.721 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' C' C ' 328' ' ' PHE . . . . . 0.448 ' O ' HG23 ' C' ' 329' ' ' THR . 68.9 m-85 -112.96 -166.36 1.07 Allowed 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.423 -0.798 . . . . 0.33000000000000002 108.975 179.458 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' C' C ' 329' ' ' THR . . . . . 0.448 HG23 ' O ' ' C' ' 328' ' ' PHE . 4.4 p -154.28 166.01 34.5 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.259 -0.901 . . . . 0.23000000000000001 109.492 -179.944 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' C' C ' 330' ' ' LEU . . . . . . . . . . . . . 42.0 tp -150.07 129.42 12.9 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.24 -0.912 . . . . 0.28000000000000003 109.762 -179.692 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' C' C ' 331' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -87.59 116.48 25.74 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.278 -0.889 . . . . 1.48 109.095 179.683 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' C' C ' 332' ' ' ILE . . . . . 0.635 HG21 ' HA ' ' C' ' 338' ' ' PHE . 76.1 mt -104.14 110.71 31.16 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.559 0 O-C-N 121.195 -0.941 . . . . 0.23999999999999999 109.828 -179.748 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' C' C ' 333' ' ' ARG . . . . . 0.584 ' HG2' ' CE1' ' A' ' 327' ' ' TYR . 58.2 mtt180 -73.89 143.01 45.98 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.238 -0.914 . . . . 2.7400000000000002 109.368 179.64 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' C' C ' 334' ' ' GLY . . . . . . . . . . . . . . . 80.92 133.71 1.38 Allowed Glycine 0 N--CA 1.491 2.341 0 N-CA-C 109.884 -1.286 . . . . 0.34999999999999998 109.884 179.845 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' C' C ' 335' ' ' ARG . . . . . . . . . . . . . 3.8 ttt180 -77.69 -35.35 52.27 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.271 -1.135 . . . . 2.5299999999999998 109.402 179.81 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' C' C ' 336' ' ' GLU . . . . . . . . . . . . . 2.0 mp0 -56.93 -57.38 12.78 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.239 -0.913 . . . . 2.6200000000000001 109.763 -179.85 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' C' C ' 337' ' ' ARG . . . . . 0.441 HH11 ' HG3' ' C' ' 337' ' ' ARG . 0.3 OUTLIER -59.44 -34.52 72.62 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.158 -0.964 . . . . 2.8100000000000001 109.683 -179.746 . . . . . . . . 3 3 . 1 . 026 nuclear build core ' C' C ' 338' ' ' PHE . . . . . 0.635 ' HA ' HG21 ' C' ' 332' ' ' ILE . 61.2 t80 -54.87 -55.65 28.07 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.415 -0.803 . . . . 0.40000000000000002 109.747 -179.841 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' C' C ' 339' ' ' GLU . . . . . . . . . . . . . 11.4 mm-40 -50.92 -35.85 35.4 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.319 -0.863 . . . . 2.0499999999999998 110.367 -179.592 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' C' C ' 340' ' ' MET . . . . . . . . . . . . . 34.6 ttp -63.33 -48.66 77.11 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.112 -0.993 . . . . 0.32000000000000001 110.054 -179.343 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' C' C ' 341' ' ' PHE . . . . . . . . . . . . . 30.9 m-85 -63.23 -46.32 87.5 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.187 -0.946 . . . . 0.17999999999999999 110.251 -179.351 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' C' C ' 342' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -48.89 -39.96 27.95 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.015 -1.053 . . . . 2.9100000000000001 109.799 -179.663 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' C' C ' 343' ' ' GLU . . . . . . . . . . . . . 31.3 tt0 -58.41 -52.82 63.99 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.08 -1.013 . . . . 2.1400000000000001 109.507 179.913 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' C' C ' 344' ' ' LEU . . . . . . . . . . . . . 86.4 mt -62.02 -25.02 67.41 Favored 'General case' 0 N--CA 1.488 1.454 0 O-C-N 121.344 -0.848 . . . . 0.22 109.23 -179.943 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' C' C ' 345' ' ' ASN . . . . . . . . . . . . . 6.9 t-20 -60.31 -61.43 2.61 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.322 -0.861 . . . . 1.0800000000000001 109.341 -179.942 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' C' C ' 346' ' ' GLU . . . . . . . . . . . . . 34.5 tt0 -61.29 -23.2 65.53 Favored 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.316 -0.865 . . . . 2.21 109.487 -179.931 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' C' C ' 347' ' ' ALA . . . . . 0.418 ' HB1' ' HB1' ' D' ' 347' ' ' ALA . . . -63.2 -62.8 1.45 Allowed 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.308 -0.87 . . . . 0.17999999999999999 109.776 -179.941 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' C' C ' 348' ' ' LEU . . . . . 0.523 ' HA ' HD13 ' C' ' 348' ' ' LEU . 3.5 mm? -61.6 -40.77 95.99 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.333 -0.854 . . . . 0.32000000000000001 109.712 -179.676 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' C' C ' 349' ' ' GLU . . . . . 0.441 ' HA ' ' OE1' ' C' ' 349' ' ' GLU . 7.8 mm-40 -57.28 -38.66 74.26 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 120.994 -1.066 . . . . 2.1899999999999999 109.52 -179.825 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' C' C ' 350' ' ' LEU . . . . . 0.518 HD22 HD22 ' D' ' 350' ' ' LEU . 9.5 tt -63.74 -44.02 94.75 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.429 -0.794 . . . . 0.46000000000000002 109.07 179.853 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' C' C ' 351' ' ' LYS . . . . . . . . . . . . . 2.6 tttt -59.46 -39.4 83.52 Favored 'General case' 0 C--N 1.301 -1.532 0 O-C-N 121.504 -0.748 . . . . 1.3500000000000001 109.431 179.981 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' C' C ' 352' ' ' ASP . . . . . . . . . . . . . 24.6 m-20 -58.44 -39.9 81.1 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.316 -0.865 . . . . 1.1899999999999999 109.561 -179.781 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' C' C ' 353' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 1.569 0 O-C-N 121.276 -0.89 . . . . 0.56999999999999995 109.795 -179.657 . . . . . . . . 0 0 . 1 . 026 nuclear build core ' D' D ' 326' ' ' GLU . . . . . . . . . . . . . 33.9 mp0 . . . . . 0 N--CA 1.489 1.478 0 CA-C-O 121.413 0.625 . . . . 2.1299999999999999 109.642 . . . . . . . . . 0 0 . 1 . 026 nuclear build core ' D' D ' 327' ' ' TYR . . . . . . . . . . . . . 41.6 m-85 -149.62 112.21 4.76 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.321 -0.862 . . . . 0.46999999999999997 109.784 -179.866 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' D' D ' 328' ' ' PHE . . . . . . . . . . . . . 98.7 m-85 -113.1 -169.41 1.48 Allowed 'General case' 0 C--N 1.302 -1.498 0 O-C-N 121.315 -0.866 . . . . 0.29999999999999999 109.381 -179.969 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' D' D ' 329' ' ' THR . . . . . . . . . . . . . 16.9 p -152.66 168.71 24.73 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.222 -0.924 . . . . 0.22 109.639 -179.753 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' D' D ' 330' ' ' LEU . . . . . . . . . . . . . 41.4 tp -152.1 129.28 11.18 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.283 -0.885 . . . . 0.28000000000000003 109.754 -179.982 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' D' D ' 331' ' ' GLN . . . . . . . . . . . . . 1.5 tt0 -87.55 115.31 24.89 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.112 -0.992 . . . . 0.93000000000000005 109.291 179.654 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' D' D ' 332' ' ' ILE . . . . . 0.655 HG21 ' HA ' ' D' ' 338' ' ' PHE . 39.3 mt -103.2 102.92 14.33 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.562 0 O-C-N 121.165 -0.959 . . . . 0.25 109.739 -179.886 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' D' D ' 333' ' ' ARG . . . . . . . . . . . . . 49.3 mtt180 -71.84 141.88 49.61 Favored 'General case' 0 N--CA 1.487 1.403 0 O-C-N 121.372 -0.83 . . . . 2.9300000000000002 109.189 179.626 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' D' D ' 334' ' ' GLY . . . . . . . . . . . . . . . 90.87 125.04 3.08 Favored Glycine 0 N--CA 1.492 2.377 0 N-CA-C 109.376 -1.49 . . . . 0.40999999999999998 109.376 -179.931 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' D' D ' 335' ' ' ARG . . . . . 0.451 ' HA ' ' CE2' ' B' ' 328' ' ' PHE . 18.5 ttt180 -76.64 -40.64 48.57 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.158 -1.201 . . . . 3.0299999999999998 109.734 -179.971 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' D' D ' 336' ' ' GLU . . . . . . . . . . . . . 24.1 tt0 -57.86 -58.58 7.76 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.269 -0.895 . . . . 2.2599999999999998 109.785 -179.771 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' D' D ' 337' ' ' ARG . . . . . 0.46 ' CG ' ' NH1' ' D' ' 337' ' ' ARG . 0.0 OUTLIER -61.45 -32.33 72.31 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.072 -1.017 . . . . 2.9199999999999999 109.581 -179.669 . . . . . . . . 3 3 . 1 . 026 nuclear build core ' D' D ' 338' ' ' PHE . . . . . 0.655 ' HA ' HG21 ' D' ' 332' ' ' ILE . 52.7 t80 -55.6 -53.24 58.91 Favored 'General case' 0 N--CA 1.489 1.492 0 O-C-N 121.304 -0.872 . . . . 0.37 109.527 179.926 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' D' D ' 339' ' ' GLU . . . . . . . . . . . . . 28.7 mt-10 -50.91 -32.3 20.22 Favored 'General case' 0 N--CA 1.494 1.762 0 O-C-N 121.308 -0.87 . . . . 1.99 110.109 -179.806 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' D' D ' 340' ' ' MET . . . . . . . . . . . . . 20.7 ttp -63.7 -51.28 65.75 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.069 -1.019 . . . . 0.31 109.642 -179.626 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' D' D ' 341' ' ' PHE . . . . . . . . . . . . . 34.9 m-85 -62.48 -41.59 98.89 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.11 -0.994 . . . . 0.17999999999999999 109.937 -179.656 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' D' D ' 342' ' ' ARG . . . . . . . . . . . . . 6.4 tpt180 -49.27 -43.51 43.09 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.162 -0.961 . . . . 2.4100000000000001 109.819 -179.793 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' D' D ' 343' ' ' GLU . . . . . . . . . . . . . 1.3 tt0 -59.26 -47.3 85.87 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.293 -0.879 . . . . 2.3500000000000001 109.679 -179.766 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' D' D ' 344' ' ' LEU . . . . . . . . . . . . . 48.3 mt -61.42 -30.22 70.43 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.241 -0.912 . . . . 0.19 109.354 -179.89 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' D' D ' 345' ' ' ASN . . . . . . . . . . . . . 11.8 t-20 -58.67 -59.18 5.81 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.186 -0.946 . . . . 1.0900000000000001 109.981 -179.979 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' D' D ' 346' ' ' GLU . . . . . . . . . . . . . 19.1 tt0 -60.87 -27.81 68.39 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.228 -0.92 . . . . 1.6899999999999999 109.927 -179.542 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' D' D ' 347' ' ' ALA . . . . . 0.418 ' HB1' ' HB1' ' C' ' 347' ' ' ALA . . . -61.09 -61.49 2.53 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.082 -1.011 . . . . 0.17999999999999999 110.111 -179.705 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' D' D ' 348' ' ' LEU . . . . . 0.629 HD22 ' N ' ' D' ' 348' ' ' LEU . 3.8 mm? -62.1 -45.89 91.49 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.368 -0.832 . . . . 0.31 110.239 -179.441 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' D' D ' 349' ' ' GLU . . . . . . . . . . . . . 3.8 mt-10 -57.6 -33.19 67.94 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.186 -0.946 . . . . 1.95 109.784 -179.299 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' D' D ' 350' ' ' LEU . . . . . 0.518 HD22 HD22 ' C' ' 350' ' ' LEU . 7.7 tt -65.01 -43.88 91.03 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.302 -0.874 . . . . 0.42999999999999999 109.531 -179.98 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' D' D ' 351' ' ' LYS . . . . . . . . . . . . . 16.7 tttt -59.5 -50.16 74.98 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.502 -0.749 . . . . 1.3999999999999999 109.543 -179.783 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' D' D ' 352' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 -56.62 -32.37 65.24 Favored 'General case' 0 N--CA 1.488 1.458 0 O-C-N 121.293 -0.879 . . . . 1.1699999999999999 109.767 -179.799 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' D' D ' 353' ' ' ALA . . . . . . . . . . . . . . . -66.51 -32.31 73.58 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.296 -0.878 . . . . 0.58999999999999997 109.929 -179.732 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' D' D ' 354' ' ' GLN . . . . . . . . . . . . . 19.9 mt-30 . . . . . 0 N--CA 1.49 1.552 0 O-C-N 121.1 -1.0 . . . . 1.4399999999999999 109.687 -179.702 . . . . . . . . 0 0 . 1 . 027 nuclear build core ' A' A ' 326' ' ' GLU . . . . . . . . . . . . . 5.7 mm-40 . . . . . 0 N--CA 1.492 1.657 0 N-CA-C 109.242 -0.651 . . . . 2.1299999999999999 109.242 . . . . . . . . . 0 0 . 1 . 027 nuclear build core ' A' A ' 327' ' ' TYR . . . . . 0.59 ' CE1' ' HG3' ' C' ' 333' ' ' ARG . 41.0 m-85 -148.76 108.07 3.94 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.25 -0.906 . . . . 0.47999999999999998 109.849 -179.909 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 328' ' ' PHE . . . . . 0.477 ' CE2' ' HA ' ' C' ' 335' ' ' ARG . 46.7 m-85 -113.35 -166.45 1.09 Allowed 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.214 -0.929 . . . . 0.31 109.297 179.691 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 329' ' ' THR . . . . . . . . . . . . . 20.2 p -152.75 171.29 18.46 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.131 -0.98 . . . . 0.22 109.238 179.729 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 330' ' ' LEU . . . . . 0.504 HD21 ' HB2' ' C' ' 345' ' ' ASN . 35.0 tp -151.47 130.29 12.43 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.109 -0.995 . . . . 0.28000000000000003 109.815 -179.799 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 331' ' ' GLN . . . . . . . . . . . . . 13.4 tp60 -88.22 109.12 19.67 Favored 'General case' 0 N--CA 1.488 1.471 0 O-C-N 121.446 -0.784 . . . . 0.91000000000000003 108.938 179.463 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 332' ' ' ILE . . . . . . . . . . . . . 30.6 mt -103.21 106.68 20.55 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.6 0 O-C-N 120.965 -1.084 . . . . 0.26000000000000001 109.641 -179.814 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 333' ' ' ARG . . . . . 0.463 ' HG2' ' CE1' ' C' ' 327' ' ' TYR . 61.8 mtt180 -72.81 148.67 44.29 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.205 -0.935 . . . . 2.9199999999999999 109.585 179.873 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 334' ' ' GLY . . . . . . . . . . . . . . . 83.27 129.52 1.5 Allowed Glycine 0 N--CA 1.492 2.377 0 N-CA-C 109.648 -1.381 . . . . 0.40000000000000002 109.648 179.734 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 335' ' ' ARG . . . . . . . . . . . . . 15.2 ttt180 -79.76 -32.8 41.03 Favored 'General case' 0 N--CA 1.489 1.476 0 O-C-N 121.27 -1.135 . . . . 3.0099999999999998 109.486 179.774 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 336' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -56.87 -62.87 1.44 Allowed 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.359 -0.838 . . . . 2.29 109.415 -179.812 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 337' ' ' ARG . . . . . . . . . . . . . 1.4 mmt180 -60.92 -29.89 69.87 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.323 -0.861 . . . . 2.9300000000000002 109.638 179.974 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 338' ' ' PHE . . . . . . . . . . . . . 72.0 t80 -54.72 -57.75 10.27 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.344 -0.848 . . . . 0.38 109.759 -179.881 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 339' ' ' GLU . . . . . . . . . . . . . 50.7 mt-10 -52.11 -36.18 50.26 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.087 -1.008 . . . . 1.97 109.958 -179.869 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 340' ' ' MET . . . . . . . . . . . . . 41.5 ttp -63.44 -46.39 86.54 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.137 -0.977 . . . . 0.31 109.888 -179.647 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 341' ' ' PHE . . . . . . . . . . . . . 39.9 m-85 -62.79 -46.25 88.86 Favored 'General case' 0 N--CA 1.494 1.74 0 O-C-N 121.106 -0.997 . . . . 0.17999999999999999 110.076 -179.734 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 342' ' ' ARG . . . . . . . . . . . . . 22.3 ttt180 -49.38 -44.12 44.66 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.219 -0.926 . . . . 2.4199999999999999 110.296 -179.414 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 343' ' ' GLU . . . . . . . . . . . . . 1.8 tp10 -57.33 -45.34 84.38 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.115 -0.991 . . . . 2.3500000000000001 110.005 -179.735 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 344' ' ' LEU . . . . . 0.573 HD22 ' CD2' ' B' ' 344' ' ' LEU . 69.6 mt -62.59 -41.5 99.0 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.17 -0.956 . . . . 0.17999999999999999 110.034 -179.558 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 345' ' ' ASN . . . . . 0.558 ' HB2' HD21 ' C' ' 330' ' ' LEU . 62.9 t-20 -56.95 -49.78 74.64 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.244 -0.91 . . . . 1.0900000000000001 109.665 -179.737 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 346' ' ' GLU . . . . . . . . . . . . . 4.5 tp10 -62.72 -34.41 77.11 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.167 -0.958 . . . . 1.6499999999999999 110.14 -179.788 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 347' ' ' ALA . . . . . 1.001 ' HB1' ' HB1' ' B' ' 347' ' ' ALA . . . -59.26 -55.44 34.83 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.083 -1.01 . . . . 0.17999999999999999 109.956 -179.602 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 348' ' ' LEU . . . . . 0.564 HD22 ' N ' ' A' ' 348' ' ' LEU . 3.9 mm? -61.19 -44.62 97.01 Favored 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.345 -0.847 . . . . 0.29999999999999999 109.871 -179.552 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 349' ' ' GLU . . . . . . . . . . . . . 2.5 mt-10 -57.4 -33.46 67.87 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.359 -0.838 . . . . 1.9399999999999999 109.93 -179.364 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 350' ' ' LEU . . . . . 0.687 HD23 ' O ' ' A' ' 350' ' ' LEU . 4.8 tt -63.29 -46.27 87.51 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.175 -0.953 . . . . 0.46000000000000002 109.299 -179.604 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 351' ' ' LYS . . . . . . . . . . . . . 42.8 tttt -59.58 -37.61 78.97 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.42 -0.8 . . . . 1.3999999999999999 109.312 179.946 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 352' ' ' ASP . . . . . . . . . . . . . 3.5 m-20 -57.43 -43.6 84.0 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.34 -0.85 . . . . 1.1599999999999999 109.698 179.837 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 353' ' ' ALA . . . . . . . . . . . . . . . -67.65 -18.69 65.04 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.183 -0.948 . . . . 0.63 109.936 -179.357 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 354' ' ' GLN . . . . . . . . . . . . . 23.5 tt0 . . . . . 0 N--CA 1.49 1.529 0 O-C-N 121.086 -1.009 . . . . 1.47 109.445 -179.887 . . . . . . . . 0 0 . 1 . 027 nuclear build core ' B' B ' 326' ' ' GLU . . . . . . . . . . . . . 5.4 mm-40 . . . . . 0 N--CA 1.487 1.379 0 N-CA-C 109.209 -0.663 . . . . 2.1299999999999999 109.209 . . . . . . . . . 0 0 . 1 . 027 nuclear build core ' B' B ' 327' ' ' TYR . . . . . . . . . . . . . 40.0 m-85 -149.36 107.22 3.69 Favored 'General case' 0 C--N 1.303 -1.421 0 O-C-N 121.183 -0.948 . . . . 0.47999999999999998 109.824 -179.983 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' B' B ' 328' ' ' PHE . . . . . . . . . . . . . 45.3 m-85 -113.03 -166.13 1.05 Allowed 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.213 -0.929 . . . . 0.32000000000000001 109.12 179.8 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' B' B ' 329' ' ' THR . . . . . . . . . . . . . 22.4 p -153.33 170.63 20.17 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.321 -0.862 . . . . 0.23000000000000001 109.197 -179.934 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' B' B ' 330' ' ' LEU . . . . . 0.587 HD11 HD22 ' D' ' 345' ' ' ASN . 33.4 tp -150.64 130.64 13.42 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.22 -0.925 . . . . 0.28000000000000003 110.023 -179.804 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' B' B ' 331' ' ' GLN . . . . . . . . . . . . . 12.6 tp60 -88.49 108.87 19.62 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.335 -0.853 . . . . 0.91000000000000003 108.934 179.415 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' B' B ' 332' ' ' ILE . . . . . . . . . . . . . 30.4 mt -103.08 106.75 20.65 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.546 0 O-C-N 121.171 -0.955 . . . . 0.23999999999999999 109.651 -179.621 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' B' B ' 333' ' ' ARG . . . . . 0.41 ' HG2' ' CE1' ' D' ' 327' ' ' TYR . 62.2 mtt180 -72.89 148.81 44.03 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.361 -0.837 . . . . 2.9300000000000002 109.632 179.911 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' B' B ' 334' ' ' GLY . . . . . . . . . . . . . . . 83.16 129.9 1.52 Allowed Glycine 0 N--CA 1.49 2.281 0 N-CA-C 109.569 -1.412 . . . . 0.40000000000000002 109.569 179.585 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' B' B ' 335' ' ' ARG . . . . . . . . . . . . . 16.7 ttt180 -79.88 -32.81 40.37 Favored 'General case' 0 N--CA 1.489 1.5 0 O-C-N 121.351 -1.087 . . . . 3.0099999999999998 109.425 179.929 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' B' B ' 336' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -57.22 -62.42 1.78 Allowed 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.063 -1.023 . . . . 2.2799999999999998 109.677 -179.853 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' B' B ' 337' ' ' ARG . . . . . . . . . . . . . 1.1 mmt180 -61.11 -30.61 70.46 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.223 -0.923 . . . . 2.9300000000000002 109.625 -179.907 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' B' B ' 338' ' ' PHE . . . . . . . . . . . . . 69.0 t80 -54.4 -56.8 15.0 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.315 -0.865 . . . . 0.37 109.731 -179.82 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' B' B ' 339' ' ' GLU . . . . . . . . . . . . . 51.7 mt-10 -52.86 -35.59 57.79 Favored 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.24 -0.912 . . . . 1.98 109.824 -179.692 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' B' B ' 340' ' ' MET . . . . . . . . . . . . . 42.1 ttp -63.87 -46.46 84.82 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.211 -0.931 . . . . 0.32000000000000001 109.874 -179.678 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' B' B ' 341' ' ' PHE . . . . . . . . . . . . . 39.6 m-85 -62.73 -46.12 89.58 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.212 -0.93 . . . . 0.17999999999999999 110.055 -179.57 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' B' B ' 342' ' ' ARG . . . . . . . . . . . . . 23.0 ttt180 -48.98 -43.93 40.56 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.302 -0.874 . . . . 2.4199999999999999 110.318 -179.584 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' B' B ' 343' ' ' GLU . . . . . . . . . . . . . 1.9 tp10 -58.14 -45.0 88.12 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.224 -0.922 . . . . 2.3500000000000001 109.934 -179.309 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' B' B ' 344' ' ' LEU . . . . . 0.573 ' CD2' HD22 ' A' ' 344' ' ' LEU . 70.6 mt -62.68 -42.26 99.53 Favored 'General case' 0 N--CA 1.488 1.459 0 O-C-N 121.18 -0.95 . . . . 0.17999999999999999 109.808 -179.693 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' B' B ' 345' ' ' ASN . . . . . 0.603 HD22 HD11 ' D' ' 330' ' ' LEU . 63.2 t-20 -55.9 -49.97 71.96 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.197 -0.939 . . . . 1.0900000000000001 109.786 -179.804 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' B' B ' 346' ' ' GLU . . . . . . . . . . . . . 4.3 tp10 -62.98 -34.65 78.0 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.261 -0.899 . . . . 1.6599999999999999 109.909 -179.584 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' B' B ' 347' ' ' ALA . . . . . 1.001 ' HB1' ' HB1' ' A' ' 347' ' ' ALA . . . -58.99 -55.79 30.57 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.072 -1.018 . . . . 0.17000000000000001 110.047 -179.587 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' B' B ' 348' ' ' LEU . . . . . 0.58 HD22 ' N ' ' B' ' 348' ' ' LEU . 3.9 mm? -60.86 -45.05 96.06 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.213 -0.93 . . . . 0.28999999999999998 109.804 -179.709 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' B' B ' 349' ' ' GLU . . . . . . . . . . . . . 2.6 mt-10 -57.21 -32.84 66.91 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.442 -0.786 . . . . 1.95 110.06 -179.509 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' B' B ' 350' ' ' LEU . . . . . 0.681 HD23 ' O ' ' B' ' 350' ' ' LEU . 4.8 tt -63.82 -46.7 83.91 Favored 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.091 -1.006 . . . . 0.45000000000000001 109.399 -179.685 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' B' B ' 351' ' ' LYS . . . . . . . . . . . . . 42.6 tttt -59.19 -37.15 76.69 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.299 -0.876 . . . . 1.3799999999999999 109.294 179.716 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' B' B ' 352' ' ' ASP . . . . . . . . . . . . . 2.3 m-20 -57.84 -43.46 85.86 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.336 -0.853 . . . . 1.1599999999999999 109.873 -179.979 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' B' B ' 353' ' ' ALA . . . . . . . . . . . . . . . -67.42 -19.4 65.37 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.313 -0.867 . . . . 0.60999999999999999 109.834 -179.722 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' B' B ' 354' ' ' GLN . . . . . . . . . . . . . 24.4 tt0 . . . . . 0 N--CA 1.493 1.676 0 O-C-N 121.037 -1.039 . . . . 1.45 109.534 -179.713 . . . . . . . . 0 0 . 1 . 027 nuclear build core ' C' C ' 326' ' ' GLU . . . . . . . . . . . . . 1.8 mt-10 . . . . . 0 N--CA 1.488 1.444 0 N-CA-C 109.066 -0.716 . . . . 2.1699999999999999 109.066 . . . . . . . . . 0 0 . 1 . 027 nuclear build core ' C' C ' 327' ' ' TYR . . . . . 0.463 ' CE1' ' HG2' ' A' ' 333' ' ' ARG . 39.9 m-85 -150.81 108.37 3.65 Favored 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.139 -0.976 . . . . 0.47999999999999998 109.86 -179.99 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' C' C ' 328' ' ' PHE . . . . . . . . . . . . . 98.4 m-85 -113.79 -166.97 1.14 Allowed 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.149 -0.97 . . . . 0.33000000000000002 109.453 179.731 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' C' C ' 329' ' ' THR . . . . . 0.422 ' HA ' ' O ' ' A' ' 330' ' ' LEU . 6.7 p -152.03 172.41 16.34 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.107 -0.996 . . . . 0.23000000000000001 109.595 -179.929 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' C' C ' 330' ' ' LEU . . . . . 0.558 HD21 ' HB2' ' A' ' 345' ' ' ASN . 31.1 tp -151.69 130.14 12.15 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.137 -0.977 . . . . 0.28000000000000003 109.757 -179.609 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' C' C ' 331' ' ' GLN . . . . . . . . . . . . . 2.4 tp60 -86.85 109.85 19.58 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.208 -0.933 . . . . 1.48 109.355 179.8 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' C' C ' 332' ' ' ILE . . . . . 0.749 HG21 ' HA ' ' C' ' 338' ' ' PHE . 70.1 mt -103.16 106.04 19.37 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.518 0 O-C-N 121.185 -0.947 . . . . 0.23999999999999999 109.945 -179.616 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' C' C ' 333' ' ' ARG . . . . . 0.59 ' HG3' ' CE1' ' A' ' 327' ' ' TYR . 0.0 OUTLIER -72.27 151.61 42.69 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.381 -0.825 . . . . 2.7400000000000002 109.174 179.588 . . . . . . . . 3 3 . 1 . 027 nuclear build core ' C' C ' 334' ' ' GLY . . . . . . . . . . . . . . . 80.19 129.92 0.84 Allowed Glycine 0 N--CA 1.49 2.237 0 N-CA-C 109.434 -1.466 . . . . 0.34999999999999998 109.434 -179.91 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' C' C ' 335' ' ' ARG . . . . . 0.477 ' HA ' ' CE2' ' A' ' 328' ' ' PHE . 10.1 ttp180 -79.18 -35.8 41.28 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.246 -1.15 . . . . 2.5299999999999998 109.876 -179.678 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' C' C ' 336' ' ' GLU . . . . . . . . . . . . . 89.4 mt-10 -58.6 -63.01 1.44 Allowed 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.201 -0.937 . . . . 2.6200000000000001 109.921 -179.697 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' C' C ' 337' ' ' ARG . . . . . 0.46 ' NH1' ' CG ' ' C' ' 337' ' ' ARG . 0.3 OUTLIER -59.16 -31.06 68.63 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.126 -0.983 . . . . 2.8100000000000001 109.278 179.966 . . . . . . . . 3 3 . 1 . 027 nuclear build core ' C' C ' 338' ' ' PHE . . . . . 0.749 ' HA ' HG21 ' C' ' 332' ' ' ILE . 66.8 t80 -52.95 -58.58 6.48 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.272 -0.892 . . . . 0.40000000000000002 109.071 179.57 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' C' C ' 339' ' ' GLU . . . . . . . . . . . . . 2.7 mm-40 -51.55 -31.29 23.84 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.341 -0.849 . . . . 2.0499999999999998 109.741 179.713 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' C' C ' 340' ' ' MET . . . . . . . . . . . . . 29.5 ttp -63.74 -53.14 55.66 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.153 -0.967 . . . . 0.32000000000000001 109.681 -179.811 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' C' C ' 341' ' ' PHE . . . . . 0.442 ' HB2' HD13 ' C' ' 332' ' ' ILE . 46.0 m-85 -60.58 -38.1 83.51 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.345 -0.847 . . . . 0.17999999999999999 109.413 -179.989 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' C' C ' 342' ' ' ARG . . . . . . . . . . . . . 11.7 ttp180 -51.71 -53.14 42.54 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.449 -0.782 . . . . 2.9100000000000001 110.283 -179.683 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' C' C ' 343' ' ' GLU . . . . . . . . . . . . . 15.9 tp10 -55.73 -42.16 74.93 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.199 -0.938 . . . . 2.1400000000000001 110.26 -179.135 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' C' C ' 344' ' ' LEU . . . . . 0.452 ' O ' HD23 ' C' ' 348' ' ' LEU . 57.7 mt -61.83 -40.85 96.74 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.117 -0.99 . . . . 0.22 109.503 -179.706 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' C' C ' 345' ' ' ASN . . . . . 0.504 ' HB2' HD21 ' A' ' 330' ' ' LEU . 0.7 OUTLIER -57.6 -51.08 70.97 Favored 'General case' 0 C--N 1.303 -1.451 0 O-C-N 121.441 -0.787 . . . . 1.0800000000000001 109.331 179.803 . . . . . . . . 3 3 . 1 . 027 nuclear build core ' C' C ' 346' ' ' GLU . . . . . . . . . . . . . 3.6 tm-20 -61.75 -32.4 72.65 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.376 -0.828 . . . . 2.21 109.751 -179.993 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' C' C ' 347' ' ' ALA . . . . . 0.732 ' HB1' ' HB1' ' D' ' 347' ' ' ALA . . . -62.79 -52.85 61.56 Favored 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.249 -0.907 . . . . 0.17999999999999999 109.821 -179.846 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' C' C ' 348' ' ' LEU . . . . . 0.547 ' N ' HD22 ' C' ' 348' ' ' LEU . 4.2 mm? -61.13 -48.89 79.54 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.284 -0.885 . . . . 0.32000000000000001 109.644 -179.544 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' C' C ' 349' ' ' GLU . . . . . . . . . . . . . 61.1 mt-10 -58.71 -31.21 68.06 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.293 -0.88 . . . . 2.1899999999999999 109.754 -179.797 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' C' C ' 350' ' ' LEU . . . . . 0.911 ' CD2' HD13 ' D' ' 350' ' ' LEU . 10.2 tt -63.37 -40.72 98.02 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.218 -0.926 . . . . 0.46000000000000002 109.109 179.838 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' C' C ' 351' ' ' LYS . . . . . . . . . . . . . 36.1 tttm -61.4 -43.22 99.25 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.362 -0.836 . . . . 1.3500000000000001 109.483 179.869 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' C' C ' 352' ' ' ASP . . . . . . . . . . . . . 4.4 m-20 -56.23 -49.04 75.27 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.246 -0.909 . . . . 1.1899999999999999 109.551 -179.957 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' C' C ' 353' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.488 1.471 0 O-C-N 121.312 -0.868 . . . . 0.56999999999999995 109.363 -179.886 . . . . . . . . 0 0 . 1 . 027 nuclear build core ' D' D ' 326' ' ' GLU . . . . . . . . . . . . . 5.6 mm-40 . . . . . 0 N--CA 1.489 1.476 0 N-CA-C 109.039 -0.726 . . . . 2.1299999999999999 109.039 . . . . . . . . . 0 0 . 1 . 027 nuclear build core ' D' D ' 327' ' ' TYR . . . . . 0.41 ' CE1' ' HG2' ' B' ' 333' ' ' ARG . 41.2 m-85 -149.54 107.25 3.67 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.106 -0.996 . . . . 0.46999999999999997 109.75 -179.899 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' D' D ' 328' ' ' PHE . . . . . . . . . . . . . 45.9 m-85 -112.99 -166.06 1.05 Allowed 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.336 -0.852 . . . . 0.29999999999999999 109.458 179.708 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' D' D ' 329' ' ' THR . . . . . . . . . . . . . 30.8 p -153.07 170.46 20.41 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.167 -0.958 . . . . 0.22 109.348 179.879 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' D' D ' 330' ' ' LEU . . . . . 0.603 HD11 HD22 ' B' ' 345' ' ' ASN . 32.4 tp -150.46 130.41 13.4 Favored 'General case' 0 C--N 1.304 -1.41 0 O-C-N 121.125 -0.984 . . . . 0.28000000000000003 109.911 -179.973 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' D' D ' 331' ' ' GLN . . . . . . . . . . . . . 11.0 tp60 -88.41 108.56 19.43 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.427 -0.795 . . . . 0.93000000000000005 108.961 179.526 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' D' D ' 332' ' ' ILE . . . . . . . . . . . . . 25.3 mt -103.0 106.41 20.01 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.617 0 O-C-N 121.045 -1.034 . . . . 0.25 109.831 -179.632 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' D' D ' 333' ' ' ARG . . . . . . . . . . . . . 60.6 mtt180 -72.46 148.35 45.21 Favored 'General case' 0 N--CA 1.488 1.452 0 O-C-N 121.403 -0.811 . . . . 2.9300000000000002 109.574 179.956 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' D' D ' 334' ' ' GLY . . . . . . . . . . . . . . . 83.47 130.43 1.71 Allowed Glycine 0 N--CA 1.492 2.37 0 N-CA-C 109.834 -1.306 . . . . 0.40999999999999998 109.834 179.676 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' D' D ' 335' ' ' ARG . . . . . . . . . . . . . 19.5 ttt180 -79.82 -32.81 40.67 Favored 'General case' 0 N--CA 1.489 1.478 0 O-C-N 121.293 -1.122 . . . . 3.0299999999999998 109.499 179.851 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' D' D ' 336' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -57.44 -63.49 1.21 Allowed 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.272 -0.892 . . . . 2.2599999999999998 109.636 -179.91 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' D' D ' 337' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -60.45 -29.88 69.3 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.112 -0.992 . . . . 2.9199999999999999 109.694 -179.983 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' D' D ' 338' ' ' PHE . . . . . . . . . . . . . 69.2 t80 -55.23 -56.7 16.95 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.224 -0.922 . . . . 0.37 109.648 -179.722 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' D' D ' 339' ' ' GLU . . . . . . . . . . . . . 52.9 mt-10 -52.53 -35.62 53.81 Favored 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.278 -0.889 . . . . 1.99 109.948 -179.824 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' D' D ' 340' ' ' MET . . . . . . . . . . . . . 42.4 ttp -63.94 -45.98 86.74 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.25 -0.906 . . . . 0.31 109.916 -179.615 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' D' D ' 341' ' ' PHE . . . . . . . . . . . . . 40.1 m-85 -63.44 -45.53 90.47 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.306 -0.871 . . . . 0.17999999999999999 110.005 -179.464 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' D' D ' 342' ' ' ARG . . . . . . . . . . . . . 22.1 ttt180 -49.4 -43.5 44.47 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.172 -0.955 . . . . 2.4100000000000001 110.145 -179.401 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' D' D ' 343' ' ' GLU . . . . . . . . . . . . . 2.1 tp10 -57.98 -45.44 86.75 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.138 -0.976 . . . . 2.3500000000000001 109.96 -179.263 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' D' D ' 344' ' ' LEU . . . . . . . . . . . . . 70.9 mt -62.5 -42.28 99.4 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.257 -0.902 . . . . 0.19 109.956 -179.661 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' D' D ' 345' ' ' ASN . . . . . 0.587 HD22 HD11 ' B' ' 330' ' ' LEU . 63.5 t-20 -56.27 -49.56 73.87 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.145 -0.972 . . . . 1.0900000000000001 109.471 -179.723 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' D' D ' 346' ' ' GLU . . . . . . . . . . . . . 4.1 tp10 -62.64 -34.96 78.13 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.269 -0.894 . . . . 1.6899999999999999 110.116 -179.932 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' D' D ' 347' ' ' ALA . . . . . 0.732 ' HB1' ' HB1' ' C' ' 347' ' ' ALA . . . -59.44 -56.04 27.09 Favored 'General case' 0 N--CA 1.493 1.692 0 O-C-N 120.984 -1.072 . . . . 0.17999999999999999 110.104 -179.611 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' D' D ' 348' ' ' LEU . . . . . 0.583 HD22 ' N ' ' D' ' 348' ' ' LEU . 3.9 mm? -60.67 -44.84 95.99 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.156 -0.965 . . . . 0.31 109.789 -179.761 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' D' D ' 349' ' ' GLU . . . . . . . . . . . . . 2.5 mt-10 -57.71 -32.62 67.58 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.421 -0.8 . . . . 1.95 109.97 -179.45 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' D' D ' 350' ' ' LEU . . . . . 0.911 HD13 ' CD2' ' C' ' 350' ' ' LEU . 4.9 tt -63.8 -46.75 83.74 Favored 'General case' 0 N--CA 1.489 1.479 0 O-C-N 120.927 -1.108 . . . . 0.42999999999999999 109.365 -179.79 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' D' D ' 351' ' ' LYS . . . . . . . . . . . . . 39.0 tttt -59.29 -36.7 76.07 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.443 -0.786 . . . . 1.3999999999999999 109.413 -179.935 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' D' D ' 352' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -58.31 -43.08 87.99 Favored 'General case' 0 N--CA 1.489 1.475 0 O-C-N 121.34 -0.85 . . . . 1.1699999999999999 109.634 -179.961 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' D' D ' 353' ' ' ALA . . . . . . . . . . . . . . . -67.59 -19.06 65.2 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.201 -0.937 . . . . 0.58999999999999997 110.091 -179.413 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' D' D ' 354' ' ' GLN . . . . . . . . . . . . . 5.9 tt0 . . . . . 0 N--CA 1.489 1.516 0 O-C-N 121.285 -0.885 . . . . 1.4399999999999999 109.554 -179.744 . . . . . . . . 0 0 . 1 . 028 nuclear build core ' A' A ' 326' ' ' GLU . . . . . . . . . . . . . 32.2 mm-40 . . . . . 0 N--CA 1.488 1.447 0 CA-C-O 121.375 0.607 . . . . 2.1299999999999999 109.594 . . . . . . . . . 0 0 . 1 . 028 nuclear build core ' A' A ' 327' ' ' TYR . . . . . 0.424 ' CE1' ' HG2' ' C' ' 333' ' ' ARG . 39.4 m-85 -148.24 110.99 4.77 Favored 'General case' 0 C--N 1.303 -1.416 0 O-C-N 121.246 -0.909 . . . . 0.47999999999999998 109.759 179.998 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 328' ' ' PHE . . . . . . . . . . . . . 29.5 m-85 -113.9 -171.78 1.96 Allowed 'General case' 0 C--N 1.301 -1.533 0 O-C-N 121.428 -0.795 . . . . 0.31 109.395 179.753 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 329' ' ' THR . . . . . . . . . . . . . 3.3 p -149.16 167.0 27.14 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.307 -0.871 . . . . 0.22 109.059 179.898 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 330' ' ' LEU . . . . . 0.413 ' O ' ' HA ' ' C' ' 329' ' ' THR . 63.3 tp -149.82 129.29 13.01 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.313 -0.867 . . . . 0.28000000000000003 109.762 -179.576 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 331' ' ' GLN . . . . . . . . . . . . . 1.1 tp60 -87.32 113.2 22.83 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.394 -0.816 . . . . 0.91000000000000003 109.418 179.701 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 332' ' ' ILE . . . . . 0.665 HG21 ' HA ' ' A' ' 338' ' ' PHE . 69.7 mt -102.19 107.63 22.16 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.527 0 O-C-N 121.112 -0.993 . . . . 0.26000000000000001 109.611 -179.959 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 333' ' ' ARG . . . . . 0.462 ' HG2' ' CE1' ' C' ' 327' ' ' TYR . 76.1 mtt180 -72.51 143.75 48.25 Favored 'General case' 0 C--N 1.303 -1.445 0 O-C-N 121.492 -0.755 . . . . 2.9199999999999999 109.456 179.925 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 334' ' ' GLY . . . . . . . . . . . . . . . 85.43 128.26 1.98 Allowed Glycine 0 N--CA 1.49 2.252 0 N-CA-C 109.596 -1.402 . . . . 0.40000000000000002 109.596 179.949 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 335' ' ' ARG . . . . . . . . . . . . . 9.2 ttp180 -77.06 -33.36 57.22 Favored 'General case' 0 C--N 1.303 -1.433 0 O-C-N 121.388 -1.066 . . . . 3.0099999999999998 109.197 179.903 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 336' ' ' GLU . . . . . . . . . . . . . 15.1 mt-10 -59.19 -63.89 1.14 Allowed 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.326 -0.859 . . . . 2.29 109.936 -179.781 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 337' ' ' ARG . . . . . 0.46 ' CG ' ' NH1' ' A' ' 337' ' ' ARG . 0.0 OUTLIER -59.25 -29.83 67.83 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 120.985 -1.072 . . . . 2.9300000000000002 109.496 -179.791 . . . . . . . . 3 3 . 1 . 028 nuclear build core ' A' A ' 338' ' ' PHE . . . . . 0.665 ' HA ' HG21 ' A' ' 332' ' ' ILE . 66.5 t80 -55.3 -54.14 47.22 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.199 -0.938 . . . . 0.38 109.544 179.867 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 339' ' ' GLU . . . . . . . . . . . . . 44.6 mt-10 -53.89 -35.37 61.51 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.26 -0.9 . . . . 1.97 109.91 179.979 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 340' ' ' MET . . . . . . . . . . . . . 6.7 ttp -63.46 -52.74 60.12 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.17 -0.956 . . . . 0.31 110.442 -179.075 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 341' ' ' PHE . . . . . . . . . . . . . 51.7 m-85 -60.74 -42.38 97.22 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.05 -1.031 . . . . 0.17999999999999999 109.816 -179.353 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 342' ' ' ARG . . . . . . . . . . . . . 60.6 ttt180 -50.86 -43.34 59.31 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.357 -0.84 . . . . 2.4199999999999999 109.884 -179.73 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 343' ' ' GLU . . . . . . . . . . . . . 3.9 tt0 -59.67 -45.99 90.4 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.178 -0.951 . . . . 2.3500000000000001 109.954 -179.553 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 344' ' ' LEU . . . . . 0.456 HD22 ' CD2' ' B' ' 344' ' ' LEU . 42.8 mt -61.3 -38.69 87.72 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.248 -0.907 . . . . 0.17999999999999999 109.889 -179.625 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 345' ' ' ASN . . . . . . . . . . . . . 64.2 t-20 -57.77 -49.64 75.9 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.202 -0.936 . . . . 1.0900000000000001 110.002 -179.773 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 346' ' ' GLU . . . . . . . . . . . . . 45.8 tt0 -60.78 -33.1 72.47 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.103 -0.998 . . . . 1.6499999999999999 109.837 -179.666 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 347' ' ' ALA . . . . . 0.973 ' HB1' ' HB1' ' B' ' 347' ' ' ALA . . . -59.7 -55.4 34.81 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.058 -1.026 . . . . 0.17999999999999999 110.013 -179.618 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 348' ' ' LEU . . . . . 0.629 HD22 ' N ' ' A' ' 348' ' ' LEU . 3.9 mm? -62.7 -40.22 96.46 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.167 -0.958 . . . . 0.29999999999999999 109.909 -179.455 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 349' ' ' GLU . . . . . 0.449 ' OE2' ' HD3' ' C' ' 333' ' ' ARG . 7.3 mm-40 -57.65 -39.48 77.11 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.218 -0.926 . . . . 1.9399999999999999 109.792 -179.431 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 350' ' ' LEU . . . . . 0.705 HD13 HD22 ' B' ' 350' ' ' LEU . 7.6 tt -61.86 -44.59 96.52 Favored 'General case' 0 N--CA 1.488 1.463 0 O-C-N 121.321 -0.862 . . . . 0.46000000000000002 109.334 -179.972 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 351' ' ' LYS . . . . . . . . . . . . . 42.0 tttt -58.85 -43.5 90.81 Favored 'General case' 0 N--CA 1.488 1.468 0 O-C-N 121.326 -0.859 . . . . 1.3999999999999999 109.235 179.98 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 352' ' ' ASP . . . . . . . . . . . . . 7.3 m-20 -56.65 -55.37 34.93 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.346 -0.846 . . . . 1.1599999999999999 109.676 -179.976 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 353' ' ' ALA . . . . . . . . . . . . . . . -69.02 -11.45 60.8 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.23 -0.919 . . . . 0.63 109.386 179.937 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 354' ' ' GLN . . . . . 0.409 ' HB2' ' O ' ' A' ' 350' ' ' LEU . 11.2 tt0 . . . . . 0 N--CA 1.489 1.511 0 O-C-N 121.181 -0.95 . . . . 1.47 109.488 -179.699 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' B' B ' 326' ' ' GLU . . . . . . . . . . . . . 30.9 mm-40 . . . . . 0 N--CA 1.49 1.565 0 CA-C-O 121.392 0.615 . . . . 2.1299999999999999 109.522 . . . . . . . . . 0 0 . 1 . 028 nuclear build core ' B' B ' 327' ' ' TYR . . . . . . . . . . . . . 38.0 m-85 -148.62 110.51 4.55 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.324 -0.86 . . . . 0.47999999999999998 109.764 -179.695 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' B' B ' 328' ' ' PHE . . . . . 0.442 ' CZ ' ' HB2' ' D' ' 335' ' ' ARG . 30.7 m-85 -114.3 -172.9 2.19 Favored 'General case' 0 N--CA 1.489 1.491 0 O-C-N 121.53 -0.731 . . . . 0.32000000000000001 109.626 179.862 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' B' B ' 329' ' ' THR . . . . . 0.418 ' HA ' ' O ' ' D' ' 330' ' ' LEU . 3.2 p -148.36 167.19 25.89 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.096 -1.002 . . . . 0.23000000000000001 109.143 -179.905 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' B' B ' 330' ' ' LEU . . . . . . . . . . . . . 62.0 tp -150.17 129.6 12.97 Favored 'General case' 0 C--N 1.303 -1.438 0 O-C-N 121.238 -0.914 . . . . 0.28000000000000003 109.617 -179.501 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' B' B ' 331' ' ' GLN . . . . . . . . . . . . . 1.1 tp60 -87.47 114.17 23.84 Favored 'General case' 0 C--N 1.304 -1.412 0 O-C-N 121.3 -0.875 . . . . 0.91000000000000003 109.007 179.608 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' B' B ' 332' ' ' ILE . . . . . 0.643 HG21 ' HA ' ' B' ' 338' ' ' PHE . 70.1 mt -102.87 106.75 20.59 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.465 0 O-C-N 121.227 -0.921 . . . . 0.23999999999999999 109.256 -179.749 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' B' B ' 333' ' ' ARG . . . . . . . . . . . . . 74.9 mtt180 -71.78 144.42 49.2 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.157 -0.964 . . . . 2.9300000000000002 109.458 -179.871 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' B' B ' 334' ' ' GLY . . . . . . . . . . . . . . . 84.75 128.39 1.79 Allowed Glycine 0 N--CA 1.489 2.229 0 N-CA-C 109.741 -1.344 . . . . 0.40000000000000002 109.741 179.886 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' B' B ' 335' ' ' ARG . . . . . . . . . . . . . 8.5 ttp180 -77.42 -32.96 55.02 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.321 -1.106 . . . . 3.0099999999999998 109.449 179.866 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' B' B ' 336' ' ' GLU . . . . . . . . . . . . . 14.1 mt-10 -59.77 -62.8 1.61 Allowed 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.242 -0.911 . . . . 2.2799999999999998 109.843 -179.69 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' B' B ' 337' ' ' ARG . . . . . 0.476 HH11 ' CG ' ' B' ' 337' ' ' ARG . 0.0 OUTLIER -59.96 -30.04 68.83 Favored 'General case' 0 N--CA 1.488 1.472 0 O-C-N 121.166 -0.959 . . . . 2.9300000000000002 109.354 -179.794 . . . . . . . . 3 3 . 1 . 028 nuclear build core ' B' B ' 338' ' ' PHE . . . . . 0.643 ' HA ' HG21 ' B' ' 332' ' ' ILE . 66.8 t80 -55.39 -53.75 52.31 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.146 -0.971 . . . . 0.37 109.629 179.9 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' B' B ' 339' ' ' GLU . . . . . . . . . . . . . 49.3 mt-10 -53.84 -35.83 61.91 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.134 -0.979 . . . . 1.98 109.976 179.827 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' B' B ' 340' ' ' MET . . . . . . . . . . . . . 6.2 ttp -63.12 -52.21 63.48 Favored 'General case' 0 N--CA 1.495 1.785 0 O-C-N 121.196 -0.94 . . . . 0.32000000000000001 110.649 -179.141 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' B' B ' 341' ' ' PHE . . . . . . . . . . . . . 49.5 m-85 -60.93 -43.49 98.57 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.13 -0.981 . . . . 0.17999999999999999 109.59 -179.494 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' B' B ' 342' ' ' ARG . . . . . . . . . . . . . 61.7 ttt180 -49.99 -43.38 50.45 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.433 -0.792 . . . . 2.4199999999999999 109.993 -179.841 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' B' B ' 343' ' ' GLU . . . . . . . . . . . . . 3.7 tt0 -59.88 -45.86 91.16 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.232 -0.918 . . . . 2.3500000000000001 110.14 -179.536 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' B' B ' 344' ' ' LEU . . . . . 0.456 ' CD2' HD22 ' A' ' 344' ' ' LEU . 43.5 mt -61.84 -37.95 86.36 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.189 -0.945 . . . . 0.17999999999999999 110.024 -179.621 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' B' B ' 345' ' ' ASN . . . . . 0.51 ' C ' HD21 ' B' ' 345' ' ' ASN . 0.4 OUTLIER -58.23 -49.05 78.45 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.291 -0.88 . . . . 1.0900000000000001 109.879 -179.708 . . . . . . . . 3 3 . 1 . 028 nuclear build core ' B' B ' 346' ' ' GLU . . . . . . . . . . . . . 46.8 tt0 -60.98 -32.95 72.5 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.209 -0.932 . . . . 1.6599999999999999 109.819 -179.669 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' B' B ' 347' ' ' ALA . . . . . 0.973 ' HB1' ' HB1' ' A' ' 347' ' ' ALA . . . -60.03 -56.18 24.87 Favored 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.101 -1.0 . . . . 0.17000000000000001 110.009 -179.598 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' B' B ' 348' ' ' LEU . . . . . 0.642 HD22 ' N ' ' B' ' 348' ' ' LEU . 3.9 mm? -62.25 -40.36 95.94 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.284 -0.885 . . . . 0.28999999999999998 109.866 -179.567 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' B' B ' 349' ' ' GLU . . . . . . . . . . . . . 7.2 mm-40 -57.43 -39.17 75.65 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 121.211 -0.93 . . . . 1.95 109.913 -179.648 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' B' B ' 350' ' ' LEU . . . . . 0.705 HD22 HD13 ' A' ' 350' ' ' LEU . 7.7 tt -62.35 -45.29 93.84 Favored 'General case' 0 N--CA 1.488 1.456 0 O-C-N 121.201 -0.937 . . . . 0.45000000000000001 109.242 -179.786 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' B' B ' 351' ' ' LYS . . . . . . . . . . . . . 39.2 tttt -58.16 -43.94 87.69 Favored 'General case' 0 C--N 1.302 -1.457 0 O-C-N 121.297 -0.877 . . . . 1.3799999999999999 109.286 179.975 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' B' B ' 352' ' ' ASP . . . . . . . . . . . . . 7.4 m-20 -56.13 -55.72 29.56 Favored 'General case' 0 N--CA 1.488 1.439 0 O-C-N 121.279 -0.888 . . . . 1.1599999999999999 109.526 -179.953 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' B' B ' 353' ' ' ALA . . . . . . . . . . . . . . . -68.38 -12.35 60.98 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.153 -0.967 . . . . 0.60999999999999999 109.777 179.977 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' B' B ' 354' ' ' GLN . . . . . . . . . . . . . 13.2 tt0 . . . . . 0 N--CA 1.492 1.666 0 O-C-N 121.326 -0.859 . . . . 1.45 109.683 -179.772 . . . . . . . . 0 0 . 1 . 028 nuclear build core ' C' C ' 326' ' ' GLU . . . . . 0.51 ' HB3' ' CE2' ' C' ' 328' ' ' PHE . 13.5 mm-40 . . . . . 0 N--CA 1.49 1.562 0 N-CA-C 109.398 -0.593 . . . . 2.1699999999999999 109.398 . . . . . . . . . 1 1 . 1 . 028 nuclear build core ' C' C ' 327' ' ' TYR . . . . . 0.462 ' CE1' ' HG2' ' A' ' 333' ' ' ARG . 38.4 m-85 -147.22 99.09 3.11 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.184 -0.948 . . . . 0.47999999999999998 109.475 179.965 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' C' C ' 328' ' ' PHE . . . . . 0.51 ' CE2' ' HB3' ' C' ' 326' ' ' GLU . 95.0 m-85 -106.85 -167.03 1.23 Allowed 'General case' 0 N--CA 1.487 1.406 0 O-C-N 121.485 -0.759 . . . . 0.33000000000000002 109.055 179.914 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' C' C ' 329' ' ' THR . . . . . 0.413 ' HA ' ' O ' ' A' ' 330' ' ' LEU . 41.5 p -150.98 169.0 22.86 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.31 -0.869 . . . . 0.23000000000000001 109.353 179.967 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' C' C ' 330' ' ' LEU . . . . . 0.401 HD12 ' HA ' ' C' ' 330' ' ' LEU . 29.0 tp -148.72 127.52 12.58 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.214 -0.929 . . . . 0.28000000000000003 109.622 -179.853 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' C' C ' 331' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -87.62 111.64 21.47 Favored 'General case' 0 N--CA 1.489 1.479 0 O-C-N 121.308 -0.87 . . . . 1.48 109.367 179.806 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' C' C ' 332' ' ' ILE . . . . . 0.439 HD12 ' CD1' ' C' ' 338' ' ' PHE . 7.3 mt -103.9 108.04 23.67 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.448 0 O-C-N 121.183 -0.948 . . . . 0.23999999999999999 109.436 179.748 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' C' C ' 333' ' ' ARG . . . . . 0.468 ' NH1' ' HG2' ' C' ' 333' ' ' ARG . 0.0 OUTLIER -73.47 158.39 35.02 Favored 'General case' 0 C--N 1.303 -1.424 0 O-C-N 121.293 -0.879 . . . . 2.7400000000000002 108.871 179.516 . . . . . . . . 3 3 . 1 . 028 nuclear build core ' C' C ' 334' ' ' GLY . . . . . . . . . . . . . . . 74.04 125.94 0.13 Allowed Glycine 0 N--CA 1.491 2.303 0 N-CA-C 109.452 -1.459 . . . . 0.34999999999999998 109.452 -179.929 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' C' C ' 335' ' ' ARG . . . . . 0.521 ' HG3' ' NH1' ' C' ' 335' ' ' ARG . 0.0 OUTLIER -74.75 -33.32 62.31 Favored 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.117 -1.226 . . . . 2.5299999999999998 109.775 -179.861 . . . . . . . . 3 3 . 1 . 028 nuclear build core ' C' C ' 336' ' ' GLU . . . . . . . . . . . . . 1.3 mt-10 -57.49 -59.84 4.55 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.115 -0.991 . . . . 2.6200000000000001 109.678 -179.88 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' C' C ' 337' ' ' ARG . . . . . . . . . . . . . 1.7 mpt_? -61.16 -32.97 72.69 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.252 -0.905 . . . . 2.8100000000000001 109.982 -179.688 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' C' C ' 338' ' ' PHE . . . . . 0.439 ' CD1' HD12 ' C' ' 332' ' ' ILE . 63.7 t80 -55.49 -61.62 2.22 Favored 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.041 -1.037 . . . . 0.40000000000000002 109.615 -179.797 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' C' C ' 339' ' ' GLU . . . . . . . . . . . . . 1.1 mm-40 -49.38 -36.64 22.39 Favored 'General case' 0 C--N 1.3 -1.547 0 O-C-N 121.407 -0.808 . . . . 2.0499999999999998 110.358 -179.114 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' C' C ' 340' ' ' MET . . . . . . . . . . . . . 37.9 ttp -63.9 -48.5 76.37 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.036 -1.04 . . . . 0.32000000000000001 110.051 -179.212 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' C' C ' 341' ' ' PHE . . . . . . . . . . . . . 38.8 m-85 -61.37 -45.92 92.35 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 120.951 -1.093 . . . . 0.17999999999999999 109.539 -179.763 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' C' C ' 342' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -47.63 -38.42 14.67 Favored 'General case' 0 N--CA 1.489 1.491 0 O-C-N 121.252 -0.905 . . . . 2.9100000000000001 109.959 -179.804 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' C' C ' 343' ' ' GLU . . . . . . . . . . . . . 29.0 tp10 -59.04 -50.96 72.09 Favored 'General case' 0 N--CA 1.488 1.47 0 O-C-N 121.182 -0.949 . . . . 2.1400000000000001 109.598 -179.906 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' C' C ' 344' ' ' LEU . . . . . . . . . . . . . 70.8 mt -62.37 -31.55 72.22 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.364 -0.835 . . . . 0.22 109.56 179.931 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' C' C ' 345' ' ' ASN . . . . . . . . . . . . . 18.7 t-20 -57.07 -58.36 8.52 Favored 'General case' 0 N--CA 1.487 1.412 0 O-C-N 121.254 -0.904 . . . . 1.0800000000000001 109.564 179.928 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' C' C ' 346' ' ' GLU . . . . . . . . . . . . . 8.4 tm-20 -61.44 -27.87 68.87 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.46 -0.775 . . . . 2.21 110.028 -179.731 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' C' C ' 347' ' ' ALA . . . . . 0.652 ' HB1' ' HB1' ' D' ' 347' ' ' ALA . . . -62.93 -61.79 2.16 Favored 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.024 -1.048 . . . . 0.17999999999999999 110.16 -179.651 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' C' C ' 348' ' ' LEU . . . . . 0.567 ' N ' HD22 ' C' ' 348' ' ' LEU . 4.2 mm? -60.59 -42.87 97.62 Favored 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.209 -0.932 . . . . 0.32000000000000001 109.707 -179.72 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' C' C ' 349' ' ' GLU . . . . . . . . . . . . . 3.7 mm-40 -58.49 -35.98 73.06 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.11 -0.994 . . . . 2.1899999999999999 109.834 -179.729 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' C' C ' 350' ' ' LEU . . . . . 0.626 ' CD2' HD13 ' D' ' 350' ' ' LEU . 4.1 tt -65.16 -39.59 93.18 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.048 -1.033 . . . . 0.46000000000000002 109.043 179.766 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' C' C ' 351' ' ' LYS . . . . . . . . . . . . . 4.1 tttm -59.25 -40.82 87.19 Favored 'General case' 0 N--CA 1.488 1.452 0 O-C-N 121.394 -0.816 . . . . 1.3500000000000001 109.108 179.914 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' C' C ' 352' ' ' ASP . . . . . . . . . . . . . 41.8 m-20 -57.73 -48.91 78.25 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.41 -0.806 . . . . 1.1899999999999999 109.519 -179.996 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' C' C ' 353' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.487 1.42 0 O-C-N 121.42 -0.8 . . . . 0.56999999999999995 109.537 -179.873 . . . . . . . . 0 0 . 1 . 028 nuclear build core ' D' D ' 326' ' ' GLU . . . . . . . . . . . . . 32.9 mm-40 . . . . . 0 N--CA 1.49 1.574 0 N-CA-C 109.464 -0.569 . . . . 2.1299999999999999 109.464 . . . . . . . . . 0 0 . 1 . 028 nuclear build core ' D' D ' 327' ' ' TYR . . . . . . . . . . . . . 39.1 m-85 -148.45 110.67 4.63 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.187 -0.945 . . . . 0.46999999999999997 109.574 179.916 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' D' D ' 328' ' ' PHE . . . . . 0.404 ' CD1' ' N ' ' D' ' 328' ' ' PHE . 32.9 m-85 -114.06 -171.66 1.95 Allowed 'General case' 0 N--CA 1.488 1.437 0 O-C-N 121.297 -0.877 . . . . 0.29999999999999999 109.402 179.925 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' D' D ' 329' ' ' THR . . . . . . . . . . . . . 3.2 p -149.73 165.95 30.87 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.457 -0.777 . . . . 0.22 109.058 179.944 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' D' D ' 330' ' ' LEU . . . . . 0.418 ' O ' ' HA ' ' B' ' 329' ' ' THR . 63.0 tp -149.46 130.17 14.11 Favored 'General case' 0 C--N 1.303 -1.414 0 O-C-N 121.14 -0.975 . . . . 0.28000000000000003 109.783 -179.534 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' D' D ' 331' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -87.27 113.12 22.72 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.396 -0.815 . . . . 0.93000000000000005 109.302 179.838 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' D' D ' 332' ' ' ILE . . . . . 0.665 HG21 ' HA ' ' D' ' 338' ' ' PHE . 64.5 mt -101.89 106.09 19.11 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.41 0 O-C-N 121.15 -0.969 . . . . 0.25 109.467 -179.877 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' D' D ' 333' ' ' ARG . . . . . . . . . . . . . 72.6 mtt180 -71.74 142.54 49.77 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.476 -0.765 . . . . 2.9300000000000002 109.552 179.952 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' D' D ' 334' ' ' GLY . . . . . . . . . . . . . . . 86.76 127.71 2.3 Favored Glycine 0 N--CA 1.489 2.209 0 N-CA-C 109.56 -1.416 . . . . 0.40999999999999998 109.56 179.732 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' D' D ' 335' ' ' ARG . . . . . 0.442 ' HB2' ' CZ ' ' B' ' 328' ' ' PHE . 7.8 ttp180 -76.96 -33.66 57.65 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.129 -1.218 . . . . 3.0299999999999998 109.31 -179.938 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' D' D ' 336' ' ' GLU . . . . . . . . . . . . . 12.3 mt-10 -58.6 -63.06 1.42 Allowed 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.414 -0.804 . . . . 2.2599999999999998 110.093 -179.854 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' D' D ' 337' ' ' ARG . . . . . 0.456 ' CG ' ' NH1' ' D' ' 337' ' ' ARG . 0.0 OUTLIER -60.42 -29.25 68.87 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.085 -1.009 . . . . 2.9199999999999999 109.307 -179.868 . . . . . . . . 3 3 . 1 . 028 nuclear build core ' D' D ' 338' ' ' PHE . . . . . 0.665 ' HA ' HG21 ' D' ' 332' ' ' ILE . 66.6 t80 -55.83 -53.98 50.13 Favored 'General case' 0 N--CA 1.489 1.492 0 O-C-N 121.247 -0.908 . . . . 0.37 109.288 179.98 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' D' D ' 339' ' ' GLU . . . . . . . . . . . . . 53.4 mt-10 -53.94 -34.97 61.18 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.199 -0.938 . . . . 1.99 110.081 179.94 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' D' D ' 340' ' ' MET . . . . . . . . . . . . . 5.3 ttp -63.68 -52.75 59.26 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.258 -0.901 . . . . 0.31 110.263 -179.112 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' D' D ' 341' ' ' PHE . . . . . . . . . . . . . 50.5 m-85 -60.35 -42.86 96.6 Favored 'General case' 0 N--CA 1.496 1.827 0 O-C-N 121.087 -1.008 . . . . 0.17999999999999999 109.807 -179.656 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' D' D ' 342' ' ' ARG . . . . . . . . . . . . . 62.2 ttt180 -50.66 -43.27 57.32 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.369 -0.832 . . . . 2.4100000000000001 110.123 -179.844 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' D' D ' 343' ' ' GLU . . . . . . . . . . . . . 3.3 tt0 -59.68 -46.66 88.39 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.272 -0.893 . . . . 2.3500000000000001 109.851 -179.712 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' D' D ' 344' ' ' LEU . . . . . . . . . . . . . 43.4 mt -61.07 -39.24 89.12 Favored 'General case' 0 N--CA 1.489 1.525 0 O-C-N 121.207 -0.933 . . . . 0.19 110.004 -179.465 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' D' D ' 345' ' ' ASN . . . . . . . . . . . . . 61.8 t-20 -56.99 -48.95 77.22 Favored 'General case' 0 N--CA 1.488 1.438 0 O-C-N 121.177 -0.952 . . . . 1.0900000000000001 109.943 -179.768 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' D' D ' 346' ' ' GLU . . . . . . . . . . . . . 46.4 tt0 -61.15 -32.69 72.4 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 120.918 -1.114 . . . . 1.6899999999999999 110.037 -179.52 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' D' D ' 347' ' ' ALA . . . . . 0.652 ' HB1' ' HB1' ' C' ' 347' ' ' ALA . . . -60.12 -56.5 20.86 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.073 -1.017 . . . . 0.17999999999999999 110.104 -179.752 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' D' D ' 348' ' ' LEU . . . . . 0.642 HD22 ' N ' ' D' ' 348' ' ' LEU . 3.9 mm? -62.43 -40.35 96.28 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.141 -0.974 . . . . 0.31 109.881 -179.509 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' D' D ' 349' ' ' GLU . . . . . . . . . . . . . 10.3 mm-40 -57.3 -39.74 76.39 Favored 'General case' 0 N--CA 1.495 1.777 0 O-C-N 121.304 -0.872 . . . . 1.95 109.858 -179.568 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' D' D ' 350' ' ' LEU . . . . . 0.626 HD13 ' CD2' ' C' ' 350' ' ' LEU . 7.9 tt -61.89 -45.71 92.56 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.285 -0.885 . . . . 0.42999999999999999 109.317 179.936 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' D' D ' 351' ' ' LYS . . . . . . . . . . . . . 34.4 tttt -58.05 -42.95 86.5 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.418 -0.802 . . . . 1.3999999999999999 109.453 179.851 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' D' D ' 352' ' ' ASP . . . . . . . . . . . . . 8.0 m-20 -57.01 -54.88 41.69 Favored 'General case' 0 N--CA 1.488 1.448 0 O-C-N 121.262 -0.899 . . . . 1.1699999999999999 109.473 -179.993 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' D' D ' 353' ' ' ALA . . . . . . . . . . . . . . . -69.2 -12.36 61.61 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.326 -0.859 . . . . 0.58999999999999997 109.705 179.923 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' D' D ' 354' ' ' GLN . . . . . . . . . . . . . 13.5 tt0 . . . . . 0 N--CA 1.488 1.472 0 O-C-N 121.161 -0.962 . . . . 1.4399999999999999 109.802 -179.918 . . . . . . . . 0 0 . 1 . 029 nuclear build core ' A' A ' 326' ' ' GLU . . . . . . . . . . . . . 2.4 mt-10 . . . . . 0 N--CA 1.489 1.508 0 N-CA-C 109.151 -0.685 . . . . 2.1299999999999999 109.151 . . . . . . . . . 0 0 . 1 . 029 nuclear build core ' A' A ' 327' ' ' TYR . . . . . 0.554 ' CE1' ' HG2' ' C' ' 333' ' ' ARG . 46.3 m-85 -150.29 108.56 3.77 Favored 'General case' 0 N--CA 1.488 1.463 0 O-C-N 121.152 -0.967 . . . . 0.47999999999999998 109.788 -179.888 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 328' ' ' PHE . . . . . 0.469 ' CZ ' ' HG3' ' C' ' 335' ' ' ARG . 86.6 m-85 -108.45 -161.86 0.79 Allowed 'General case' 0 N--CA 1.488 1.47 0 O-C-N 121.308 -0.87 . . . . 0.31 109.377 179.936 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 329' ' ' THR . . . . . 0.442 HG23 ' O ' ' A' ' 328' ' ' PHE . 24.2 p -155.27 167.69 29.53 Favored 'General case' 0 N--CA 1.488 1.469 0 O-C-N 121.272 -0.892 . . . . 0.22 109.193 179.913 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 330' ' ' LEU . . . . . 0.426 ' O ' ' HA ' ' C' ' 329' ' ' THR . 24.4 tp -150.06 125.4 10.15 Favored 'General case' 0 N--CA 1.489 1.486 0 O-C-N 121.212 -0.93 . . . . 0.28000000000000003 109.594 -179.924 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 331' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -87.01 115.69 24.56 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.316 -0.865 . . . . 0.91000000000000003 109.209 179.857 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 332' ' ' ILE . . . . . 0.719 HG21 ' HA ' ' A' ' 338' ' ' PHE . 68.6 mt -103.61 113.98 41.96 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.511 0 O-C-N 121.217 -0.927 . . . . 0.26000000000000001 109.588 -179.871 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 333' ' ' ARG . . . . . 0.416 ' HG2' ' CE1' ' C' ' 327' ' ' TYR . 31.6 mtt180 -72.74 151.84 41.94 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.313 -0.867 . . . . 2.9199999999999999 109.404 179.9 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 334' ' ' GLY . . . . . . . . . . . . . . . 73.92 131.47 0.21 Allowed Glycine 0 N--CA 1.492 2.374 0 N-CA-C 109.589 -1.404 . . . . 0.40000000000000002 109.589 -179.967 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 335' ' ' ARG . . . . . 0.429 ' HA ' ' CE1' ' C' ' 328' ' ' PHE . 0.1 OUTLIER -77.59 -35.29 53.06 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.283 -1.128 . . . . 3.0099999999999998 109.463 -179.994 . . . . . . . . 3 3 . 1 . 029 nuclear build core ' A' A ' 336' ' ' GLU . . . . . . . . . . . . . 45.3 mt-10 -57.59 -61.5 2.46 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.259 -0.901 . . . . 2.29 109.723 -179.843 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 337' ' ' ARG . . . . . 0.917 ' CZ ' HD12 ' C' ' 348' ' ' LEU . 1.9 mtp180 -60.07 -31.35 69.91 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.273 -0.892 . . . . 2.9300000000000002 109.571 -179.877 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 338' ' ' PHE . . . . . 0.719 ' HA ' HG21 ' A' ' 332' ' ' ILE . 44.5 t80 -54.89 -61.1 2.53 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.297 -0.877 . . . . 0.38 109.284 179.835 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 339' ' ' GLU . . . . . . . . . . . . . 93.4 mt-10 -51.43 -27.8 11.23 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.273 -0.892 . . . . 1.97 109.586 -179.941 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 340' ' ' MET . . . . . 0.411 ' HB3' ' O ' ' A' ' 337' ' ' ARG . 26.9 ttp -64.74 -54.26 34.29 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.241 -0.912 . . . . 0.31 109.716 -179.903 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 341' ' ' PHE . . . . . 0.432 ' HB2' HD13 ' A' ' 332' ' ' ILE . 47.5 m-85 -61.79 -41.77 98.15 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.24 -0.912 . . . . 0.17999999999999999 109.656 -179.746 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 342' ' ' ARG . . . . . . . . . . . . . 4.4 ttt180 -49.2 -42.2 39.44 Favored 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.3 -0.875 . . . . 2.4199999999999999 109.524 179.988 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 343' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -59.2 -46.66 87.85 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.175 -0.953 . . . . 2.3500000000000001 109.735 -179.835 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 344' ' ' LEU . . . . . . . . . . . . . 36.6 mt -61.85 -31.82 72.11 Favored 'General case' 0 N--CA 1.489 1.486 0 O-C-N 121.144 -0.972 . . . . 0.17999999999999999 109.559 -179.91 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 345' ' ' ASN . . . . . . . . . . . . . 26.5 t-20 -57.95 -57.31 13.37 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.231 -0.918 . . . . 1.0900000000000001 109.683 -179.867 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 346' ' ' GLU . . . . . . . . . . . . . 20.3 tt0 -60.66 -28.32 68.5 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.306 -0.871 . . . . 1.6499999999999999 109.912 -179.571 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 347' ' ' ALA . . . . . 0.726 ' HB1' ' HB1' ' B' ' 347' ' ' ALA . . . -60.47 -58.95 6.32 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.225 -0.922 . . . . 0.17999999999999999 109.933 -179.805 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 348' ' ' LEU . . . . . 0.621 HD22 ' N ' ' A' ' 348' ' ' LEU . 4.0 mm? -62.23 -46.83 87.12 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.196 -0.94 . . . . 0.29999999999999999 110.007 -179.482 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 349' ' ' GLU . . . . . . . . . . . . . 2.3 mt-10 -58.21 -29.05 65.37 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.22 -0.925 . . . . 1.9399999999999999 109.965 -179.459 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 350' ' ' LEU . . . . . 0.787 ' CD1' HD22 ' B' ' 350' ' ' LEU . 3.4 tt -64.17 -50.93 66.2 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.118 -0.989 . . . . 0.46000000000000002 109.22 179.957 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 351' ' ' LYS . . . . . . . . . . . . . 24.7 tttt -60.03 -38.54 83.03 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.372 -0.83 . . . . 1.3999999999999999 109.375 179.965 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 352' ' ' ASP . . . . . 0.43 ' OD1' ' NH2' ' C' ' 337' ' ' ARG . 16.9 m-20 -56.95 -44.78 82.91 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.206 -0.934 . . . . 1.1599999999999999 109.756 179.997 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 353' ' ' ALA . . . . . . . . . . . . . . . -67.01 -20.1 65.81 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.29 -0.881 . . . . 0.63 109.798 -179.624 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 354' ' ' GLN . . . . . . . . . . . . . 1.5 mt-30 . . . . . 0 N--CA 1.49 1.569 0 O-C-N 121.06 -1.025 . . . . 1.47 109.561 -179.999 . . . . . . . . 0 0 . 1 . 029 nuclear build core ' B' B ' 326' ' ' GLU . . . . . . . . . . . . . 2.4 mt-10 . . . . . 0 N--CA 1.49 1.572 0 N-CA-C 109.158 -0.682 . . . . 2.1299999999999999 109.158 . . . . . . . . . 0 0 . 1 . 029 nuclear build core ' B' B ' 327' ' ' TYR . . . . . 0.442 ' CE1' ' HG2' ' D' ' 333' ' ' ARG . 46.9 m-85 -150.24 108.55 3.77 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.163 -0.96 . . . . 0.47999999999999998 109.815 -179.902 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' B' B ' 328' ' ' PHE . . . . . 0.438 ' O ' HG23 ' B' ' 329' ' ' THR . 86.5 m-85 -108.45 -162.18 0.81 Allowed 'General case' 0 N--CA 1.489 1.48 0 O-C-N 121.267 -0.895 . . . . 0.32000000000000001 109.404 179.817 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' B' B ' 329' ' ' THR . . . . . 0.438 HG23 ' O ' ' B' ' 328' ' ' PHE . 24.2 p -155.11 167.52 30.09 Favored 'General case' 0 N--CA 1.489 1.491 0 O-C-N 121.27 -0.893 . . . . 0.23000000000000001 109.283 179.795 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' B' B ' 330' ' ' LEU . . . . . 0.467 ' O ' ' HA ' ' D' ' 329' ' ' THR . 24.3 tp -149.79 125.74 10.55 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.171 -0.955 . . . . 0.28000000000000003 109.531 -179.846 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' B' B ' 331' ' ' GLN . . . . . . . . . . . . . 1.3 tt0 -87.28 115.6 24.79 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.256 -0.902 . . . . 0.91000000000000003 109.289 179.832 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' B' B ' 332' ' ' ILE . . . . . 0.746 HG21 ' HA ' ' B' ' 338' ' ' PHE . 68.4 mt -103.47 114.47 43.17 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.521 0 O-C-N 121.136 -0.978 . . . . 0.23999999999999999 109.644 -179.971 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' B' B ' 333' ' ' ARG . . . . . 0.472 ' HG2' ' CE1' ' D' ' 327' ' ' TYR . 32.6 mtt180 -73.15 151.86 41.38 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.253 -0.904 . . . . 2.9300000000000002 109.429 179.887 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' B' B ' 334' ' ' GLY . . . . . . . . . . . . . . . 73.88 131.2 0.2 Allowed Glycine 0 N--CA 1.491 2.327 0 N-CA-C 109.523 -1.431 . . . . 0.40000000000000002 109.523 179.959 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' B' B ' 335' ' ' ARG . . . . . 0.423 ' HA ' ' CE1' ' D' ' 328' ' ' PHE . 0.1 OUTLIER -77.36 -35.34 54.62 Favored 'General case' 0 N--CA 1.488 1.47 0 O-C-N 121.294 -1.121 . . . . 3.0099999999999998 109.477 -179.979 . . . . . . . . 3 3 . 1 . 029 nuclear build core ' B' B ' 336' ' ' GLU . . . . . . . . . . . . . 46.3 mt-10 -57.22 -61.79 2.22 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.295 -0.878 . . . . 2.2799999999999998 109.656 -179.926 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' B' B ' 337' ' ' ARG . . . . . 0.487 ' NH2' HD12 ' D' ' 348' ' ' LEU . 1.9 mtp180 -60.14 -30.99 69.67 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.249 -0.907 . . . . 2.9300000000000002 109.611 -179.698 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' B' B ' 338' ' ' PHE . . . . . 0.746 ' HA ' HG21 ' B' ' 332' ' ' ILE . 44.8 t80 -55.21 -60.94 2.7 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.235 -0.916 . . . . 0.37 109.293 179.872 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' B' B ' 339' ' ' GLU . . . . . . . . . . . . . 93.4 mt-10 -51.4 -27.81 11.06 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.271 -0.893 . . . . 1.98 109.483 179.952 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' B' B ' 340' ' ' MET . . . . . 0.409 ' HB3' ' O ' ' B' ' 337' ' ' ARG . 27.4 ttp -64.75 -54.21 34.91 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.351 -0.843 . . . . 0.32000000000000001 109.698 -179.852 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' B' B ' 341' ' ' PHE . . . . . 0.427 ' HB2' HD13 ' B' ' 332' ' ' ILE . 46.9 m-85 -61.79 -42.07 98.53 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.317 -0.865 . . . . 0.17999999999999999 109.656 -179.69 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' B' B ' 342' ' ' ARG . . . . . . . . . . . . . 4.3 ttt180 -49.01 -42.12 36.91 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.219 -0.926 . . . . 2.4199999999999999 109.552 -179.95 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' B' B ' 343' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -59.24 -46.63 87.96 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.278 -0.889 . . . . 2.3500000000000001 109.681 -179.797 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' B' B ' 344' ' ' LEU . . . . . . . . . . . . . 36.2 mt -61.87 -31.93 72.24 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.178 -0.951 . . . . 0.17999999999999999 109.559 -179.928 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' B' B ' 345' ' ' ASN . . . . . . . . . . . . . 27.1 t-20 -57.69 -57.67 11.7 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.326 -0.858 . . . . 1.0900000000000001 109.759 -179.909 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' B' B ' 346' ' ' GLU . . . . . . . . . . . . . 20.4 tt0 -60.36 -28.29 68.07 Favored 'General case' 0 N--CA 1.489 1.525 0 O-C-N 121.385 -0.822 . . . . 1.6599999999999999 109.916 -179.589 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' B' B ' 347' ' ' ALA . . . . . 0.726 ' HB1' ' HB1' ' A' ' 347' ' ' ALA . . . -60.7 -58.71 7.31 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.12 -0.988 . . . . 0.17000000000000001 109.894 -179.732 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' B' B ' 348' ' ' LEU . . . . . 0.626 HD22 ' N ' ' B' ' 348' ' ' LEU . 4.0 mm? -62.1 -47.2 85.67 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.23 -0.918 . . . . 0.28999999999999998 109.955 -179.563 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' B' B ' 349' ' ' GLU . . . . . . . . . . . . . 2.3 mt-10 -57.95 -29.05 64.87 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.233 -0.917 . . . . 1.95 109.967 -179.458 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' B' B ' 350' ' ' LEU . . . . . 0.787 HD22 ' CD1' ' A' ' 350' ' ' LEU . 3.5 tt -64.17 -51.11 65.38 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.15 -0.969 . . . . 0.45000000000000001 109.207 179.871 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' B' B ' 351' ' ' LYS . . . . . . . . . . . . . 24.1 tttt -59.81 -38.43 81.95 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.403 -0.811 . . . . 1.3799999999999999 109.41 -179.938 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' B' B ' 352' ' ' ASP . . . . . . . . . . . . . 18.1 m-20 -57.07 -44.88 83.51 Favored 'General case' 0 N--CA 1.491 1.625 0 O-C-N 121.334 -0.854 . . . . 1.1599999999999999 109.773 -179.971 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' B' B ' 353' ' ' ALA . . . . . . . . . . . . . . . -66.88 -19.9 65.82 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.208 -0.933 . . . . 0.60999999999999999 109.742 -179.572 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' B' B ' 354' ' ' GLN . . . . . . . . . . . . . 1.6 mt-30 . . . . . 0 N--CA 1.491 1.595 0 O-C-N 121.215 -0.928 . . . . 1.45 109.527 -179.973 . . . . . . . . 0 0 . 1 . 029 nuclear build core ' C' C ' 326' ' ' GLU . . . . . . . . . . . . . 80.2 mm-40 . . . . . 0 N--CA 1.49 1.545 0 N-CA-C 109.146 -0.687 . . . . 2.1699999999999999 109.146 . . . . . . . . . 0 0 . 1 . 029 nuclear build core ' C' C ' 327' ' ' TYR . . . . . 0.416 ' CE1' ' HG2' ' A' ' 333' ' ' ARG . 55.5 m-85 -149.57 107.14 3.65 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.058 -1.026 . . . . 0.47999999999999998 109.816 -179.744 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' C' C ' 328' ' ' PHE . . . . . 0.441 ' O ' HG23 ' C' ' 329' ' ' THR . 80.8 m-85 -107.16 -162.86 0.87 Allowed 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.126 -0.984 . . . . 0.33000000000000002 109.36 179.663 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' C' C ' 329' ' ' THR . . . . . 0.441 HG23 ' O ' ' C' ' 328' ' ' PHE . 34.0 p -155.23 163.31 40.35 Favored 'General case' 0 N--CA 1.489 1.497 0 O-C-N 121.272 -0.892 . . . . 0.23000000000000001 109.259 179.915 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' C' C ' 330' ' ' LEU . . . . . . . . . . . . . 48.5 tp -149.55 128.56 12.67 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.235 -0.916 . . . . 0.28000000000000003 109.555 -179.767 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' C' C ' 331' ' ' GLN . . . . . . . . . . . . . 1.1 tt0 -86.29 117.72 25.28 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.231 -0.918 . . . . 1.48 109.251 179.881 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' C' C ' 332' ' ' ILE . . . . . 0.708 HG21 ' HA ' ' C' ' 338' ' ' PHE . 40.6 mt -103.38 112.36 36.57 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.557 0 O-C-N 121.244 -0.91 . . . . 0.23999999999999999 109.714 -179.805 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' C' C ' 333' ' ' ARG . . . . . 0.554 ' HG2' ' CE1' ' A' ' 327' ' ' TYR . 0.1 OUTLIER -74.25 136.34 42.69 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.303 -0.873 . . . . 2.7400000000000002 109.546 179.847 . . . . . . . . 3 3 . 1 . 029 nuclear build core ' C' C ' 334' ' ' GLY . . . . . . . . . . . . . . . 87.52 132.81 3.79 Favored Glycine 0 N--CA 1.492 2.388 0 N-CA-C 109.741 -1.344 . . . . 0.34999999999999998 109.741 179.692 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' C' C ' 335' ' ' ARG . . . . . 0.469 ' HG3' ' CZ ' ' A' ' 328' ' ' PHE . 1.8 tmm_? -80.43 -38.06 30.84 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.292 -1.122 . . . . 2.5299999999999998 109.724 -179.971 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' C' C ' 336' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -56.44 -58.22 8.95 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.13 -0.981 . . . . 2.6200000000000001 109.67 -179.831 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' C' C ' 337' ' ' ARG . . . . . 0.43 ' NH2' ' OD1' ' A' ' 352' ' ' ASP . 0.4 OUTLIER -60.63 -30.14 69.68 Favored 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.28 -0.887 . . . . 2.8100000000000001 109.657 -179.803 . . . . . . . . 3 3 . 1 . 029 nuclear build core ' C' C ' 338' ' ' PHE . . . . . 0.708 ' HA ' HG21 ' C' ' 332' ' ' ILE . 61.1 t80 -56.01 -55.91 27.06 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.152 -0.968 . . . . 0.40000000000000002 109.87 -179.841 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' C' C ' 339' ' ' GLU . . . . . . . . . . . . . 5.1 mt-10 -50.16 -34.14 21.39 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.11 -0.994 . . . . 2.0499999999999998 109.887 -179.735 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' C' C ' 340' ' ' MET . . . . . . . . . . . . . 3.5 ttt -62.98 -50.2 71.7 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.118 -0.989 . . . . 0.32000000000000001 109.889 -179.702 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' C' C ' 341' ' ' PHE . . . . . . . . . . . . . 37.1 m-85 -62.14 -49.62 75.15 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.087 -1.008 . . . . 0.17999999999999999 110.113 -179.664 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' C' C ' 342' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -47.86 -38.71 16.79 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.222 -0.924 . . . . 2.9100000000000001 110.011 -179.655 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' C' C ' 343' ' ' GLU . . . . . . . . . . . . . 2.5 tt0 -58.27 -49.47 77.03 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.143 -0.973 . . . . 2.1400000000000001 109.579 -179.823 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' C' C ' 344' ' ' LEU . . . . . 0.56 HD22 ' CD2' ' D' ' 344' ' ' LEU . 81.3 mt -63.52 -33.52 75.76 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.257 -0.902 . . . . 0.22 109.836 -179.971 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' C' C ' 345' ' ' ASN . . . . . 0.418 ' C ' ' OD1' ' C' ' 345' ' ' ASN . 16.6 t-20 -57.5 -58.76 6.86 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.192 -0.942 . . . . 1.0800000000000001 109.732 -179.791 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' C' C ' 346' ' ' GLU . . . . . . . . . . . . . 1.3 tt0 -60.46 -26.61 66.89 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.192 -0.943 . . . . 2.21 109.57 -179.603 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' C' C ' 347' ' ' ALA . . . . . 0.81 ' HB1' ' HB1' ' D' ' 347' ' ' ALA . . . -62.9 -56.69 15.0 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.185 -0.947 . . . . 0.17999999999999999 109.738 179.923 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' C' C ' 348' ' ' LEU . . . . . 0.917 HD12 ' CZ ' ' A' ' 337' ' ' ARG . 4.2 mm? -61.73 -47.97 82.82 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.245 -0.909 . . . . 0.32000000000000001 110.061 -179.672 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' C' C ' 349' ' ' GLU . . . . . . . . . . . . . 47.9 mm-40 -57.78 -34.6 69.75 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.25 -0.906 . . . . 2.1899999999999999 110.269 -179.229 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' C' C ' 350' ' ' LEU . . . . . 0.795 HD22 ' CD1' ' D' ' 350' ' ' LEU . 5.4 tt -63.98 -45.88 87.07 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.11 -0.994 . . . . 0.46000000000000002 109.221 -179.887 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' C' C ' 351' ' ' LYS . . . . . . . . . . . . . 12.7 tttp -60.15 -46.45 89.62 Favored 'General case' 0 N--CA 1.488 1.426 0 O-C-N 121.455 -0.778 . . . . 1.3500000000000001 109.381 179.892 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' C' C ' 352' ' ' ASP . . . . . . . . . . . . . 76.6 m-20 -57.7 -37.93 74.34 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.351 -0.843 . . . . 1.1899999999999999 109.565 -179.967 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' C' C ' 353' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.493 1.676 0 O-C-N 121.287 -0.883 . . . . 0.56999999999999995 109.767 -179.809 . . . . . . . . 0 0 . 1 . 029 nuclear build core ' D' D ' 326' ' ' GLU . . . . . . . . . . . . . 2.4 mt-10 . . . . . 0 N--CA 1.489 1.498 0 N-CA-C 109.287 -0.634 . . . . 2.1299999999999999 109.287 . . . . . . . . . 0 0 . 1 . 029 nuclear build core ' D' D ' 327' ' ' TYR . . . . . 0.472 ' CE1' ' HG2' ' B' ' 333' ' ' ARG . 47.2 m-85 -150.12 108.42 3.77 Favored 'General case' 0 N--CA 1.489 1.485 0 O-C-N 121.162 -0.961 . . . . 0.46999999999999997 109.818 -179.803 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' D' D ' 328' ' ' PHE . . . . . 0.457 ' O ' HG23 ' D' ' 329' ' ' THR . 87.4 m-85 -108.25 -161.96 0.8 Allowed 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.302 -0.874 . . . . 0.29999999999999999 109.433 179.771 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' D' D ' 329' ' ' THR . . . . . 0.467 ' HA ' ' O ' ' B' ' 330' ' ' LEU . 23.6 p -155.24 167.64 29.71 Favored 'General case' 0 N--CA 1.489 1.49 0 O-C-N 121.253 -0.905 . . . . 0.22 109.244 179.864 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' D' D ' 330' ' ' LEU . . . . . 0.436 ' O ' ' HA ' ' B' ' 329' ' ' THR . 24.0 tp -149.98 125.51 10.27 Favored 'General case' 0 N--CA 1.489 1.478 0 O-C-N 121.195 -0.941 . . . . 0.28000000000000003 109.605 -179.951 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' D' D ' 331' ' ' GLN . . . . . . . . . . . . . 1.3 tt0 -87.03 115.6 24.52 Favored 'General case' 0 N--CA 1.488 1.471 0 O-C-N 121.245 -0.909 . . . . 0.93000000000000005 109.23 179.837 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' D' D ' 332' ' ' ILE . . . . . 0.731 HG21 ' HA ' ' D' ' 338' ' ' PHE . 69.9 mt -103.55 114.24 42.59 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.507 0 O-C-N 121.177 -0.952 . . . . 0.25 109.537 -179.898 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' D' D ' 333' ' ' ARG . . . . . 0.442 ' HG2' ' CE1' ' B' ' 327' ' ' TYR . 32.9 mtt180 -72.83 151.98 41.76 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.321 -0.862 . . . . 2.9300000000000002 109.391 179.835 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' D' D ' 334' ' ' GLY . . . . . . . . . . . . . . . 73.64 131.38 0.19 Allowed Glycine 0 N--CA 1.491 2.33 0 N-CA-C 109.546 -1.422 . . . . 0.40999999999999998 109.546 179.902 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' D' D ' 335' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -77.45 -35.36 53.99 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.269 -1.136 . . . . 3.0299999999999998 109.453 -179.986 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' D' D ' 336' ' ' GLU . . . . . . . . . . . . . 47.8 mt-10 -57.33 -61.6 2.36 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.251 -0.906 . . . . 2.2599999999999998 109.647 -179.909 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' D' D ' 337' ' ' ARG . . . . . 0.495 ' NH2' HD12 ' B' ' 348' ' ' LEU . 1.9 mtp180 -60.18 -31.03 69.73 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.304 -0.873 . . . . 2.9199999999999999 109.64 -179.755 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' D' D ' 338' ' ' PHE . . . . . 0.731 ' HA ' HG21 ' D' ' 332' ' ' ILE . 45.2 t80 -55.18 -60.72 3.0 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.301 -0.874 . . . . 0.37 109.279 179.909 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' D' D ' 339' ' ' GLU . . . . . . . . . . . . . 92.9 mt-10 -51.62 -27.86 12.58 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.401 -0.812 . . . . 1.99 109.565 179.988 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' D' D ' 340' ' ' MET . . . . . 0.4 ' HB3' ' O ' ' D' ' 337' ' ' ARG . 28.0 ttp -64.73 -54.2 35.26 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.204 -0.935 . . . . 0.31 109.748 -179.953 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' D' D ' 341' ' ' PHE . . . . . 0.434 ' HB2' HD13 ' D' ' 332' ' ' ILE . 47.3 m-85 -61.78 -41.92 98.34 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.222 -0.924 . . . . 0.17999999999999999 109.713 -179.728 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' D' D ' 342' ' ' ARG . . . . . . . . . . . . . 4.5 ttt180 -49.25 -41.77 38.61 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.264 -0.898 . . . . 2.4100000000000001 109.563 -179.972 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' D' D ' 343' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -59.59 -46.64 88.34 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.361 -0.837 . . . . 2.3500000000000001 109.63 -179.839 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' D' D ' 344' ' ' LEU . . . . . 0.56 ' CD2' HD22 ' C' ' 344' ' ' LEU . 36.7 mt -61.99 -31.63 72.01 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.132 -0.98 . . . . 0.19 109.515 -179.939 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' D' D ' 345' ' ' ASN . . . . . . . . . . . . . 26.7 t-20 -58.07 -57.15 14.09 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.174 -0.954 . . . . 1.0900000000000001 109.736 -179.868 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' D' D ' 346' ' ' GLU . . . . . . . . . . . . . 19.3 tt0 -60.75 -28.28 68.58 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.358 -0.839 . . . . 1.6899999999999999 109.916 -179.542 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' D' D ' 347' ' ' ALA . . . . . 0.81 ' HB1' ' HB1' ' C' ' 347' ' ' ALA . . . -60.89 -58.56 7.91 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.189 -0.944 . . . . 0.17999999999999999 109.83 -179.71 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' D' D ' 348' ' ' LEU . . . . . 0.637 HD22 ' N ' ' D' ' 348' ' ' LEU . 4.0 mm? -62.22 -47.01 86.3 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.19 -0.944 . . . . 0.31 109.98 -179.514 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' D' D ' 349' ' ' GLU . . . . . . . . . . . . . 2.4 mt-10 -58.25 -29.03 65.44 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.168 -0.957 . . . . 1.95 110.04 -179.493 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' D' D ' 350' ' ' LEU . . . . . 0.795 ' CD1' HD22 ' C' ' 350' ' ' LEU . 3.5 tt -63.98 -50.87 66.86 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.141 -0.974 . . . . 0.42999999999999999 109.235 179.818 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' D' D ' 351' ' ' LYS . . . . . . . . . . . . . 24.2 tttt -59.94 -38.53 82.67 Favored 'General case' 0 N--CA 1.489 1.487 0 O-C-N 121.44 -0.787 . . . . 1.3999999999999999 109.47 179.915 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' D' D ' 352' ' ' ASP . . . . . . . . . . . . . 19.9 m-20 -57.19 -44.34 83.5 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.202 -0.936 . . . . 1.1699999999999999 109.797 -179.94 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' D' D ' 353' ' ' ALA . . . . . . . . . . . . . . . -67.26 -20.2 65.62 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.232 -0.917 . . . . 0.58999999999999997 109.743 -179.652 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' D' D ' 354' ' ' GLN . . . . . . . . . . . . . 6.9 mt-30 . . . . . 0 N--CA 1.491 1.577 0 O-C-N 121.115 -0.991 . . . . 1.4399999999999999 109.554 -179.925 . . . . . . . . 0 0 . 1 . 030 nuclear build core ' A' A ' 326' ' ' GLU . . . . . . . . . . . . . 8.6 mt-10 . . . . . 0 N--CA 1.487 1.38 0 N-CA-C 109.457 -0.571 . . . . 2.1299999999999999 109.457 . . . . . . . . . 0 0 . 1 . 030 nuclear build core ' A' A ' 327' ' ' TYR . . . . . 0.573 ' CE1' ' HG2' ' C' ' 333' ' ' ARG . 44.9 m-85 -149.08 107.96 3.87 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.082 -1.011 . . . . 0.47999999999999998 109.885 -179.529 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 328' ' ' PHE . . . . . . . . . . . . . 18.4 m-85 -112.88 -166.72 1.1 Allowed 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.341 -0.849 . . . . 0.31 109.389 179.912 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 329' ' ' THR . . . . . . . . . . . . . 13.6 p -153.88 169.53 23.19 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.431 -0.793 . . . . 0.22 109.012 179.98 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 330' ' ' LEU . . . . . . . . . . . . . 18.2 tp -151.51 134.23 15.61 Favored 'General case' 0 C--N 1.302 -1.457 0 O-C-N 121.176 -0.952 . . . . 0.28000000000000003 109.561 179.758 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 331' ' ' GLN . . . . . . . . . . . . . 2.1 tp60 -86.66 114.19 23.16 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.204 -0.935 . . . . 0.91000000000000003 109.413 179.835 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 332' ' ' ILE . . . . . 0.907 HG21 ' HA ' ' A' ' 338' ' ' PHE . 64.0 mt -103.17 101.65 12.5 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.392 0 O-C-N 121.323 -0.861 . . . . 0.26000000000000001 109.331 179.835 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 333' ' ' ARG . . . . . . . . . . . . . 57.3 mtt180 -71.86 152.72 42.4 Favored 'General case' 0 N--CA 1.487 1.409 0 O-C-N 121.403 -0.81 . . . . 2.9199999999999999 109.829 -179.516 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 334' ' ' GLY . . . . . . . . . . . . . . . 76.27 131.36 0.39 Allowed Glycine 0 N--CA 1.489 2.224 0 N-CA-C 109.813 -1.315 . . . . 0.40000000000000002 109.813 179.974 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 335' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -74.61 -34.85 62.91 Favored 'General case' 0 N--CA 1.488 1.449 0 O-C-N 121.181 -1.188 . . . . 3.0099999999999998 109.743 -179.867 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 336' ' ' GLU . . . . . . . . . . . . . 15.1 mt-10 -58.82 -58.35 9.0 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.195 -0.941 . . . . 2.29 109.777 -179.864 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 337' ' ' ARG . . . . . 0.428 ' CZ ' HD12 ' C' ' 348' ' ' LEU . 5.8 mmt180 -60.73 -36.2 78.26 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.082 -1.011 . . . . 2.9300000000000002 109.754 -179.783 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 338' ' ' PHE . . . . . 0.907 ' HA ' HG21 ' A' ' 332' ' ' ILE . 59.7 t80 -53.89 -60.89 2.74 Favored 'General case' 0 C--N 1.302 -1.486 0 O-C-N 120.95 -1.094 . . . . 0.38 109.419 179.978 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 339' ' ' GLU . . . . . . . . . . . . . 73.8 mt-10 -49.44 -36.31 22.05 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.384 -0.823 . . . . 1.97 110.64 -179.432 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 340' ' ' MET . . . . . . . . . . . . . 48.2 ttp -63.28 -49.65 73.21 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 120.979 -1.076 . . . . 0.31 110.145 -179.417 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 341' ' ' PHE . . . . . . . . . . . . . 52.7 m-85 -62.52 -46.17 89.62 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.308 -0.87 . . . . 0.17999999999999999 109.636 -179.546 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 342' ' ' ARG . . . . . . . . . . . . . 12.6 ttp180 -47.43 -43.89 24.27 Favored 'General case' 0 N--CA 1.493 1.711 0 O-C-N 121.401 -0.812 . . . . 2.4199999999999999 109.928 -179.579 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 343' ' ' GLU . . . . . . . . . . . . . 29.1 tt0 -58.6 -48.51 80.71 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.372 -0.83 . . . . 2.3500000000000001 109.869 -179.517 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 344' ' ' LEU . . . . . 0.439 ' O ' ' HB3' ' A' ' 347' ' ' ALA . 55.3 mt -60.97 -30.79 70.47 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.196 -0.94 . . . . 0.17999999999999999 109.566 -179.671 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 345' ' ' ASN . . . . . . . . . . . . . 11.3 t-20 -57.8 -59.59 5.0 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.252 -0.905 . . . . 1.0900000000000001 109.635 -179.943 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 346' ' ' GLU . . . . . . . . . . . . . 79.4 tt0 -60.01 -24.78 64.76 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.148 -0.97 . . . . 1.6499999999999999 109.652 -179.767 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 347' ' ' ALA . . . . . 0.6 ' HB1' ' HB1' ' B' ' 347' ' ' ALA . . . -61.84 -61.61 2.38 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.376 -0.827 . . . . 0.17999999999999999 109.75 179.809 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 348' ' ' LEU . . . . . 0.621 HD22 ' N ' ' A' ' 348' ' ' LEU . 3.8 mm? -61.39 -46.67 89.19 Favored 'General case' 0 N--CA 1.495 1.812 0 O-C-N 121.31 -0.869 . . . . 0.29999999999999999 109.868 -179.604 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 349' ' ' GLU . . . . . . . . . . . . . 25.8 mm-40 -56.44 -34.0 66.4 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.235 -0.916 . . . . 1.9399999999999999 109.736 -179.456 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 350' ' ' LEU . . . . . 0.55 HD23 ' O ' ' A' ' 350' ' ' LEU . 5.8 tt -62.5 -47.03 85.76 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.197 -0.939 . . . . 0.46000000000000002 109.02 -179.936 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 351' ' ' LYS . . . . . . . . . . . . . 6.3 tttt -57.44 -43.36 83.83 Favored 'General case' 0 C--N 1.302 -1.489 0 O-C-N 121.329 -0.857 . . . . 1.3999999999999999 109.385 179.621 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 352' ' ' ASP . . . . . . . . . . . . . 23.1 m-20 -55.87 -40.1 72.46 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.275 -0.891 . . . . 1.1599999999999999 109.397 179.857 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 353' ' ' ALA . . . . . . . . . . . . . . . -69.01 -26.65 65.11 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.37 -0.831 . . . . 0.63 109.736 -179.901 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 354' ' ' GLN . . . . . . . . . . . . . 4.5 tt0 . . . . . 0 N--CA 1.495 1.782 0 O-C-N 121.116 -0.99 . . . . 1.47 109.877 -179.893 . . . . . . . . 0 0 . 1 . 030 nuclear build core ' B' B ' 326' ' ' GLU . . . . . . . . . . . . . 6.2 mt-10 . . . . . 0 N--CA 1.489 1.48 0 N-CA-C 109.282 -0.636 . . . . 2.1299999999999999 109.282 . . . . . . . . . 0 0 . 1 . 030 nuclear build core ' B' B ' 327' ' ' TYR . . . . . . . . . . . . . 41.3 m-85 -149.37 108.94 3.99 Favored 'General case' 0 C--N 1.303 -1.429 0 O-C-N 121.324 -0.86 . . . . 0.47999999999999998 109.684 -179.843 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' B' B ' 328' ' ' PHE . . . . . . . . . . . . . 18.9 m-85 -113.0 -166.96 1.13 Allowed 'General case' 0 C--N 1.302 -1.476 0 O-C-N 121.273 -0.892 . . . . 0.32000000000000001 109.366 179.964 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' B' B ' 329' ' ' THR . . . . . . . . . . . . . 16.5 p -153.9 169.2 24.01 Favored 'General case' 0 N--CA 1.488 1.463 0 O-C-N 121.351 -0.843 . . . . 0.23000000000000001 108.994 179.611 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' B' B ' 330' ' ' LEU . . . . . 0.4 ' O ' ' HA ' ' D' ' 329' ' ' THR . 18.1 tp -151.53 134.42 15.73 Favored 'General case' 0 N--CA 1.491 1.625 0 O-C-N 121.334 -0.854 . . . . 0.28000000000000003 109.673 179.796 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' B' B ' 331' ' ' GLN . . . . . . . . . . . . . 2.1 tp60 -86.94 114.58 23.69 Favored 'General case' 0 C--N 1.302 -1.47 0 O-C-N 121.416 -0.803 . . . . 0.91000000000000003 109.66 179.672 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' B' B ' 332' ' ' ILE . . . . . 0.877 HG21 ' HA ' ' B' ' 338' ' ' PHE . 58.0 mt -103.03 101.93 12.89 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.458 0 O-C-N 121.245 -0.909 . . . . 0.23999999999999999 109.181 179.751 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' B' B ' 333' ' ' ARG . . . . . . . . . . . . . 54.7 mtt180 -72.1 152.14 42.56 Favored 'General case' 0 N--CA 1.488 1.456 0 O-C-N 121.259 -0.901 . . . . 2.9300000000000002 109.613 -179.71 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' B' B ' 334' ' ' GLY . . . . . . . . . . . . . . . 77.51 130.42 0.49 Allowed Glycine 0 N--CA 1.491 2.33 0 N-CA-C 109.795 -1.322 . . . . 0.40000000000000002 109.795 179.735 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' B' B ' 335' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -74.22 -34.56 63.73 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.165 -1.197 . . . . 3.0099999999999998 109.759 179.9 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' B' B ' 336' ' ' GLU . . . . . . . . . . . . . 11.4 mt-10 -59.22 -58.28 9.34 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.199 -0.938 . . . . 2.2799999999999998 109.688 -179.697 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' B' B ' 337' ' ' ARG . . . . . . . . . . . . . 5.1 mmt180 -60.81 -36.13 78.28 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.441 -0.787 . . . . 2.9300000000000002 109.655 -179.674 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' B' B ' 338' ' ' PHE . . . . . 0.877 ' HA ' HG21 ' B' ' 332' ' ' ILE . 62.7 t80 -54.23 -60.07 3.83 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.233 -0.917 . . . . 0.37 109.435 179.884 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' B' B ' 339' ' ' GLU . . . . . . . . . . . . . 80.8 mt-10 -49.9 -36.56 27.91 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.262 -0.899 . . . . 1.98 110.379 -179.64 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' B' B ' 340' ' ' MET . . . . . . . . . . . . . 47.9 ttp -63.38 -50.32 70.35 Favored 'General case' 0 N--CA 1.494 1.76 0 O-C-N 121.088 -1.008 . . . . 0.32000000000000001 110.278 -179.387 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' B' B ' 341' ' ' PHE . . . . . . . . . . . . . 54.5 m-85 -62.24 -45.72 92.05 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.128 -0.983 . . . . 0.17999999999999999 109.998 -179.707 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' B' B ' 342' ' ' ARG . . . . . . . . . . . . . 13.0 ttp180 -47.59 -43.75 25.81 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.329 -0.857 . . . . 2.4199999999999999 109.849 -179.931 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' B' B ' 343' ' ' GLU . . . . . . . . . . . . . 30.6 tt0 -58.84 -48.91 79.67 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.417 -0.802 . . . . 2.3500000000000001 109.68 -179.578 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' B' B ' 344' ' ' LEU . . . . . 0.408 ' O ' ' HB3' ' B' ' 347' ' ' ALA . 52.9 mt -60.97 -29.96 69.97 Favored 'General case' 0 N--CA 1.489 1.486 0 O-C-N 121.021 -1.049 . . . . 0.17999999999999999 109.576 -179.538 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' B' B ' 345' ' ' ASN . . . . . . . . . . . . . 11.2 t-20 -58.13 -59.99 4.44 Favored 'General case' 0 N--CA 1.489 1.493 0 O-C-N 121.248 -0.908 . . . . 1.0900000000000001 109.702 179.875 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' B' B ' 346' ' ' GLU . . . . . . . . . . . . . 86.1 tt0 -60.16 -24.14 64.5 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.253 -0.904 . . . . 1.6599999999999999 109.382 -179.724 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' B' B ' 347' ' ' ALA . . . . . 0.6 ' HB1' ' HB1' ' A' ' 347' ' ' ALA . . . -62.18 -61.8 2.21 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.147 -0.97 . . . . 0.17000000000000001 109.967 -179.829 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' B' B ' 348' ' ' LEU . . . . . 0.62 HD22 ' N ' ' B' ' 348' ' ' LEU . 3.8 mm? -61.26 -45.77 93.14 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.325 -0.86 . . . . 0.28999999999999998 109.824 -179.722 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' B' B ' 349' ' ' GLU . . . . . . . . . . . . . 27.6 mm-40 -56.68 -33.49 66.47 Favored 'General case' 0 N--CA 1.494 1.762 0 O-C-N 121.399 -0.813 . . . . 1.95 109.832 -179.399 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' B' B ' 350' ' ' LEU . . . . . 0.591 HD23 ' O ' ' B' ' 350' ' ' LEU . 5.7 tt -63.53 -46.75 84.59 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.381 -0.824 . . . . 0.45000000000000001 108.847 -179.943 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' B' B ' 351' ' ' LYS . . . . . . . . . . . . . 5.7 tttt -57.62 -44.04 85.25 Favored 'General case' 0 C--N 1.302 -1.481 0 O-C-N 121.449 -0.782 . . . . 1.3799999999999999 109.022 179.584 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' B' B ' 352' ' ' ASP . . . . . . . . . . . . . 25.2 m-20 -55.3 -39.55 70.05 Favored 'General case' 0 N--CA 1.488 1.456 0 O-C-N 121.389 -0.82 . . . . 1.1599999999999999 109.502 179.82 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' B' B ' 353' ' ' ALA . . . . . . . . . . . . . . . -69.53 -26.45 64.53 Favored 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.454 -0.779 . . . . 0.60999999999999999 109.889 -179.898 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' B' B ' 354' ' ' GLN . . . . . 0.501 ' OE1' HD11 ' A' ' 350' ' ' LEU . 4.3 tt0 . . . . . 0 C--N 1.302 -1.479 0 O-C-N 120.954 -1.091 . . . . 1.45 109.798 -179.91 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' C' C ' 326' ' ' GLU . . . . . . . . . . . . . 2.9 mp0 . . . . . 0 N--CA 1.486 1.362 0 CA-C-O 121.326 0.584 . . . . 2.1699999999999999 109.433 . . . . . . . . . 0 0 . 1 . 030 nuclear build core ' C' C ' 327' ' ' TYR . . . . . . . . . . . . . 49.5 m-85 -150.75 114.19 4.89 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.062 -1.024 . . . . 0.47999999999999998 109.835 179.752 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' C' C ' 328' ' ' PHE . . . . . 0.458 ' O ' HG23 ' C' ' 329' ' ' THR . 79.5 m-85 -113.38 -167.81 1.25 Allowed 'General case' 0 N--CA 1.488 1.466 0 O-C-N 121.217 -0.927 . . . . 0.33000000000000002 109.491 179.542 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' C' C ' 329' ' ' THR . . . . . 0.458 HG23 ' O ' ' C' ' 328' ' ' PHE . 4.4 p -153.91 161.84 41.69 Favored 'General case' 0 C--N 1.301 -1.508 0 O-C-N 121.068 -1.02 . . . . 0.23000000000000001 109.536 -179.881 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' C' C ' 330' ' ' LEU . . . . . . . . . . . . . 15.0 tp -149.24 129.43 13.65 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.291 -0.881 . . . . 0.28000000000000003 109.671 -179.703 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' C' C ' 331' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -87.15 119.88 27.85 Favored 'General case' 0 N--CA 1.487 1.4 0 O-C-N 121.334 -0.854 . . . . 1.48 109.229 179.632 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' C' C ' 332' ' ' ILE . . . . . 0.719 HG21 ' HA ' ' C' ' 338' ' ' PHE . 14.1 mt -103.23 105.89 19.12 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.574 0 O-C-N 121.18 -0.95 . . . . 0.23999999999999999 109.299 179.915 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' C' C ' 333' ' ' ARG . . . . . 0.573 ' HG2' ' CE1' ' A' ' 327' ' ' TYR . 8.3 mtt180 -72.65 134.9 45.32 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.228 -0.92 . . . . 2.7400000000000002 109.155 179.624 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' C' C ' 334' ' ' GLY . . . . . . . . . . . . . . . 92.78 134.79 6.94 Favored Glycine 0 N--CA 1.489 2.176 0 N-CA-C 109.714 -1.354 . . . . 0.34999999999999998 109.714 179.959 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' C' C ' 335' ' ' ARG . . . . . 0.408 ' O ' ' HB3' ' C' ' 338' ' ' PHE . 6.7 tpt180 -80.33 -34.25 36.83 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.502 -0.999 . . . . 2.5299999999999998 109.319 179.922 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' C' C ' 336' ' ' GLU . . . . . . . . . . . . . 1.3 tt0 -57.96 -61.45 2.53 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.189 -0.945 . . . . 2.6200000000000001 109.69 -179.974 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' C' C ' 337' ' ' ARG . . . . . . . . . . . . . 3.0 mtt180 -59.19 -28.57 66.76 Favored 'General case' 0 N--CA 1.487 1.384 0 O-C-N 121.065 -1.022 . . . . 2.8100000000000001 109.553 -179.91 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' C' C ' 338' ' ' PHE . . . . . 0.719 ' HA ' HG21 ' C' ' 332' ' ' ILE . 48.4 t80 -55.21 -62.4 1.69 Allowed 'General case' 0 N--CA 1.487 1.389 0 O-C-N 121.275 -0.891 . . . . 0.40000000000000002 109.61 179.887 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' C' C ' 339' ' ' GLU . . . . . . . . . . . . . 1.3 mm-40 -49.79 -31.44 11.63 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 120.994 -1.066 . . . . 2.0499999999999998 109.662 -179.819 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' C' C ' 340' ' ' MET . . . . . . . . . . . . . 24.2 ttp -63.27 -57.38 10.62 Favored 'General case' 0 N--CA 1.488 1.462 0 O-C-N 121.271 -0.893 . . . . 0.32000000000000001 110.35 -179.429 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' C' C ' 341' ' ' PHE . . . . . 0.444 ' HB2' ' CD1' ' C' ' 332' ' ' ILE . 51.7 m-85 -61.57 -47.87 83.54 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.004 -1.06 . . . . 0.17999999999999999 109.715 -179.575 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' C' C ' 342' ' ' ARG . . . . . 0.439 HH11 ' CG ' ' C' ' 342' ' ' ARG . 0.0 OUTLIER -47.15 -40.93 16.76 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.556 -0.715 . . . . 2.9100000000000001 109.947 -179.983 . . . . . . . . 3 3 . 1 . 030 nuclear build core ' C' C ' 343' ' ' GLU . . . . . 0.442 ' HA ' ' OE1' ' C' ' 343' ' ' GLU . 4.6 tp10 -60.1 -48.73 80.51 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.236 -0.915 . . . . 2.1400000000000001 109.611 -179.951 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' C' C ' 344' ' ' LEU . . . . . . . . . . . . . 28.7 mt -62.18 -31.1 71.57 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.324 -0.86 . . . . 0.22 109.47 -179.899 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' C' C ' 345' ' ' ASN . . . . . . . . . . . . . 8.8 t-20 -57.57 -50.53 72.79 Favored 'General case' 0 C--N 1.301 -1.529 0 O-C-N 121.16 -0.962 . . . . 1.0800000000000001 109.258 -179.928 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' C' C ' 346' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -63.9 -33.43 75.69 Favored 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.247 -0.908 . . . . 2.21 109.85 -179.849 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' C' C ' 347' ' ' ALA . . . . . 0.422 ' HB1' ' HB1' ' D' ' 347' ' ' ALA . . . -61.26 -60.1 4.27 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.225 -0.922 . . . . 0.17999999999999999 110.285 -179.459 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' C' C ' 348' ' ' LEU . . . . . 0.543 ' N ' HD22 ' C' ' 348' ' ' LEU . 3.8 mm? -59.0 -44.45 91.67 Favored 'General case' 0 N--CA 1.488 1.472 0 O-C-N 121.154 -0.966 . . . . 0.32000000000000001 109.814 -179.025 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' C' C ' 349' ' ' GLU . . . . . . . . . . . . . 20.2 mt-10 -58.61 -34.4 71.1 Favored 'General case' 0 N--CA 1.489 1.525 0 O-C-N 121.094 -1.004 . . . . 2.1899999999999999 109.735 -179.751 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' C' C ' 350' ' ' LEU . . . . . 0.74 ' CD2' HD13 ' D' ' 350' ' ' LEU . 4.9 tt -64.07 -46.78 82.79 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.304 -0.872 . . . . 0.46000000000000002 109.459 -179.713 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' C' C ' 351' ' ' LYS . . . . . 0.539 ' N ' HD23 ' C' ' 350' ' ' LEU . 3.5 tttt -61.16 -44.02 97.97 Favored 'General case' 0 C--N 1.301 -1.531 0 O-C-N 121.408 -0.807 . . . . 1.3500000000000001 109.587 -179.79 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' C' C ' 352' ' ' ASP . . . . . . . . . . . . . 56.2 m-20 -55.76 -47.0 77.75 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.353 -0.842 . . . . 1.1899999999999999 109.951 -179.696 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' C' C ' 353' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 1.667 0 O-C-N 121.309 -0.869 . . . . 0.56999999999999995 109.709 -179.578 . . . . . . . . 0 0 . 1 . 030 nuclear build core ' D' D ' 326' ' ' GLU . . . . . . . . . . . . . 5.7 mt-10 . . . . . 0 N--CA 1.489 1.501 0 N-CA-C 109.496 -0.557 . . . . 2.1299999999999999 109.496 . . . . . . . . . 0 0 . 1 . 030 nuclear build core ' D' D ' 327' ' ' TYR . . . . . . . . . . . . . 41.3 m-85 -148.35 109.13 4.22 Favored 'General case' 0 C--N 1.302 -1.484 0 O-C-N 121.072 -1.018 . . . . 0.46999999999999997 109.407 179.949 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' D' D ' 328' ' ' PHE . . . . . . . . . . . . . 18.6 m-85 -113.9 -167.88 1.27 Allowed 'General case' 0 N--CA 1.489 1.49 0 O-C-N 121.158 -0.964 . . . . 0.29999999999999999 109.125 -179.802 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' D' D ' 329' ' ' THR . . . . . 0.4 ' HA ' ' O ' ' B' ' 330' ' ' LEU . 15.2 p -153.58 169.35 23.44 Favored 'General case' 0 C--N 1.302 -1.49 0 O-C-N 121.373 -0.829 . . . . 0.22 108.855 -179.902 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' D' D ' 330' ' ' LEU . . . . . . . . . . . . . 20.7 tp -151.78 134.48 15.54 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.44 -0.788 . . . . 0.28000000000000003 109.686 -179.909 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' D' D ' 331' ' ' GLN . . . . . . . . . . . . . 3.3 tp60 -87.19 114.54 23.89 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.526 -0.733 . . . . 0.93000000000000005 109.583 179.714 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' D' D ' 332' ' ' ILE . . . . . 0.844 HG21 ' HA ' ' D' ' 338' ' ' PHE . 57.8 mt -103.25 101.68 12.54 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.475 0 O-C-N 121.348 -0.845 . . . . 0.25 109.079 179.85 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' D' D ' 333' ' ' ARG . . . . . . . . . . . . . 47.0 mtt180 -72.17 153.42 41.64 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.322 -0.861 . . . . 2.9300000000000002 109.733 -179.72 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' D' D ' 334' ' ' GLY . . . . . . . . . . . . . . . 76.38 131.33 0.4 Allowed Glycine 0 N--CA 1.492 2.378 0 N-CA-C 109.588 -1.405 . . . . 0.40999999999999998 109.588 179.672 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' D' D ' 335' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -75.31 -35.15 61.29 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.222 -1.164 . . . . 3.0299999999999998 109.762 179.994 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' D' D ' 336' ' ' GLU . . . . . . . . . . . . . 9.7 mt-10 -58.46 -58.01 10.42 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.131 -0.981 . . . . 2.2599999999999998 109.716 -179.937 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' D' D ' 337' ' ' ARG . . . . . . . . . . . . . 5.9 mmt180 -60.81 -35.46 76.57 Favored 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.099 -1.001 . . . . 2.9199999999999999 109.865 179.927 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' D' D ' 338' ' ' PHE . . . . . 0.844 ' HA ' HG21 ' D' ' 332' ' ' ILE . 65.6 t80 -54.99 -59.47 4.7 Favored 'General case' 0 N--CA 1.487 1.376 0 O-C-N 121.082 -1.011 . . . . 0.37 109.364 179.998 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' D' D ' 339' ' ' GLU . . . . . . . . . . . . . 78.1 mt-10 -50.09 -36.5 29.7 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.592 -0.693 . . . . 1.99 110.485 -179.43 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' D' D ' 340' ' ' MET . . . . . . . . . . . . . 43.5 ttp -64.39 -50.49 67.45 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.078 -1.014 . . . . 0.31 110.278 -179.266 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' D' D ' 341' ' ' PHE . . . . . . . . . . . . . 53.9 m-85 -61.81 -45.53 93.43 Favored 'General case' 0 C--N 1.298 -1.631 0 O-C-N 120.925 -1.109 . . . . 0.17999999999999999 110.249 -179.408 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' D' D ' 342' ' ' ARG . . . . . . . . . . . . . 11.6 ttp180 -48.12 -43.91 31.48 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.157 -0.964 . . . . 2.4100000000000001 109.896 -179.656 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' D' D ' 343' ' ' GLU . . . . . . . . . . . . . 27.7 tt0 -58.24 -48.26 80.95 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.246 -0.909 . . . . 2.3500000000000001 109.7 -179.539 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' D' D ' 344' ' ' LEU . . . . . . . . . . . . . 46.4 mt -61.47 -30.31 70.52 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.074 -1.016 . . . . 0.19 109.551 -179.872 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' D' D ' 345' ' ' ASN . . . . . . . . . . . . . 12.6 t-20 -57.82 -59.11 5.73 Favored 'General case' 0 C--N 1.305 -1.367 0 O-C-N 121.148 -0.97 . . . . 1.0900000000000001 109.587 -179.931 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' D' D ' 346' ' ' GLU . . . . . . . . . . . . . 83.4 tt0 -60.52 -25.22 65.95 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.327 -0.858 . . . . 1.6899999999999999 109.692 -179.755 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' D' D ' 347' ' ' ALA . . . . . 0.422 ' HB1' ' HB1' ' C' ' 347' ' ' ALA . . . -61.71 -60.89 2.99 Favored 'General case' 0 C--N 1.301 -1.515 0 O-C-N 121.171 -0.956 . . . . 0.17999999999999999 109.773 -179.77 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' D' D ' 348' ' ' LEU . . . . . 0.627 HD22 ' N ' ' D' ' 348' ' ' LEU . 3.8 mm? -61.84 -46.33 89.92 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.35 -0.843 . . . . 0.31 109.716 -179.239 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' D' D ' 349' ' ' GLU . . . . . . . . . . . . . 21.1 mm-40 -56.85 -31.67 65.03 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.374 -0.829 . . . . 1.95 109.904 -179.516 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' D' D ' 350' ' ' LEU . . . . . 0.74 HD13 ' CD2' ' C' ' 350' ' ' LEU . 5.8 tt -64.75 -47.12 79.37 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.466 -0.771 . . . . 0.42999999999999999 108.957 179.787 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' D' D ' 351' ' ' LYS . . . . . . . . . . . . . 6.1 tttt -57.71 -43.67 85.36 Favored 'General case' 0 N--CA 1.489 1.513 0 N-CA-C 109.047 -0.723 . . . . 1.3999999999999999 109.047 179.755 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' D' D ' 352' ' ' ASP . . . . . . . . . . . . . 15.7 m-20 -55.05 -39.87 69.66 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.362 -0.836 . . . . 1.1699999999999999 109.603 179.904 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' D' D ' 353' ' ' ALA . . . . . . . . . . . . . . . -69.0 -27.12 65.41 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.465 -0.772 . . . . 0.58999999999999997 109.848 -179.927 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' D' D ' 354' ' ' GLN . . . . . . . . . . . . . 4.2 tt0 . . . . . 0 N--CA 1.488 1.468 0 O-C-N 120.946 -1.096 . . . . 1.4399999999999999 109.997 -179.636 . . . . . . . . 0 0 . 1 . 031 nuclear build core ' A' A ' 326' ' ' GLU . . . . . . . . . . . . . 2.6 mt-10 . . . . . 0 N--CA 1.488 1.47 0 N-CA-C 109.042 -0.725 . . . . 2.1299999999999999 109.042 . . . . . . . . . 0 0 . 1 . 031 nuclear build core ' A' A ' 327' ' ' TYR . . . . . 0.483 ' CE1' ' HG2' ' C' ' 333' ' ' ARG . 33.6 m-85 -148.5 112.42 5.14 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.212 -0.93 . . . . 0.47999999999999998 109.722 179.901 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 328' ' ' PHE . . . . . 0.405 ' O ' HG23 ' A' ' 329' ' ' THR . 85.1 m-85 -114.78 -168.12 1.33 Allowed 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.452 -0.78 . . . . 0.31 109.45 179.972 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 329' ' ' THR . . . . . 0.405 HG23 ' O ' ' A' ' 328' ' ' PHE . 37.0 p -154.18 157.93 39.56 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.206 -0.934 . . . . 0.22 109.315 -179.971 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 330' ' ' LEU . . . . . . . . . . . . . 21.9 tp -150.73 128.81 11.85 Favored 'General case' 0 N--CA 1.488 1.465 0 O-C-N 121.213 -0.929 . . . . 0.28000000000000003 109.888 -179.546 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 331' ' ' GLN . . . . . . . . . . . . . 1.3 tt0 -86.92 117.06 25.4 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.242 -0.911 . . . . 0.91000000000000003 109.095 179.673 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 332' ' ' ILE . . . . . 0.585 HG21 ' HA ' ' A' ' 338' ' ' PHE . 96.2 mt -103.43 106.49 20.24 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.565 0 O-C-N 121.114 -0.991 . . . . 0.26000000000000001 109.96 -179.576 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 333' ' ' ARG . . . . . 0.598 ' HG2' ' CE1' ' C' ' 327' ' ' TYR . 1.6 mtp180 -73.15 154.21 40.42 Favored 'General case' 0 C--N 1.303 -1.439 0 O-C-N 121.466 -0.771 . . . . 2.9199999999999999 109.429 179.781 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 334' ' ' GLY . . . . . . . . . . . . . . . 79.62 129.67 0.73 Allowed Glycine 0 N--CA 1.492 2.397 0 N-CA-C 109.882 -1.287 . . . . 0.40000000000000002 109.882 179.621 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 335' ' ' ARG . . . . . 0.529 ' NH1' ' HG2' ' A' ' 335' ' ' ARG . 21.6 ttt-85 -79.8 -38.24 33.46 Favored 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.355 -1.085 . . . . 3.0099999999999998 109.229 179.627 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 336' ' ' GLU . . . . . . . . . . . . . 21.4 mt-10 -58.69 -59.14 5.88 Favored 'General case' 0 N--CA 1.488 1.436 0 O-C-N 121.399 -0.813 . . . . 2.29 109.59 -179.996 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 337' ' ' ARG . . . . . . . . . . . . . 2.5 mmt180 -60.17 -30.62 69.46 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.292 -0.88 . . . . 2.9300000000000002 109.3 -179.981 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 338' ' ' PHE . . . . . 0.585 ' HA ' HG21 ' A' ' 332' ' ' ILE . 64.3 t80 -55.48 -58.1 9.14 Favored 'General case' 0 N--CA 1.488 1.474 0 O-C-N 121.171 -0.955 . . . . 0.38 109.278 179.826 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 339' ' ' GLU . . . . . . . . . . . . . 7.2 mt-10 -51.92 -30.95 26.58 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.139 -0.975 . . . . 1.97 109.99 -179.847 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 340' ' ' MET . . . . . . . . . . . . . 16.0 ttp -64.67 -54.4 32.34 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.166 -0.959 . . . . 0.31 109.885 -179.6 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 341' ' ' PHE . . . . . . . . . . . . . 35.7 m-85 -62.61 -52.77 62.08 Favored 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.3 -0.875 . . . . 0.17999999999999999 110.024 -179.6 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 342' ' ' ARG . . . . . . . . . . . . . 12.9 ttp180 -47.93 -41.17 24.07 Favored 'General case' 0 N--CA 1.489 1.481 0 O-C-N 121.234 -0.916 . . . . 2.4199999999999999 109.946 -179.576 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 343' ' ' GLU . . . . . . . . . . . . . 42.9 tt0 -59.17 -45.11 91.86 Favored 'General case' 0 N--CA 1.494 1.74 0 O-C-N 121.156 -0.965 . . . . 2.3500000000000001 109.741 -179.859 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 344' ' ' LEU . . . . . 0.611 HD22 HD22 ' B' ' 344' ' ' LEU . 39.8 mt -62.81 -41.63 99.37 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.118 -0.989 . . . . 0.17999999999999999 109.781 -179.864 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 345' ' ' ASN . . . . . 0.541 HD22 HD11 ' C' ' 330' ' ' LEU . 33.2 t-20 -56.16 -45.46 79.67 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.113 -0.992 . . . . 1.0900000000000001 109.464 -179.826 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 346' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -60.88 -36.08 78.28 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.255 -0.903 . . . . 1.6499999999999999 109.746 -179.949 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 347' ' ' ALA . . . . . 0.992 ' HB1' ' HB1' ' B' ' 347' ' ' ALA . . . -60.54 -52.32 65.7 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.164 -0.96 . . . . 0.17999999999999999 110.27 -179.646 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 348' ' ' LEU . . . . . 0.59 HD22 ' N ' ' A' ' 348' ' ' LEU . 3.9 mm? -60.78 -49.74 76.28 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.196 -0.94 . . . . 0.29999999999999999 109.888 -179.403 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 349' ' ' GLU . . . . . . . . . . . . . 53.3 mt-10 -57.49 -31.08 65.65 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.233 -0.917 . . . . 1.9399999999999999 110.038 -179.332 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 350' ' ' LEU . . . . . 0.76 HD23 ' O ' ' A' ' 350' ' ' LEU . 4.7 tt -63.81 -41.28 97.92 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.075 -1.016 . . . . 0.46000000000000002 109.054 179.92 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 351' ' ' LYS . . . . . . . . . . . . . 6.3 tttt -59.65 -44.94 93.34 Favored 'General case' 0 C--N 1.302 -1.497 0 O-C-N 121.342 -0.849 . . . . 1.3999999999999999 109.647 179.94 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 352' ' ' ASP . . . . . . . . . . . . . 63.8 m-20 -54.48 -43.33 71.65 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.162 -0.962 . . . . 1.1599999999999999 109.623 -179.917 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 353' ' ' ALA . . . . . . . . . . . . . . . -67.61 -28.91 68.15 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.194 -0.941 . . . . 0.63 109.599 -179.687 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 354' ' ' GLN . . . . . 0.533 ' OE1' HD11 ' B' ' 350' ' ' LEU . 3.8 mt-30 . . . . . 0 N--CA 1.491 1.611 0 O-C-N 121.211 -0.93 . . . . 1.47 109.378 179.853 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' B' B ' 326' ' ' GLU . . . . . . . . . . . . . 2.6 mt-10 . . . . . 0 N--CA 1.488 1.471 0 N-CA-C 109.314 -0.624 . . . . 2.1299999999999999 109.314 . . . . . . . . . 0 0 . 1 . 031 nuclear build core ' B' B ' 327' ' ' TYR . . . . . 0.627 ' CE1' ' HG2' ' D' ' 333' ' ' ARG . 35.9 m-85 -148.57 112.44 5.13 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.42 -0.8 . . . . 0.47999999999999998 109.671 179.74 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' B' B ' 328' ' ' PHE . . . . . 0.487 ' CE2' ' HA ' ' D' ' 335' ' ' ARG . 85.4 m-85 -114.94 -168.88 1.45 Allowed 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.429 -0.794 . . . . 0.32000000000000001 109.287 179.756 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' B' B ' 329' ' ' THR . . . . . . . . . . . . . 37.9 p -153.53 158.53 41.41 Favored 'General case' 0 N--CA 1.489 1.495 0 O-C-N 121.243 -0.911 . . . . 0.23000000000000001 109.262 179.989 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' B' B ' 330' ' ' LEU . . . . . . . . . . . . . 20.5 tp -151.11 129.61 12.16 Favored 'General case' 0 C--N 1.303 -1.429 0 O-C-N 121.275 -0.891 . . . . 0.28000000000000003 109.628 -179.758 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' B' B ' 331' ' ' GLN . . . . . . . . . . . . . 1.4 tt0 -87.42 117.73 26.39 Favored 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.289 -0.882 . . . . 0.91000000000000003 108.863 179.475 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' B' B ' 332' ' ' ILE . . . . . 0.561 HG21 ' HA ' ' B' ' 338' ' ' PHE . 95.4 mt -103.97 106.71 20.77 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.597 0 O-C-N 121.178 -0.951 . . . . 0.23999999999999999 110.048 -179.724 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' B' B ' 333' ' ' ARG . . . . . 0.541 ' HG2' ' CE1' ' D' ' 327' ' ' TYR . 1.7 mtp180 -73.38 154.84 39.88 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.268 -0.895 . . . . 2.9300000000000002 109.536 179.751 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' B' B ' 334' ' ' GLY . . . . . . . . . . . . . . . 77.99 128.63 0.46 Allowed Glycine 0 N--CA 1.491 2.303 0 N-CA-C 109.987 -1.245 . . . . 0.40000000000000002 109.987 179.82 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' B' B ' 335' ' ' ARG . . . . . 0.538 ' NH1' ' HG2' ' B' ' 335' ' ' ARG . 23.1 ttt-85 -78.77 -38.72 37.88 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.285 -1.127 . . . . 3.0099999999999998 109.293 179.787 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' B' B ' 336' ' ' GLU . . . . . . . . . . . . . 22.1 mt-10 -57.73 -59.1 5.72 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.317 -0.864 . . . . 2.2799999999999998 109.563 179.935 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' B' B ' 337' ' ' ARG . . . . . . . . . . . . . 2.5 mmt180 -60.54 -30.43 69.76 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.207 -0.933 . . . . 2.9300000000000002 109.34 -179.886 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' B' B ' 338' ' ' PHE . . . . . 0.561 ' HA ' HG21 ' B' ' 332' ' ' ILE . 65.8 t80 -55.52 -57.73 10.71 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.332 -0.855 . . . . 0.37 109.379 179.723 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' B' B ' 339' ' ' GLU . . . . . . . . . . . . . 7.9 mt-10 -52.38 -31.06 32.05 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.218 -0.926 . . . . 1.98 109.755 -179.848 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' B' B ' 340' ' ' MET . . . . . . . . . . . . . 17.5 ttp -64.3 -54.54 31.63 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.246 -0.909 . . . . 0.32000000000000001 109.88 -179.5 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' B' B ' 341' ' ' PHE . . . . . . . . . . . . . 36.4 m-85 -62.73 -53.34 55.92 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.389 -0.819 . . . . 0.17999999999999999 109.857 -179.579 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' B' B ' 342' ' ' ARG . . . . . . . . . . . . . 13.6 ttp180 -47.2 -41.37 18.04 Favored 'General case' 0 C--N 1.301 -1.511 0 O-C-N 121.274 -0.891 . . . . 2.4199999999999999 109.99 -179.6 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' B' B ' 343' ' ' GLU . . . . . . . . . . . . . 41.0 tt0 -58.77 -45.61 89.37 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.013 -1.054 . . . . 2.3500000000000001 109.704 -179.719 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' B' B ' 344' ' ' LEU . . . . . 0.611 HD22 HD22 ' A' ' 344' ' ' LEU . 41.1 mt -62.8 -40.93 98.86 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.237 -0.914 . . . . 0.17999999999999999 110.078 -179.586 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' B' B ' 345' ' ' ASN . . . . . . . . . . . . . 33.9 t-20 -56.84 -44.99 82.64 Favored 'General case' 0 C--N 1.301 -1.522 0 O-C-N 121.242 -0.911 . . . . 1.0900000000000001 109.449 -179.877 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' B' B ' 346' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -61.36 -35.43 77.43 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.191 -0.943 . . . . 1.6599999999999999 109.73 -179.924 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' B' B ' 347' ' ' ALA . . . . . 0.992 ' HB1' ' HB1' ' A' ' 347' ' ' ALA . . . -61.3 -51.98 66.6 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.24 -0.913 . . . . 0.17000000000000001 110.078 -179.48 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' B' B ' 348' ' ' LEU . . . . . 0.604 HD22 ' N ' ' B' ' 348' ' ' LEU . 3.9 mm? -61.0 -49.62 76.69 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.085 -1.009 . . . . 0.28999999999999998 109.933 -179.494 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' B' B ' 349' ' ' GLU . . . . . . . . . . . . . 53.7 mt-10 -57.7 -31.61 66.56 Favored 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.243 -0.91 . . . . 1.95 109.897 -179.335 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' B' B ' 350' ' ' LEU . . . . . 0.765 HD23 ' O ' ' B' ' 350' ' ' LEU . 4.7 tt -62.98 -41.88 99.68 Favored 'General case' 0 N--CA 1.488 1.474 0 O-C-N 120.981 -1.074 . . . . 0.45000000000000001 109.108 179.857 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' B' B ' 351' ' ' LYS . . . . . . . . . . . . . 6.3 tttt -59.0 -44.67 91.7 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.311 -0.868 . . . . 1.3799999999999999 109.715 179.908 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' B' B ' 352' ' ' ASP . . . . . . . . . . . . . 65.4 m-20 -54.74 -43.59 72.82 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.195 -0.941 . . . . 1.1599999999999999 109.776 -179.695 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' B' B ' 353' ' ' ALA . . . . . . . . . . . . . . . -67.49 -28.86 68.19 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.216 -0.927 . . . . 0.60999999999999999 109.366 -179.955 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' B' B ' 354' ' ' GLN . . . . . 0.599 ' OE1' HD11 ' A' ' 350' ' ' LEU . 3.7 mt-30 . . . . . 0 N--CA 1.49 1.536 0 O-C-N 121.287 -0.883 . . . . 1.45 109.661 179.862 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' C' C ' 326' ' ' GLU . . . . . . . . . . . . . 1.9 mm-40 . . . . . 0 N--CA 1.49 1.561 0 CA-C-O 121.407 0.622 . . . . 2.1699999999999999 109.432 . . . . . . . . . 0 0 . 1 . 031 nuclear build core ' C' C ' 327' ' ' TYR . . . . . 0.598 ' CE1' ' HG2' ' A' ' 333' ' ' ARG . 32.7 m-85 -148.2 101.34 3.26 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.193 -0.942 . . . . 0.47999999999999998 109.629 179.864 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' C' C ' 328' ' ' PHE . . . . . 0.432 ' O ' HG23 ' C' ' 329' ' ' THR . 92.8 m-85 -108.17 -164.37 0.95 Allowed 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.258 -0.901 . . . . 0.33000000000000002 109.414 179.878 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' C' C ' 329' ' ' THR . . . . . 0.432 HG23 ' O ' ' C' ' 328' ' ' PHE . 3.0 p -154.19 157.5 38.92 Favored 'General case' 0 C--N 1.303 -1.426 0 O-C-N 121.405 -0.809 . . . . 0.23000000000000001 109.039 -179.968 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' C' C ' 330' ' ' LEU . . . . . 0.541 HD11 HD22 ' A' ' 345' ' ' ASN . 19.8 tp -148.38 127.27 12.68 Favored 'General case' 0 N--CA 1.489 1.48 0 O-C-N 121.234 -0.916 . . . . 0.28000000000000003 109.687 -179.735 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' C' C ' 331' ' ' GLN . . . . . . . . . . . . . 1.1 tt0 -86.82 120.06 27.7 Favored 'General case' 0 N--CA 1.487 1.41 0 N-CA-C 108.587 -0.894 . . . . 1.48 108.587 179.286 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' C' C ' 332' ' ' ILE . . . . . 0.668 HG21 ' HA ' ' C' ' 338' ' ' PHE . 15.0 mt -102.84 103.11 14.58 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.588 0 O-C-N 121.178 -0.951 . . . . 0.23999999999999999 109.845 -179.405 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' C' C ' 333' ' ' ARG . . . . . 0.483 ' HG2' ' CE1' ' A' ' 327' ' ' TYR . 1.6 mtt-85 -73.49 126.25 29.79 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.44 -0.787 . . . . 2.7400000000000002 109.47 179.812 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' C' C ' 334' ' ' GLY . . . . . . . . . . . . . . . 104.68 125.76 5.65 Favored Glycine 0 N--CA 1.49 2.243 0 N-CA-C 109.473 -1.451 . . . . 0.34999999999999998 109.473 -179.889 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' C' C ' 335' ' ' ARG . . . . . 0.469 ' O ' ' HB3' ' C' ' 338' ' ' PHE . 2.6 ttm180 -78.65 -36.21 44.21 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.305 -1.115 . . . . 2.5299999999999998 109.612 -179.69 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' C' C ' 336' ' ' GLU . . . . . . . . . . . . . 3.0 mm-40 -58.57 -63.31 1.33 Allowed 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.182 -0.949 . . . . 2.6200000000000001 109.598 -179.802 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' C' C ' 337' ' ' ARG . . . . . . . . . . . . . 14.9 mmt180 -59.12 -27.79 65.93 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.265 -0.897 . . . . 2.8100000000000001 109.615 -179.995 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' C' C ' 338' ' ' PHE . . . . . 0.668 ' HA ' HG21 ' C' ' 332' ' ' ILE . 59.8 t80 -55.34 -58.28 8.39 Favored 'General case' 0 N--CA 1.489 1.489 0 O-C-N 121.25 -0.906 . . . . 0.40000000000000002 109.731 179.969 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' C' C ' 339' ' ' GLU . . . . . . . . . . . . . 17.9 mt-10 -50.52 -32.95 19.76 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.097 -1.002 . . . . 2.0499999999999998 110.087 -179.544 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' C' C ' 340' ' ' MET . . . . . . . . . . . . . 35.0 ttp -64.19 -55.27 22.89 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.13 -0.981 . . . . 0.32000000000000001 110.116 -179.496 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' C' C ' 341' ' ' PHE . . . . . . . . . . . . . 49.6 m-85 -60.93 -53.64 54.79 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.126 -0.984 . . . . 0.17999999999999999 109.999 -179.486 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' C' C ' 342' ' ' ARG . . . . . . . . . . . . . 16.6 ttt180 -46.98 -38.47 10.76 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.088 -1.008 . . . . 2.9100000000000001 109.805 -179.581 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' C' C ' 343' ' ' GLU . . . . . . . . . . . . . 31.4 tt0 -60.18 -47.35 86.3 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.165 -0.96 . . . . 2.1400000000000001 109.848 -179.858 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' C' C ' 344' ' ' LEU . . . . . 0.478 HD22 HD22 ' D' ' 344' ' ' LEU . 36.0 mt -62.55 -35.48 79.6 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.146 -0.971 . . . . 0.22 109.925 -179.507 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' C' C ' 345' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -56.37 -48.83 76.03 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.062 -1.024 . . . . 1.0800000000000001 109.371 -179.991 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' C' C ' 346' ' ' GLU . . . . . . . . . . . . . 2.1 tp10 -62.47 -32.76 73.7 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.253 -0.904 . . . . 2.21 109.734 179.945 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' C' C ' 347' ' ' ALA . . . . . 0.977 ' HB1' ' HB1' ' D' ' 347' ' ' ALA . . . -62.11 -55.96 23.62 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.205 -0.935 . . . . 0.17999999999999999 110.083 -179.718 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' C' C ' 348' ' ' LEU . . . . . 0.59 ' N ' HD22 ' C' ' 348' ' ' LEU . 3.9 mm? -60.97 -49.56 76.94 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.218 -0.926 . . . . 0.32000000000000001 109.832 -179.403 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' C' C ' 349' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -56.43 -33.47 65.87 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.127 -0.983 . . . . 2.1899999999999999 109.373 -179.704 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' C' C ' 350' ' ' LEU . . . . . 1.009 HD22 HD13 ' D' ' 350' ' ' LEU . 6.4 tt -62.53 -43.35 99.03 Favored 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.337 -0.852 . . . . 0.46000000000000002 109.092 179.759 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' C' C ' 351' ' ' LYS . . . . . . . . . . . . . 36.3 tttt -58.15 -41.84 84.64 Favored 'General case' 0 C--N 1.301 -1.514 0 O-C-N 121.377 -0.827 . . . . 1.3500000000000001 109.045 179.742 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' C' C ' 352' ' ' ASP . . . . . . . . . . . . . 50.5 m-20 -56.39 -49.2 75.16 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.241 -0.912 . . . . 1.1899999999999999 109.455 179.668 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' C' C ' 353' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 1.628 0 O-C-N 121.434 -0.791 . . . . 0.56999999999999995 109.303 179.943 . . . . . . . . 0 0 . 1 . 031 nuclear build core ' D' D ' 326' ' ' GLU . . . . . . . . . . . . . 2.6 mt-10 . . . . . 0 N--CA 1.488 1.468 0 N-CA-C 109.074 -0.713 . . . . 2.1299999999999999 109.074 . . . . . . . . . 0 0 . 1 . 031 nuclear build core ' D' D ' 327' ' ' TYR . . . . . 0.541 ' CE1' ' HG2' ' B' ' 333' ' ' ARG . 34.8 m-85 -148.65 111.58 4.85 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.199 -0.938 . . . . 0.46999999999999997 109.814 179.866 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' D' D ' 328' ' ' PHE . . . . . . . . . . . . . 85.6 m-85 -113.88 -168.4 1.34 Allowed 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.394 -0.816 . . . . 0.29999999999999999 109.372 179.796 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' D' D ' 329' ' ' THR . . . . . . . . . . . . . 35.5 p -153.9 157.79 39.76 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.169 -0.957 . . . . 0.22 109.132 -179.771 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' D' D ' 330' ' ' LEU . . . . . . . . . . . . . 18.3 tp -150.81 129.44 12.27 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.216 -0.928 . . . . 0.28000000000000003 109.864 -179.767 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' D' D ' 331' ' ' GLN . . . . . . . . . . . . . 1.7 tt0 -87.43 116.63 25.67 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.218 -0.926 . . . . 0.93000000000000005 109.27 179.702 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' D' D ' 332' ' ' ILE . . . . . 0.584 HG21 ' HA ' ' D' ' 338' ' ' PHE . 95.0 mt -102.85 106.2 19.59 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.528 0 O-C-N 121.25 -0.906 . . . . 0.25 110.132 -179.572 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' D' D ' 333' ' ' ARG . . . . . 0.627 ' HG2' ' CE1' ' B' ' 327' ' ' TYR . 1.8 mtp180 -72.95 155.25 40.05 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.375 -0.828 . . . . 2.9300000000000002 109.553 179.614 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' D' D ' 334' ' ' GLY . . . . . . . . . . . . . . . 78.09 128.91 0.48 Allowed Glycine 0 N--CA 1.491 2.337 0 N-CA-C 109.847 -1.301 . . . . 0.40999999999999998 109.847 179.643 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' D' D ' 335' ' ' ARG . . . . . 0.521 ' NH1' ' HG2' ' D' ' 335' ' ' ARG . 22.0 ttt-85 -79.68 -37.72 35.17 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.246 -1.149 . . . . 3.0299999999999998 109.235 179.734 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' D' D ' 336' ' ' GLU . . . . . . . . . . . . . 23.6 mt-10 -58.49 -59.54 5.21 Favored 'General case' 0 C--N 1.304 -1.383 0 O-C-N 121.261 -0.899 . . . . 2.2599999999999998 109.483 179.922 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' D' D ' 337' ' ' ARG . . . . . . . . . . . . . 2.0 mmt180 -60.02 -30.18 68.99 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.313 -0.867 . . . . 2.9199999999999999 109.438 -179.947 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' D' D ' 338' ' ' PHE . . . . . 0.584 ' HA ' HG21 ' D' ' 332' ' ' ILE . 65.6 t80 -55.37 -58.37 8.01 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.278 -0.889 . . . . 0.37 109.376 179.855 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' D' D ' 339' ' ' GLU . . . . . . . . . . . . . 8.0 mt-10 -51.9 -31.2 27.32 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.27 -0.894 . . . . 1.99 109.7 -179.939 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' D' D ' 340' ' ' MET . . . . . . . . . . . . . 17.6 ttp -64.21 -54.27 36.12 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.019 -1.051 . . . . 0.31 109.915 -179.627 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' D' D ' 341' ' ' PHE . . . . . . . . . . . . . 36.3 m-85 -62.72 -53.19 58.16 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.222 -0.924 . . . . 0.17999999999999999 109.984 -179.539 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' D' D ' 342' ' ' ARG . . . . . . . . . . . . . 13.6 ttp180 -47.86 -40.29 21.07 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.357 -0.84 . . . . 2.4100000000000001 109.943 -179.593 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' D' D ' 343' ' ' GLU . . . . . . . . . . . . . 40.2 tt0 -59.67 -45.4 92.17 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.042 -1.037 . . . . 2.3500000000000001 109.723 -179.699 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' D' D ' 344' ' ' LEU . . . . . 0.478 HD22 HD22 ' C' ' 344' ' ' LEU . 41.9 mt -63.0 -40.76 98.74 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.27 -0.894 . . . . 0.19 109.998 -179.678 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' D' D ' 345' ' ' ASN . . . . . . . . . . . . . 33.5 t-20 -56.7 -44.93 82.03 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.34 -0.85 . . . . 1.0900000000000001 109.454 -179.699 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' D' D ' 346' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -61.72 -35.86 79.26 Favored 'General case' 0 C--N 1.303 -1.447 0 O-C-N 121.476 -0.765 . . . . 1.6899999999999999 109.746 -179.809 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' D' D ' 347' ' ' ALA . . . . . 0.977 ' HB1' ' HB1' ' C' ' 347' ' ' ALA . . . -60.58 -51.82 67.79 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.289 -0.882 . . . . 0.17999999999999999 110.203 -179.614 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' D' D ' 348' ' ' LEU . . . . . 0.592 HD22 ' N ' ' D' ' 348' ' ' LEU . 3.9 mm? -61.16 -49.87 75.49 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.077 -1.014 . . . . 0.31 109.818 -179.315 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' D' D ' 349' ' ' GLU . . . . . . . . . . . . . 55.6 mt-10 -57.45 -31.29 65.77 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.168 -0.957 . . . . 1.95 110.062 -179.368 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' D' D ' 350' ' ' LEU . . . . . 1.009 HD13 HD22 ' C' ' 350' ' ' LEU . 4.7 tt -63.47 -41.47 98.6 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 120.972 -1.08 . . . . 0.42999999999999999 109.11 179.83 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' D' D ' 351' ' ' LYS . . . . . . . . . . . . . 6.7 tttt -59.6 -44.29 93.43 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.377 -0.827 . . . . 1.3999999999999999 109.517 -179.992 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' D' D ' 352' ' ' ASP . . . . . . . . . . . . . 66.6 m-20 -54.93 -43.5 73.4 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.201 -0.937 . . . . 1.1699999999999999 109.747 -179.859 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' D' D ' 353' ' ' ALA . . . . . . . . . . . . . . . -67.87 -28.2 67.33 Favored 'General case' 0 N--CA 1.489 1.488 0 O-C-N 121.215 -0.928 . . . . 0.58999999999999997 109.703 -179.739 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' D' D ' 354' ' ' GLN . . . . . . . . . . . . . 3.6 mt-30 . . . . . 0 N--CA 1.491 1.618 0 O-C-N 121.41 -0.806 . . . . 1.4399999999999999 109.515 179.883 . . . . . . . . 0 0 . 1 . 032 nuclear build core ' A' A ' 326' ' ' GLU . . . . . 0.431 ' HB2' ' CE1' ' A' ' 328' ' ' PHE . 44.9 mt-10 . . . . . 0 N--CA 1.489 1.49 0 N-CA-C 109.369 -0.604 . . . . 2.1299999999999999 109.369 . . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 327' ' ' TYR . . . . . . . . . . . . . 44.6 m-85 -149.49 109.27 4.05 Favored 'General case' 0 N--CA 1.488 1.452 0 O-C-N 121.337 -0.852 . . . . 0.47999999999999998 109.267 179.993 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 328' ' ' PHE . . . . . 0.431 ' CE1' ' HB2' ' A' ' 326' ' ' GLU . 41.7 m-85 -113.58 -169.16 1.45 Allowed 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.288 -0.882 . . . . 0.31 109.473 -179.809 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' A' A ' 329' ' ' THR . . . . . 0.427 HG23 ' O ' ' A' ' 328' ' ' PHE . 6.4 p -153.6 168.39 26.34 Favored 'General case' 0 N--CA 1.488 1.456 0 O-C-N 121.294 -0.879 . . . . 0.22 109.216 -179.948 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' A' A ' 330' ' ' LEU . . . . . . . . . . . . . 20.6 tp -150.19 129.03 12.47 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.171 -0.956 . . . . 0.28000000000000003 109.704 -179.783 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 331' ' ' GLN . . . . . . . . . . . . . 1.2 tp60 -87.7 113.35 23.29 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.441 -0.787 . . . . 0.91000000000000003 109.393 179.739 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 332' ' ' ILE . . . . . 0.936 HG21 ' HA ' ' A' ' 338' ' ' PHE . 76.2 mt -103.57 105.06 17.66 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.573 0 O-C-N 121.193 -0.942 . . . . 0.26000000000000001 109.431 -179.975 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' A' A ' 333' ' ' ARG . . . . . 0.457 ' NH1' ' HG2' ' A' ' 333' ' ' ARG . 0.0 OUTLIER -71.75 150.71 44.2 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.264 -0.898 . . . . 2.9199999999999999 109.284 179.822 . . . . . . . . 3 3 . 1 . 032 nuclear build core ' A' A ' 334' ' ' GLY . . . . . . . . . . . . . . . 76.43 126.73 0.25 Allowed Glycine 0 N--CA 1.49 2.267 0 N-CA-C 109.473 -1.451 . . . . 0.40000000000000002 109.473 -179.982 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 335' ' ' ARG . . . . . 0.463 ' HB2' ' OE1' ' C' ' 326' ' ' GLU . 0.4 OUTLIER -74.02 -32.84 63.54 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.264 -1.139 . . . . 3.0099999999999998 109.681 -179.879 . . . . . . . . 3 3 . 1 . 032 nuclear build core ' A' A ' 336' ' ' GLU . . . . . . . . . . . . . 3.1 mt-10 -58.05 -61.5 2.5 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.282 -0.886 . . . . 2.29 109.796 -179.763 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 337' ' ' ARG . . . . . . . . . . . . . 22.4 mmm180 -59.78 -33.69 72.02 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.194 -0.941 . . . . 2.9300000000000002 109.633 -179.704 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 338' ' ' PHE . . . . . 0.936 ' HA ' HG21 ' A' ' 332' ' ' ILE . 59.5 t80 -55.89 -55.12 36.37 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.159 -0.963 . . . . 0.38 109.964 -179.75 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' A' A ' 339' ' ' GLU . . . . . . . . . . . . . 45.4 mt-10 -50.86 -33.92 25.88 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.237 -0.914 . . . . 1.97 110.369 -179.354 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 340' ' ' MET . . . . . . . . . . . . . 24.2 ttp -64.08 -51.7 62.8 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 120.976 -1.077 . . . . 0.31 110.081 -179.457 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 341' ' ' PHE . . . . . . . . . . . . . 45.2 m-85 -61.98 -45.18 94.76 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.137 -0.977 . . . . 0.17999999999999999 110.017 -179.437 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 342' ' ' ARG . . . . . 0.418 ' O ' ' HB3' ' A' ' 345' ' ' ASN . 40.5 ttt180 -50.77 -40.39 54.84 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.144 -0.973 . . . . 2.4199999999999999 109.817 -179.75 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' A' A ' 343' ' ' GLU . . . . . . . . . . . . . 35.5 tp10 -58.43 -51.53 69.46 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.095 -1.003 . . . . 2.3500000000000001 109.766 -179.624 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 344' ' ' LEU . . . . . 0.618 HD22 HD22 ' B' ' 344' ' ' LEU . 84.6 mt -61.08 -32.0 71.65 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.239 -0.913 . . . . 0.17999999999999999 109.338 -179.895 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' A' A ' 345' ' ' ASN . . . . . 0.418 ' HB3' ' O ' ' A' ' 342' ' ' ARG . 8.7 t-20 -58.67 -55.0 40.7 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.254 -0.904 . . . . 1.0900000000000001 109.325 179.861 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' A' A ' 346' ' ' GLU . . . . . . . . . . . . . 32.4 tp10 -61.62 -32.1 72.22 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.382 -0.824 . . . . 1.6499999999999999 109.843 -179.736 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 347' ' ' ALA . . . . . 0.701 ' HB1' ' HB1' ' B' ' 347' ' ' ALA . . . -59.5 -57.04 14.69 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.187 -0.945 . . . . 0.17999999999999999 109.787 -179.738 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' A' A ' 348' ' ' LEU . . . . . 0.555 HD22 ' N ' ' A' ' 348' ' ' LEU . 3.5 mm? -61.82 -38.73 89.25 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.171 -0.956 . . . . 0.29999999999999999 109.645 -179.675 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' A' A ' 349' ' ' GLU . . . . . . . . . . . . . 1.8 mt-10 -58.86 -38.39 78.66 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.306 -0.871 . . . . 1.9399999999999999 110.168 -179.443 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 350' ' ' LEU . . . . . 0.515 HD13 HD22 ' B' ' 350' ' ' LEU . 7.8 tt -63.76 -43.67 95.73 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.179 -0.951 . . . . 0.46000000000000002 109.87 -179.576 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' A' A ' 351' ' ' LYS . . . . . . . . . . . . . 18.8 tttm -58.34 -42.02 85.94 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.311 -0.868 . . . . 1.3999999999999999 109.549 -179.774 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 352' ' ' ASP . . . . . . . . . . . . . 48.0 m-20 -56.2 -41.52 75.72 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.252 -0.905 . . . . 1.1599999999999999 109.522 -179.983 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 353' ' ' ALA . . . . . . . . . . . . . . . -67.97 -25.54 65.48 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.229 -0.92 . . . . 0.63 109.434 -179.936 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 354' ' ' GLN . . . . . . . . . . . . . 2.5 mt-30 . . . . . 0 N--CA 1.491 1.594 0 O-C-N 121.261 -0.9 . . . . 1.47 109.508 179.968 . . . . . . . . 0 0 . 1 . 032 nuclear build core ' B' B ' 326' ' ' GLU . . . . . 0.44 ' HB2' ' CE1' ' B' ' 328' ' ' PHE . 45.0 mt-10 . . . . . 0 N--CA 1.488 1.462 0 N-CA-C 109.348 -0.612 . . . . 2.1299999999999999 109.348 . . . . . . . . . 1 1 . 1 . 032 nuclear build core ' B' B ' 327' ' ' TYR . . . . . . . . . . . . . 44.6 m-85 -149.6 109.22 4.02 Favored 'General case' 0 N--CA 1.488 1.447 0 O-C-N 121.259 -0.901 . . . . 0.47999999999999998 109.291 179.914 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' B' B ' 328' ' ' PHE . . . . . 0.44 ' CE1' ' HB2' ' B' ' 326' ' ' GLU . 40.8 m-85 -113.63 -169.23 1.47 Allowed 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.255 -0.903 . . . . 0.32000000000000001 109.496 -179.772 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' B' B ' 329' ' ' THR . . . . . 0.433 HG23 ' O ' ' B' ' 328' ' ' PHE . 6.4 p -153.52 168.64 25.46 Favored 'General case' 0 N--CA 1.488 1.458 0 O-C-N 121.247 -0.908 . . . . 0.23000000000000001 109.267 -179.989 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' B' B ' 330' ' ' LEU . . . . . 0.477 HD21 HD22 ' D' ' 345' ' ' ASN . 20.0 tp -150.26 129.15 12.51 Favored 'General case' 0 N--CA 1.489 1.487 0 O-C-N 121.18 -0.95 . . . . 0.28000000000000003 109.759 -179.88 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' B' B ' 331' ' ' GLN . . . . . . . . . . . . . 1.2 tp60 -87.83 113.27 23.33 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.355 -0.841 . . . . 0.91000000000000003 109.383 179.739 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' B' B ' 332' ' ' ILE . . . . . 0.918 HG21 ' HA ' ' B' ' 338' ' ' PHE . 76.0 mt -103.59 105.01 17.57 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.554 0 O-C-N 121.29 -0.881 . . . . 0.23999999999999999 109.444 -179.948 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' B' B ' 333' ' ' ARG . . . . . 0.459 ' NH1' ' HG2' ' B' ' 333' ' ' ARG . 0.0 OUTLIER -71.51 150.71 44.56 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.178 -0.952 . . . . 2.9300000000000002 109.359 179.802 . . . . . . . . 3 3 . 1 . 032 nuclear build core ' B' B ' 334' ' ' GLY . . . . . . . . . . . . . . . 76.24 126.78 0.24 Allowed Glycine 0 N--CA 1.49 2.276 0 N-CA-C 109.553 -1.419 . . . . 0.40000000000000002 109.553 -179.933 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' B' B ' 335' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -74.04 -32.9 63.53 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.25 -1.147 . . . . 3.0099999999999998 109.654 -179.855 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' B' B ' 336' ' ' GLU . . . . . . . . . . . . . 3.1 mt-10 -57.96 -61.42 2.55 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.132 -0.98 . . . . 2.2799999999999998 109.781 -179.723 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' B' B ' 337' ' ' ARG . . . . . . . . . . . . . 22.2 mmm180 -59.94 -33.78 72.36 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.225 -0.922 . . . . 2.9300000000000002 109.674 -179.716 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' B' B ' 338' ' ' PHE . . . . . 0.918 ' HA ' HG21 ' B' ' 332' ' ' ILE . 59.0 t80 -55.89 -55.11 36.48 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.16 -0.963 . . . . 0.37 109.873 -179.715 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' B' B ' 339' ' ' GLU . . . . . . . . . . . . . 45.0 mt-10 -50.65 -34.22 25.47 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.21 -0.931 . . . . 1.98 110.399 -179.435 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' B' B ' 340' ' ' MET . . . . . . . . . . . . . 23.9 ttp -64.01 -51.57 63.63 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.049 -1.032 . . . . 0.32000000000000001 110.115 -179.375 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' B' B ' 341' ' ' PHE . . . . . . . . . . . . . 44.8 m-85 -61.9 -45.46 93.65 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.167 -0.958 . . . . 0.17999999999999999 109.96 -179.451 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' B' B ' 342' ' ' ARG . . . . . 0.424 ' O ' ' HB3' ' B' ' 345' ' ' ASN . 41.1 ttt180 -50.62 -40.36 52.67 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.187 -0.946 . . . . 2.4199999999999999 109.933 -179.796 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' B' B ' 343' ' ' GLU . . . . . . . . . . . . . 35.4 tp10 -58.46 -51.51 69.53 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.192 -0.943 . . . . 2.3500000000000001 109.825 -179.604 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' B' B ' 344' ' ' LEU . . . . . 0.618 HD22 HD22 ' A' ' 344' ' ' LEU . 84.0 mt -61.01 -31.99 71.6 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.137 -0.977 . . . . 0.17999999999999999 109.345 -179.949 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' B' B ' 345' ' ' ASN . . . . . 0.44 HD22 HD21 ' D' ' 330' ' ' LEU . 9.0 t-20 -58.65 -55.06 39.98 Favored 'General case' 0 N--CA 1.488 1.451 0 O-C-N 121.325 -0.859 . . . . 1.0900000000000001 109.372 179.83 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' B' B ' 346' ' ' GLU . . . . . . . . . . . . . 32.4 tp10 -61.52 -32.21 72.25 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.478 -0.764 . . . . 1.6599999999999999 109.815 -179.867 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' B' B ' 347' ' ' ALA . . . . . 0.701 ' HB1' ' HB1' ' A' ' 347' ' ' ALA . . . -59.59 -56.95 15.51 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.166 -0.959 . . . . 0.17000000000000001 109.912 -179.756 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' B' B ' 348' ' ' LEU . . . . . 0.557 HD22 ' N ' ' B' ' 348' ' ' LEU . 3.5 mm? -61.92 -38.83 89.89 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.168 -0.957 . . . . 0.28999999999999998 109.71 -179.734 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' B' B ' 349' ' ' GLU . . . . . . . . . . . . . 1.8 mt-10 -58.67 -38.36 78.02 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.298 -0.876 . . . . 1.95 110.184 -179.583 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' B' B ' 350' ' ' LEU . . . . . 0.515 HD22 HD13 ' A' ' 350' ' ' LEU . 7.8 tt -63.81 -43.58 95.84 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.089 -1.007 . . . . 0.45000000000000001 109.827 -179.512 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' B' B ' 351' ' ' LYS . . . . . . . . . . . . . 18.7 tttm -58.39 -42.14 86.42 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.189 -0.944 . . . . 1.3799999999999999 109.53 -179.744 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' B' B ' 352' ' ' ASP . . . . . . . . . . . . . 48.5 m-20 -55.91 -41.6 74.79 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.284 -0.885 . . . . 1.1599999999999999 109.524 -179.996 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' B' B ' 353' ' ' ALA . . . . . . . . . . . . . . . -68.03 -25.6 65.46 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.19 -0.944 . . . . 0.60999999999999999 109.494 -179.871 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' B' B ' 354' ' ' GLN . . . . . . . . . . . . . 2.5 mt-30 . . . . . 0 N--CA 1.49 1.552 0 O-C-N 121.213 -0.929 . . . . 1.45 109.54 179.884 . . . . . . . . 0 0 . 1 . 032 nuclear build core ' C' C ' 326' ' ' GLU . . . . . 0.463 ' OE1' ' HB2' ' A' ' 335' ' ' ARG . 95.0 mt-10 . . . . . 0 N--CA 1.49 1.527 0 N-CA-C 109.286 -0.635 . . . . 2.1699999999999999 109.286 . . . . . . . . . 1 1 . 1 . 032 nuclear build core ' C' C ' 327' ' ' TYR . . . . . . . . . . . . . 59.0 m-85 -149.02 104.53 3.44 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.102 -0.999 . . . . 0.47999999999999998 109.808 -179.744 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' C' C ' 328' ' ' PHE . . . . . 0.505 ' O ' HG23 ' C' ' 329' ' ' THR . 96.3 m-85 -106.03 -164.53 1.02 Allowed 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.297 -0.877 . . . . 0.33000000000000002 109.303 179.654 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' C' C ' 329' ' ' THR . . . . . 0.505 HG23 ' O ' ' C' ' 328' ' ' PHE . 4.2 p -155.75 167.01 31.77 Favored 'General case' 0 N--CA 1.489 1.491 0 O-C-N 121.214 -0.929 . . . . 0.23000000000000001 109.751 -179.982 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' C' C ' 330' ' ' LEU . . . . . . . . . . . . . 40.3 tp -150.94 125.57 9.62 Favored 'General case' 0 N--CA 1.488 1.471 0 O-C-N 121.321 -0.862 . . . . 0.28000000000000003 109.174 179.802 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' C' C ' 331' ' ' GLN . . . . . . . . . . . . . 3.5 tp60 -87.45 113.06 22.81 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.164 -0.96 . . . . 1.48 109.732 -179.857 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' C' C ' 332' ' ' ILE . . . . . . . . . . . . . 31.7 mt -103.77 109.5 27.32 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.643 0 O-C-N 121.25 -0.906 . . . . 0.23999999999999999 109.537 179.871 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' C' C ' 333' ' ' ARG . . . . . 0.475 ' HG3' ' NH1' ' C' ' 333' ' ' ARG . 16.0 mtm-85 -73.86 149.7 41.39 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.227 -0.921 . . . . 2.7400000000000002 109.428 179.786 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' C' C ' 334' ' ' GLY . . . . . . . . . . . . . . . 76.72 132.16 0.47 Allowed Glycine 0 N--CA 1.49 2.289 0 N-CA-C 109.6 -1.4 . . . . 0.34999999999999998 109.6 179.903 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' C' C ' 335' ' ' ARG . . . . . 0.425 ' O ' ' HB3' ' C' ' 338' ' ' PHE . 2.6 tmt_? -76.45 -30.74 57.47 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.309 -1.112 . . . . 2.5299999999999998 109.647 179.943 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' C' C ' 336' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -55.81 -57.11 13.39 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.322 -0.861 . . . . 2.6200000000000001 109.959 -179.603 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' C' C ' 337' ' ' ARG . . . . . 0.548 ' NH1' ' HG3' ' C' ' 337' ' ' ARG . 1.4 mtm-85 -60.82 -30.56 70.16 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.098 -1.002 . . . . 2.8100000000000001 109.718 -179.839 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' C' C ' 338' ' ' PHE . . . . . 0.425 ' HB3' ' O ' ' C' ' 335' ' ' ARG . 75.9 t80 -54.0 -59.84 4.11 Favored 'General case' 0 N--CA 1.489 1.49 0 O-C-N 121.306 -0.871 . . . . 0.40000000000000002 110.265 -179.257 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' C' C ' 339' ' ' GLU . . . . . . . . . . . . . 1.1 mt-10 -50.0 -37.75 34.07 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.024 -1.048 . . . . 2.0499999999999998 110.58 -179.283 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' C' C ' 340' ' ' MET . . . . . . . . . . . . . 25.9 ttp -63.62 -54.8 30.16 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.034 -1.041 . . . . 0.32000000000000001 110.426 -179.097 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' C' C ' 341' ' ' PHE . . . . . . . . . . . . . 59.5 m-85 -61.8 -58.49 7.77 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.117 -0.989 . . . . 0.17999999999999999 110.006 -179.298 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' C' C ' 342' ' ' ARG . . . . . 0.455 ' CG ' ' NH1' ' C' ' 342' ' ' ARG . 0.0 OUTLIER -48.21 -32.5 7.2 Favored 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.186 -0.946 . . . . 2.9100000000000001 109.813 -179.723 . . . . . . . . 3 3 . 1 . 032 nuclear build core ' C' C ' 343' ' ' GLU . . . . . . . . . . . . . 10.0 tp10 -58.72 -55.52 33.97 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.149 -0.97 . . . . 2.1400000000000001 109.458 -179.895 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' C' C ' 344' ' ' LEU . . . . . 1.118 HD22 HD22 ' D' ' 344' ' ' LEU . 43.3 mt -62.16 -28.7 69.84 Favored 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.241 -0.912 . . . . 0.22 109.361 179.833 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' C' C ' 345' ' ' ASN . . . . . . . . . . . . . 15.8 t-20 -56.33 -56.56 19.5 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.247 -0.908 . . . . 1.0800000000000001 109.53 -179.996 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' C' C ' 346' ' ' GLU . . . . . . . . . . . . . 61.6 tt0 -61.17 -30.66 70.53 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.227 -0.92 . . . . 2.21 109.592 -179.831 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' C' C ' 347' ' ' ALA . . . . . 0.84 ' HB1' ' HB1' ' D' ' 347' ' ' ALA . . . -59.82 -54.73 42.79 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.284 -0.885 . . . . 0.17999999999999999 109.94 -179.726 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' C' C ' 348' ' ' LEU . . . . . 0.565 ' N ' HD22 ' C' ' 348' ' ' LEU . 3.3 mm? -62.31 -43.58 98.5 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.257 -0.902 . . . . 0.32000000000000001 109.768 -179.664 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' C' C ' 349' ' ' GLU . . . . . . . . . . . . . 67.6 mm-40 -59.26 -32.71 70.26 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.192 -0.943 . . . . 2.1899999999999999 110.386 -179.242 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' C' C ' 350' ' ' LEU . . . . . 0.696 HD13 HD22 ' D' ' 350' ' ' LEU . 6.1 tt -62.67 -49.57 74.62 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 120.953 -1.092 . . . . 0.46000000000000002 109.562 -179.702 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' C' C ' 351' ' ' LYS . . . . . . . . . . . . . 73.2 tttt -57.83 -44.03 86.17 Favored 'General case' 0 C--N 1.303 -1.437 0 O-C-N 121.176 -0.953 . . . . 1.3500000000000001 109.393 -179.777 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' C' C ' 352' ' ' ASP . . . . . . . . . . . . . 42.4 m-20 -58.36 -39.79 80.5 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.333 -0.855 . . . . 1.1899999999999999 110.015 179.918 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' C' C ' 353' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 1.598 0 O-C-N 121.177 -0.952 . . . . 0.56999999999999995 110.27 -179.246 . . . . . . . . 0 0 . 1 . 032 nuclear build core ' D' D ' 326' ' ' GLU . . . . . 0.439 ' HB2' ' CE1' ' D' ' 328' ' ' PHE . 45.0 mt-10 . . . . . 0 N--CA 1.49 1.526 0 N-CA-C 109.356 -0.609 . . . . 2.1299999999999999 109.356 . . . . . . . . . 1 1 . 1 . 032 nuclear build core ' D' D ' 327' ' ' TYR . . . . . . . . . . . . . 44.7 m-85 -149.24 109.1 4.05 Favored 'General case' 0 N--CA 1.488 1.43 0 O-C-N 121.358 -0.839 . . . . 0.46999999999999997 109.276 179.925 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' D' D ' 328' ' ' PHE . . . . . 0.439 ' CE1' ' HB2' ' D' ' 326' ' ' GLU . 40.4 m-85 -113.58 -169.36 1.49 Allowed 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.236 -0.915 . . . . 0.29999999999999999 109.533 -179.775 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' D' D ' 329' ' ' THR . . . . . 0.425 ' HA ' ' O ' ' B' ' 330' ' ' LEU . 6.7 p -153.38 168.52 25.81 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.314 -0.866 . . . . 0.22 109.181 -179.979 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' D' D ' 330' ' ' LEU . . . . . 0.44 HD21 HD22 ' B' ' 345' ' ' ASN . 19.9 tp -150.02 129.13 12.71 Favored 'General case' 0 N--CA 1.489 1.491 0 O-C-N 121.14 -0.975 . . . . 0.28000000000000003 109.686 -179.868 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' D' D ' 331' ' ' GLN . . . . . . . . . . . . . 1.2 tp60 -87.96 113.21 23.39 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.299 -0.875 . . . . 0.93000000000000005 109.382 179.747 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' D' D ' 332' ' ' ILE . . . . . 0.927 HG21 ' HA ' ' D' ' 338' ' ' PHE . 74.7 mt -103.41 104.96 17.46 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.538 0 O-C-N 121.235 -0.915 . . . . 0.25 109.51 -179.985 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' D' D ' 333' ' ' ARG . . . . . 0.457 ' NH1' ' HG2' ' D' ' 333' ' ' ARG . 0.0 OUTLIER -71.47 150.78 44.55 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.246 -0.909 . . . . 2.9300000000000002 109.246 179.84 . . . . . . . . 3 3 . 1 . 032 nuclear build core ' D' D ' 334' ' ' GLY . . . . . . . . . . . . . . . 76.18 126.81 0.24 Allowed Glycine 0 N--CA 1.491 2.304 0 N-CA-C 109.475 -1.45 . . . . 0.40999999999999998 109.475 -179.996 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' D' D ' 335' ' ' ARG . . . . . 0.401 ' HA ' ' CE1' ' B' ' 328' ' ' PHE . 0.4 OUTLIER -74.05 -32.78 63.46 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.31 -1.112 . . . . 3.0299999999999998 109.63 -179.859 . . . . . . . . 3 3 . 1 . 032 nuclear build core ' D' D ' 336' ' ' GLU . . . . . . . . . . . . . 3.2 mt-10 -58.06 -61.53 2.48 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.221 -0.925 . . . . 2.2599999999999998 109.795 -179.762 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' D' D ' 337' ' ' ARG . . . . . . . . . . . . . 22.3 mmm180 -59.84 -33.61 71.99 Favored 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.319 -0.863 . . . . 2.9199999999999999 109.651 -179.678 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' D' D ' 338' ' ' PHE . . . . . 0.927 ' HA ' HG21 ' D' ' 332' ' ' ILE . 58.6 t80 -55.99 -55.03 37.69 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.217 -0.927 . . . . 0.37 109.916 -179.697 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' D' D ' 339' ' ' GLU . . . . . . . . . . . . . 44.7 mt-10 -50.8 -34.12 26.25 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.262 -0.899 . . . . 1.99 110.41 -179.411 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' D' D ' 340' ' ' MET . . . . . . . . . . . . . 23.9 ttp -64.14 -51.41 64.03 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.045 -1.035 . . . . 0.31 110.132 -179.413 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' D' D ' 341' ' ' PHE . . . . . . . . . . . . . 44.7 m-85 -61.93 -45.5 93.42 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.179 -0.951 . . . . 0.17999999999999999 109.972 -179.462 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' D' D ' 342' ' ' ARG . . . . . 0.423 ' O ' ' HB3' ' D' ' 345' ' ' ASN . 41.5 ttt180 -50.64 -40.31 52.79 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.141 -0.974 . . . . 2.4100000000000001 109.876 -179.751 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' D' D ' 343' ' ' GLU . . . . . . . . . . . . . 36.0 tp10 -58.36 -51.67 68.82 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.183 -0.948 . . . . 2.3500000000000001 109.77 -179.673 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' D' D ' 344' ' ' LEU . . . . . 1.118 HD22 HD22 ' C' ' 344' ' ' LEU . 84.7 mt -60.91 -32.0 71.5 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.221 -0.925 . . . . 0.19 109.425 -179.952 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' D' D ' 345' ' ' ASN . . . . . 0.477 HD22 HD21 ' B' ' 330' ' ' LEU . 9.1 t-20 -58.69 -55.2 38.09 Favored 'General case' 0 N--CA 1.489 1.487 0 O-C-N 121.351 -0.843 . . . . 1.0900000000000001 109.303 179.867 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' D' D ' 346' ' ' GLU . . . . . . . . . . . . . 31.5 tp10 -61.4 -32.2 72.13 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.35 -0.844 . . . . 1.6899999999999999 109.839 -179.85 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' D' D ' 347' ' ' ALA . . . . . 0.84 ' HB1' ' HB1' ' C' ' 347' ' ' ALA . . . -59.61 -56.94 15.63 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.128 -0.983 . . . . 0.17999999999999999 109.78 -179.669 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' D' D ' 348' ' ' LEU . . . . . 0.555 HD22 ' N ' ' D' ' 348' ' ' LEU . 3.5 mm? -61.96 -38.79 89.84 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.195 -0.941 . . . . 0.31 109.625 -179.662 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' D' D ' 349' ' ' GLU . . . . . . . . . . . . . 1.8 mt-10 -58.83 -38.17 78.07 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.293 -0.879 . . . . 1.95 110.183 -179.514 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' D' D ' 350' ' ' LEU . . . . . 0.696 HD22 HD13 ' C' ' 350' ' ' LEU . 7.8 tt -63.96 -43.61 95.3 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.091 -1.006 . . . . 0.42999999999999999 109.852 -179.505 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' D' D ' 351' ' ' LYS . . . . . . . . . . . . . 18.7 tttm -58.32 -42.03 85.85 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.305 -0.872 . . . . 1.3999999999999999 109.561 -179.758 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' D' D ' 352' ' ' ASP . . . . . . . . . . . . . 49.0 m-20 -56.04 -41.57 75.22 Favored 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.203 -0.936 . . . . 1.1699999999999999 109.579 179.972 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' D' D ' 353' ' ' ALA . . . . . . . . . . . . . . . -67.84 -25.72 65.69 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.204 -0.935 . . . . 0.58999999999999997 109.513 -179.97 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' D' D ' 354' ' ' GLN . . . . . . . . . . . . . 2.6 mt-30 . . . . . 0 N--CA 1.492 1.668 0 O-C-N 121.26 -0.9 . . . . 1.4399999999999999 109.474 -179.971 . . . . . . . . 0 0 . 1 . 033 nuclear build core ' A' A ' 326' ' ' GLU . . . . . . . . . . . . . 33.9 mm-40 . . . . . 0 N--CA 1.489 1.489 0 CA-C-O 121.381 0.61 . . . . 2.1299999999999999 109.603 . . . . . . . . . 0 0 . 1 . 033 nuclear build core ' A' A ' 327' ' ' TYR . . . . . . . . . . . . . 39.4 m-85 -149.83 105.81 3.45 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.256 -0.903 . . . . 0.47999999999999998 109.638 179.928 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 328' ' ' PHE . . . . . 0.566 ' CZ ' ' HB2' ' C' ' 335' ' ' ARG . 24.7 m-85 -113.29 -166.51 1.09 Allowed 'General case' 0 N--CA 1.488 1.443 0 O-C-N 121.357 -0.84 . . . . 0.31 109.192 179.799 . . . . . . . . 2 2 . 1 . 033 nuclear build core ' A' A ' 329' ' ' THR . . . . . . . . . . . . . 71.2 p -153.94 173.99 15.23 Favored 'General case' 0 N--CA 1.495 1.814 0 O-C-N 121.395 -0.815 . . . . 0.22 109.18 179.559 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 330' ' ' LEU . . . . . . . . . . . . . 17.2 tp -150.41 131.0 13.93 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.314 -0.866 . . . . 0.28000000000000003 109.394 179.845 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 331' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -87.48 112.26 22.02 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.362 -0.837 . . . . 0.91000000000000003 109.124 179.793 . . . . . . . . 2 2 . 1 . 033 nuclear build core ' A' A ' 332' ' ' ILE . . . . . 0.91 HG21 ' HA ' ' A' ' 338' ' ' PHE . 79.5 mt -103.47 105.79 18.98 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.477 0 O-C-N 121.075 -1.015 . . . . 0.26000000000000001 109.736 -179.858 . . . . . . . . 2 2 . 1 . 033 nuclear build core ' A' A ' 333' ' ' ARG . . . . . 0.638 ' HG2' ' CE2' ' C' ' 327' ' ' TYR . 25.9 mtt180 -72.38 148.26 45.42 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.44 -0.787 . . . . 2.9199999999999999 109.871 179.914 . . . . . . . . 2 2 . 1 . 033 nuclear build core ' A' A ' 334' ' ' GLY . . . . . . . . . . . . . . . 82.69 134.81 2.19 Favored Glycine 0 N--CA 1.491 2.322 0 N-CA-C 109.856 -1.297 . . . . 0.40000000000000002 109.856 179.784 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 335' ' ' ARG . . . . . 0.455 ' HA ' ' CE1' ' C' ' 328' ' ' PHE . 0.0 OUTLIER -80.37 -39.75 27.89 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.338 -1.095 . . . . 3.0099999999999998 109.653 179.997 . . . . . . . . 3 3 . 1 . 033 nuclear build core ' A' A ' 336' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -58.82 -61.48 2.59 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.14 -0.975 . . . . 2.29 109.891 -179.657 . . . . . . . . 2 2 . 1 . 033 nuclear build core ' A' A ' 337' ' ' ARG . . . . . 0.46 ' CG ' HH11 ' A' ' 337' ' ' ARG . 0.0 OUTLIER -58.09 -30.92 66.62 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.19 -0.943 . . . . 2.9300000000000002 109.529 -179.76 . . . . . . . . 3 3 . 1 . 033 nuclear build core ' A' A ' 338' ' ' PHE . . . . . 0.91 ' HA ' HG21 ' A' ' 332' ' ' ILE . 50.4 t80 -55.78 -56.37 21.33 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.306 -0.871 . . . . 0.38 109.527 -179.872 . . . . . . . . 2 2 . 1 . 033 nuclear build core ' A' A ' 339' ' ' GLU . . . . . . . . . . . . . 48.9 mt-10 -50.88 -33.27 23.32 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.231 -0.918 . . . . 1.97 109.875 -179.965 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 340' ' ' MET . . . . . . . . . . . . . 18.7 ttp -62.22 -53.3 57.14 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.29 -0.881 . . . . 0.31 110.008 -179.416 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 341' ' ' PHE . . . . . 0.425 ' HB2' HD13 ' A' ' 332' ' ' ILE . 36.9 m-85 -61.2 -49.32 77.62 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.206 -0.934 . . . . 0.17999999999999999 110.202 -179.616 . . . . . . . . 2 2 . 1 . 033 nuclear build core ' A' A ' 342' ' ' ARG . . . . . . . . . . . . . 4.2 ttt180 -47.43 -41.06 19.45 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.368 -0.832 . . . . 2.4199999999999999 109.821 -179.972 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 343' ' ' GLU . . . . . . . . . . . . . 65.2 tt0 -59.26 -47.94 83.49 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.156 -0.965 . . . . 2.3500000000000001 110.285 -179.586 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 344' ' ' LEU . . . . . . . . . . . . . 47.7 mt -63.16 -32.36 73.73 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.08 -1.013 . . . . 0.17999999999999999 110.063 -179.431 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 345' ' ' ASN . . . . . 0.442 ' HB2' HD21 ' C' ' 330' ' ' LEU . 10.8 t-20 -57.96 -55.38 35.65 Favored 'General case' 0 N--CA 1.488 1.47 0 O-C-N 121.19 -0.944 . . . . 1.0900000000000001 109.637 -179.756 . . . . . . . . 2 2 . 1 . 033 nuclear build core ' A' A ' 346' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -61.55 -29.74 70.2 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.211 -0.93 . . . . 1.6499999999999999 109.977 -179.844 . . . . . . . . 2 2 . 1 . 033 nuclear build core ' A' A ' 347' ' ' ALA . . . . . 0.553 ' HB1' ' HB1' ' B' ' 347' ' ' ALA . . . -59.34 -58.93 6.47 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.278 -0.889 . . . . 0.17999999999999999 110.237 -179.534 . . . . . . . . 2 2 . 1 . 033 nuclear build core ' A' A ' 348' ' ' LEU . . . . . 0.607 HD22 ' N ' ' A' ' 348' ' ' LEU . 4.1 mm? -61.2 -42.7 99.05 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.162 -0.961 . . . . 0.29999999999999999 110.005 -179.365 . . . . . . . . 2 2 . 1 . 033 nuclear build core ' A' A ' 349' ' ' GLU . . . . . . . . . . . . . 16.2 mm-40 -57.87 -34.05 69.34 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.207 -0.933 . . . . 1.9399999999999999 109.997 -179.493 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 350' ' ' LEU . . . . . 0.544 HD22 HD22 ' B' ' 350' ' ' LEU . 6.2 tt -64.43 -44.3 91.64 Favored 'General case' 0 N--CA 1.495 1.783 0 O-C-N 121.194 -0.941 . . . . 0.46000000000000002 109.651 -179.592 . . . . . . . . 2 2 . 1 . 033 nuclear build core ' A' A ' 351' ' ' LYS . . . . . . . . . . . . . 43.8 tttt -60.46 -46.82 88.69 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.246 -0.909 . . . . 1.3999999999999999 109.859 -179.694 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 352' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -54.86 -44.89 74.43 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.416 -0.803 . . . . 1.1599999999999999 110.377 -179.288 . . . . . . . . 2 2 . 1 . 033 nuclear build core ' A' A ' 353' ' ' ALA . . . . . . . . . . . . . . . -66.68 -26.98 67.29 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 120.95 -1.093 . . . . 0.63 109.608 -179.804 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 354' ' ' GLN . . . . . . . . . . . . . 46.8 tt0 . . . . . 0 N--CA 1.488 1.475 0 O-C-N 121.001 -1.062 . . . . 1.47 109.825 -179.749 . . . . . . . . 0 0 . 1 . 033 nuclear build core ' B' B ' 326' ' ' GLU . . . . . . . . . . . . . 35.1 mm-40 . . . . . 0 N--CA 1.489 1.504 0 CA-C-O 121.466 0.651 . . . . 2.1299999999999999 109.791 . . . . . . . . . 0 0 . 1 . 033 nuclear build core ' B' B ' 327' ' ' TYR . . . . . 0.627 ' CE1' ' HG2' ' D' ' 333' ' ' ARG . 39.2 m-85 -150.02 104.38 3.28 Favored 'General case' 0 N--CA 1.489 1.487 0 O-C-N 121.325 -0.859 . . . . 0.47999999999999998 109.678 -179.957 . . . . . . . . 2 2 . 1 . 033 nuclear build core ' B' B ' 328' ' ' PHE . . . . . . . . . . . . . 18.4 m-85 -112.43 -163.86 0.88 Allowed 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.287 -0.883 . . . . 0.32000000000000001 109.308 179.657 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' B' B ' 329' ' ' THR . . . . . 0.466 ' HA ' ' O ' ' D' ' 330' ' ' LEU . 67.1 p -154.76 176.3 12.63 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.28 -0.887 . . . . 0.23000000000000001 109.36 179.452 . . . . . . . . 2 2 . 1 . 033 nuclear build core ' B' B ' 330' ' ' LEU . . . . . 0.501 HD21 ' HB2' ' D' ' 345' ' ' ASN . 18.3 tp -151.9 130.32 12.13 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.183 -0.948 . . . . 0.28000000000000003 109.138 179.653 . . . . . . . . 2 2 . 1 . 033 nuclear build core ' B' B ' 331' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -87.38 111.95 21.62 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.221 -0.924 . . . . 0.91000000000000003 109.144 179.72 . . . . . . . . 2 2 . 1 . 033 nuclear build core ' B' B ' 332' ' ' ILE . . . . . 0.85 HG21 ' HA ' ' B' ' 338' ' ' PHE . 72.0 mt -103.52 107.32 21.93 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.531 0 O-C-N 120.886 -1.134 . . . . 0.23999999999999999 109.659 -179.815 . . . . . . . . 2 2 . 1 . 033 nuclear build core ' B' B ' 333' ' ' ARG . . . . . 0.63 ' HG2' ' CE1' ' D' ' 327' ' ' TYR . 27.2 mtt180 -73.9 147.96 42.69 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.356 -0.84 . . . . 2.9300000000000002 109.824 -179.857 . . . . . . . . 2 2 . 1 . 033 nuclear build core ' B' B ' 334' ' ' GLY . . . . . . . . . . . . . . . 82.47 135.97 2.35 Favored Glycine 0 N--CA 1.488 2.118 0 N-CA-C 109.643 -1.383 . . . . 0.40000000000000002 109.643 179.799 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' B' B ' 335' ' ' ARG . . . . . 0.414 HH11 ' HG3' ' B' ' 335' ' ' ARG . 0.0 OUTLIER -80.68 -40.35 25.6 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.303 -1.116 . . . . 3.0099999999999998 109.96 -179.964 . . . . . . . . 3 3 . 1 . 033 nuclear build core ' B' B ' 336' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -58.61 -59.98 4.53 Favored 'General case' 0 N--CA 1.495 1.811 0 O-C-N 121.102 -0.999 . . . . 2.2799999999999998 109.989 -179.638 . . . . . . . . 2 2 . 1 . 033 nuclear build core ' B' B ' 337' ' ' ARG . . . . . 0.461 ' CG ' ' NH1' ' B' ' 337' ' ' ARG . 0.0 OUTLIER -59.23 -29.97 67.9 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.113 -0.992 . . . . 2.9300000000000002 109.61 -179.674 . . . . . . . . 3 3 . 1 . 033 nuclear build core ' B' B ' 338' ' ' PHE . . . . . 0.85 ' HA ' HG21 ' B' ' 332' ' ' ILE . 51.8 t80 -56.83 -57.06 14.14 Favored 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.509 -0.745 . . . . 0.37 109.402 179.837 . . . . . . . . 2 2 . 1 . 033 nuclear build core ' B' B ' 339' ' ' GLU . . . . . . . . . . . . . 48.3 mt-10 -50.91 -31.72 18.46 Favored 'General case' 0 N--CA 1.493 1.722 0 O-C-N 121.293 -0.879 . . . . 1.98 109.875 -179.774 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' B' B ' 340' ' ' MET . . . . . . . . . . . . . 18.8 ttp -63.88 -53.55 48.74 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.286 -0.884 . . . . 0.32000000000000001 110.04 -179.57 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' B' B ' 341' ' ' PHE . . . . . . . . . . . . . 37.5 m-85 -61.33 -49.0 78.76 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.232 -0.917 . . . . 0.17999999999999999 109.866 -179.481 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' B' B ' 342' ' ' ARG . . . . . . . . . . . . . 4.6 ttt180 -47.45 -40.91 19.34 Favored 'General case' 0 N--CA 1.493 1.717 0 O-C-N 121.171 -0.955 . . . . 2.4199999999999999 109.928 -179.756 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' B' B ' 343' ' ' GLU . . . . . . . . . . . . . 62.5 tt0 -59.42 -48.04 83.18 Favored 'General case' 0 N--CA 1.495 1.811 0 O-C-N 121.365 -0.835 . . . . 2.3500000000000001 110.302 -179.316 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' B' B ' 344' ' ' LEU . . . . . . . . . . . . . 37.6 mt -62.44 -33.26 74.47 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.192 -0.942 . . . . 0.17999999999999999 109.949 -179.485 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' B' B ' 345' ' ' ASN . . . . . 0.497 ' HB2' HD21 ' D' ' 330' ' ' LEU . 13.2 t-20 -56.92 -56.46 21.31 Favored 'General case' 0 C--N 1.299 -1.596 0 O-C-N 121.282 -0.886 . . . . 1.0900000000000001 109.862 -179.773 . . . . . . . . 2 2 . 1 . 033 nuclear build core ' B' B ' 346' ' ' GLU . . . . . . . . . . . . . 1.3 tt0 -61.0 -28.59 69.14 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.224 -0.923 . . . . 1.6599999999999999 110.073 -179.627 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' B' B ' 347' ' ' ALA . . . . . 0.553 ' HB1' ' HB1' ' A' ' 347' ' ' ALA . . . -60.36 -57.69 11.68 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.118 -0.989 . . . . 0.17000000000000001 110.111 -179.421 . . . . . . . . 2 2 . 1 . 033 nuclear build core ' B' B ' 348' ' ' LEU . . . . . 0.592 HD22 ' N ' ' B' ' 348' ' ' LEU . 4.1 mm? -62.05 -42.88 99.65 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.149 -0.97 . . . . 0.28999999999999998 110.159 -179.476 . . . . . . . . 2 2 . 1 . 033 nuclear build core ' B' B ' 349' ' ' GLU . . . . . . . . . . . . . 13.7 mm-40 -57.91 -35.23 70.75 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.045 -1.034 . . . . 1.95 110.066 -179.488 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' B' B ' 350' ' ' LEU . . . . . 0.544 HD22 HD22 ' A' ' 350' ' ' LEU . 6.5 tt -62.74 -45.01 94.71 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.002 -1.061 . . . . 0.45000000000000001 109.53 -179.652 . . . . . . . . 2 2 . 1 . 033 nuclear build core ' B' B ' 351' ' ' LYS . . . . . . . . . . . . . 37.8 tttt -59.87 -47.17 86.82 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.37 -0.831 . . . . 1.3799999999999999 109.764 -179.769 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' B' B ' 352' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -54.14 -44.86 71.74 Favored 'General case' 0 N--CA 1.488 1.449 0 O-C-N 121.341 -0.849 . . . . 1.1599999999999999 110.252 -179.441 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' B' B ' 353' ' ' ALA . . . . . . . . . . . . . . . -66.61 -29.43 69.47 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.026 -1.046 . . . . 0.60999999999999999 109.46 -179.848 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' B' B ' 354' ' ' GLN . . . . . . . . . . . . . 44.7 tt0 . . . . . 0 N--CA 1.492 1.656 0 O-C-N 121.107 -0.996 . . . . 1.45 109.962 -179.622 . . . . . . . . 0 0 . 1 . 033 nuclear build core ' C' C ' 326' ' ' GLU . . . . . . . . . . . . . 2.7 mp0 . . . . . 0 N--CA 1.491 1.607 0 N-CA-C 109.608 -0.516 . . . . 2.1699999999999999 109.608 . . . . . . . . . 0 0 . 1 . 033 nuclear build core ' C' C ' 327' ' ' TYR . . . . . 0.638 ' CE2' ' HG2' ' A' ' 333' ' ' ARG . 46.3 m-85 -147.21 104.74 3.69 Favored 'General case' 0 N--CA 1.487 1.413 0 O-C-N 121.263 -0.898 . . . . 0.47999999999999998 109.204 -179.959 . . . . . . . . 2 2 . 1 . 033 nuclear build core ' C' C ' 328' ' ' PHE . . . . . 0.455 ' CE1' ' HA ' ' A' ' 335' ' ' ARG . 67.7 m-85 -106.87 -168.8 1.46 Allowed 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.287 -0.883 . . . . 0.33000000000000002 109.147 -179.915 . . . . . . . . 2 2 . 1 . 033 nuclear build core ' C' C ' 329' ' ' THR . . . . . . . . . . . . . 18.0 p -150.97 167.03 28.85 Favored 'General case' 0 C--N 1.302 -1.498 0 O-C-N 121.472 -0.768 . . . . 0.23000000000000001 108.978 -179.847 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' C' C ' 330' ' ' LEU . . . . . 0.442 HD21 ' HB2' ' A' ' 345' ' ' ASN . 47.0 tp -150.92 127.7 10.93 Favored 'General case' 0 C--N 1.302 -1.488 0 O-C-N 121.2 -0.937 . . . . 0.28000000000000003 109.688 -179.491 . . . . . . . . 2 2 . 1 . 033 nuclear build core ' C' C ' 331' ' ' GLN . . . . . . . . . . . . . 5.4 tp60 -86.71 113.41 22.54 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.375 -0.828 . . . . 1.48 109.488 179.903 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' C' C ' 332' ' ' ILE . . . . . 0.809 HG21 ' HA ' ' C' ' 338' ' ' PHE . 30.3 mt -105.2 109.49 27.88 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.51 0 O-C-N 121.547 -0.721 . . . . 0.23999999999999999 109.883 -179.853 . . . . . . . . 2 2 . 1 . 033 nuclear build core ' C' C ' 333' ' ' ARG . . . . . . . . . . . . . 79.3 mtt180 -74.23 147.65 42.27 Favored 'General case' 0 C--N 1.302 -1.472 0 O-C-N 121.306 -0.871 . . . . 2.7400000000000002 109.635 179.781 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' C' C ' 334' ' ' GLY . . . . . . . . . . . . . . . 80.23 127.0 0.67 Allowed Glycine 0 N--CA 1.486 1.987 0 N-CA-C 109.361 -1.495 . . . . 0.34999999999999998 109.361 -179.857 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' C' C ' 335' ' ' ARG . . . . . 0.566 ' HB2' ' CZ ' ' A' ' 328' ' ' PHE . 0.0 OUTLIER -78.35 -33.12 49.29 Favored 'General case' 0 N--CA 1.487 1.412 0 O-C-N 121.201 -1.176 . . . . 2.5299999999999998 109.463 179.972 . . . . . . . . 3 3 . 1 . 033 nuclear build core ' C' C ' 336' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -57.52 -62.56 1.7 Allowed 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.127 -0.983 . . . . 2.6200000000000001 108.986 179.567 . . . . . . . . 2 2 . 1 . 033 nuclear build core ' C' C ' 337' ' ' ARG . . . . . 0.541 ' HG2' ' NH1' ' C' ' 337' ' ' ARG . 0.2 OUTLIER -59.52 -31.61 69.55 Favored 'General case' 0 N--CA 1.489 1.483 0 O-C-N 121.745 -0.597 . . . . 2.8100000000000001 109.656 -179.886 . . . . . . . . 3 3 . 1 . 033 nuclear build core ' C' C ' 338' ' ' PHE . . . . . 0.809 ' HA ' HG21 ' C' ' 332' ' ' ILE . 46.3 t80 -54.52 -59.42 4.72 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.171 -0.956 . . . . 0.40000000000000002 109.755 -179.466 . . . . . . . . 2 2 . 1 . 033 nuclear build core ' C' C ' 339' ' ' GLU . . . . . . . . . . . . . 9.9 mm-40 -48.32 -32.65 7.71 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.434 -0.792 . . . . 2.0499999999999998 110.247 -179.333 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' C' C ' 340' ' ' MET . . . . . . . . . . . . . 34.6 ttp -63.91 -50.88 66.96 Favored 'General case' 0 N--CA 1.494 1.742 0 O-C-N 121.251 -0.905 . . . . 0.32000000000000001 109.818 -179.809 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' C' C ' 341' ' ' PHE . . . . . . . . . . . . . 49.7 m-85 -62.83 -52.91 61.3 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 120.959 -1.088 . . . . 0.17999999999999999 109.762 -179.804 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' C' C ' 342' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -47.81 -39.96 19.76 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.442 -0.786 . . . . 2.9100000000000001 110.005 -179.428 . . . . . . . . 2 2 . 1 . 033 nuclear build core ' C' C ' 343' ' ' GLU . . . . . . . . . . . . . 4.5 tp10 -60.8 -44.88 96.27 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 120.974 -1.079 . . . . 2.1400000000000001 109.461 -179.998 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' C' C ' 344' ' ' LEU . . . . . 0.411 ' O ' ' HB3' ' C' ' 347' ' ' ALA . 27.0 mt -60.35 -41.02 92.8 Favored 'General case' 0 N--CA 1.487 1.395 0 O-C-N 121.294 -0.879 . . . . 0.22 109.593 -179.939 . . . . . . . . 2 2 . 1 . 033 nuclear build core ' C' C ' 345' ' ' ASN . . . . . . . . . . . . . 48.9 t-20 -54.61 -53.7 51.24 Favored 'General case' 0 N--CA 1.489 1.488 0 O-C-N 121.313 -0.867 . . . . 1.0800000000000001 109.818 -179.664 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' C' C ' 346' ' ' GLU . . . . . . . . . . . . . 2.9 tp10 -58.58 -29.84 66.72 Favored 'General case' 0 C--N 1.303 -1.449 0 O-C-N 121.108 -0.995 . . . . 2.21 109.362 -179.872 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' C' C ' 347' ' ' ALA . . . . . 0.655 ' HB1' ' HB1' ' D' ' 347' ' ' ALA . . . -63.12 -51.82 65.0 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.16 -0.962 . . . . 0.17999999999999999 109.766 179.943 . . . . . . . . 2 2 . 1 . 033 nuclear build core ' C' C ' 348' ' ' LEU . . . . . 0.619 ' N ' HD22 ' C' ' 348' ' ' LEU . 3.6 mm? -62.88 -43.6 98.35 Favored 'General case' 0 N--CA 1.494 1.743 0 O-C-N 121.04 -1.038 . . . . 0.32000000000000001 109.773 -179.619 . . . . . . . . 2 2 . 1 . 033 nuclear build core ' C' C ' 349' ' ' GLU . . . . . . . . . . . . . 3.1 mm-40 -59.25 -36.82 76.19 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.284 -0.885 . . . . 2.1899999999999999 110.085 -179.376 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' C' C ' 350' ' ' LEU . . . . . 0.614 HD13 HD22 ' D' ' 350' ' ' LEU . 5.5 tt -62.75 -48.91 77.13 Favored 'General case' 0 C--N 1.302 -1.466 0 O-C-N 121.12 -0.987 . . . . 0.46000000000000002 109.29 -179.775 . . . . . . . . 2 2 . 1 . 033 nuclear build core ' C' C ' 351' ' ' LYS . . . . . . . . . . . . . 27.4 tttm -58.23 -39.66 79.67 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.198 -0.939 . . . . 1.3500000000000001 109.06 179.662 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' C' C ' 352' ' ' ASP . . . . . . . . . . . . . 96.2 m-20 -54.44 -31.7 55.96 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.334 -0.853 . . . . 1.1899999999999999 109.579 179.888 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' C' C ' 353' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 1.615 0 O-C-N 121.42 -0.8 . . . . 0.56999999999999995 109.631 -179.626 . . . . . . . . 0 0 . 1 . 033 nuclear build core ' D' D ' 326' ' ' GLU . . . . . . . . . . . . . 41.3 mm-40 . . . . . 0 N--CA 1.489 1.511 0 CA-C-O 121.407 0.622 . . . . 2.1299999999999999 109.65 . . . . . . . . . 0 0 . 1 . 033 nuclear build core ' D' D ' 327' ' ' TYR . . . . . 0.63 ' CE1' ' HG2' ' B' ' 333' ' ' ARG . 41.0 m-85 -148.78 105.49 3.56 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.281 -0.887 . . . . 0.46999999999999997 109.7 179.989 . . . . . . . . 2 2 . 1 . 033 nuclear build core ' D' D ' 328' ' ' PHE . . . . . 0.404 ' C ' HG23 ' D' ' 329' ' ' THR . 22.1 m-85 -112.95 -165.44 0.99 Allowed 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.371 -0.83 . . . . 0.29999999999999999 109.176 179.582 . . . . . . . . 2 2 . 1 . 033 nuclear build core ' D' D ' 329' ' ' THR . . . . . 0.47 ' HA ' ' O ' ' B' ' 330' ' ' LEU . 78.3 p -154.02 173.87 15.42 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.194 -0.941 . . . . 0.22 109.257 179.783 . . . . . . . . 2 2 . 1 . 033 nuclear build core ' D' D ' 330' ' ' LEU . . . . . 0.497 HD21 ' HB2' ' B' ' 345' ' ' ASN . 21.5 tp -150.58 129.81 12.78 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.265 -0.897 . . . . 0.28000000000000003 109.212 179.639 . . . . . . . . 2 2 . 1 . 033 nuclear build core ' D' D ' 331' ' ' GLN . . . . . . . . . . . . . 1.1 tt0 -86.98 112.83 22.21 Favored 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.165 -0.959 . . . . 0.93000000000000005 109.331 179.756 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' D' D ' 332' ' ' ILE . . . . . 0.847 HG21 ' HA ' ' D' ' 338' ' ' PHE . 73.5 mt -103.94 107.56 22.58 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.505 0 O-C-N 121.108 -0.995 . . . . 0.25 109.671 -179.784 . . . . . . . . 2 2 . 1 . 033 nuclear build core ' D' D ' 333' ' ' ARG . . . . . 0.627 ' HG2' ' CE1' ' B' ' 327' ' ' TYR . 32.2 mtt180 -74.1 148.27 41.99 Favored 'General case' 0 C--N 1.304 -1.37 0 O-C-N 121.413 -0.804 . . . . 2.9300000000000002 109.672 -179.886 . . . . . . . . 2 2 . 1 . 033 nuclear build core ' D' D ' 334' ' ' GLY . . . . . . . . . . . . . . . 82.84 134.48 2.17 Favored Glycine 0 N--CA 1.486 1.978 0 N-CA-C 109.598 -1.401 . . . . 0.40999999999999998 109.598 179.988 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' D' D ' 335' ' ' ARG . . . . . 0.403 HH11 ' HG3' ' D' ' 335' ' ' ARG . 0.0 OUTLIER -79.88 -40.8 27.54 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.4 -1.059 . . . . 3.0299999999999998 109.69 -179.795 . . . . . . . . 3 3 . 1 . 033 nuclear build core ' D' D ' 336' ' ' GLU . . . . . . . . . . . . . 1.7 mt-10 -58.66 -59.12 5.9 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.221 -0.924 . . . . 2.2599999999999998 110.044 -179.717 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' D' D ' 337' ' ' ARG . . . . . 0.447 ' CG ' HH11 ' D' ' 337' ' ' ARG . 0.0 OUTLIER -59.53 -31.91 69.83 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.142 -0.974 . . . . 2.9199999999999999 109.756 -179.657 . . . . . . . . 3 3 . 1 . 033 nuclear build core ' D' D ' 338' ' ' PHE . . . . . 0.847 ' HA ' HG21 ' D' ' 332' ' ' ILE . 46.7 t80 -55.66 -56.7 17.27 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.259 -0.901 . . . . 0.37 109.783 -179.957 . . . . . . . . 2 2 . 1 . 033 nuclear build core ' D' D ' 339' ' ' GLU . . . . . . . . . . . . . 44.1 mt-10 -50.72 -32.75 20.45 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.059 -1.026 . . . . 1.99 109.735 -179.87 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' D' D ' 340' ' ' MET . . . . . . . . . . . . . 17.3 ttp -62.49 -52.66 62.61 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.187 -0.945 . . . . 0.31 109.99 -179.535 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' D' D ' 341' ' ' PHE . . . . . 0.406 ' HB2' HD13 ' D' ' 332' ' ' ILE . 40.2 m-85 -62.32 -51.14 68.85 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.184 -0.948 . . . . 0.17999999999999999 109.773 -179.814 . . . . . . . . 2 2 . 1 . 033 nuclear build core ' D' D ' 342' ' ' ARG . . . . . . . . . . . . . 4.1 ttt180 -45.17 -39.51 6.22 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.284 -0.885 . . . . 2.4100000000000001 109.92 -179.76 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' D' D ' 343' ' ' GLU . . . . . . . . . . . . . 60.1 tt0 -60.96 -48.48 81.64 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.136 -0.977 . . . . 2.3500000000000001 110.213 -179.675 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' D' D ' 344' ' ' LEU . . . . . 0.411 HD22 ' CD2' ' C' ' 344' ' ' LEU . 49.7 mt -62.13 -33.06 73.77 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.052 -1.03 . . . . 0.19 109.878 -179.459 . . . . . . . . 2 2 . 1 . 033 nuclear build core ' D' D ' 345' ' ' ASN . . . . . 0.501 ' HB2' HD21 ' B' ' 330' ' ' LEU . 14.3 t-20 -56.96 -56.51 20.74 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.299 -0.875 . . . . 1.0900000000000001 109.558 -179.582 . . . . . . . . 2 2 . 1 . 033 nuclear build core ' D' D ' 346' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -60.85 -29.1 69.32 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.192 -0.942 . . . . 1.6899999999999999 110.133 -179.716 . . . . . . . . 2 2 . 1 . 033 nuclear build core ' D' D ' 347' ' ' ALA . . . . . 0.655 ' HB1' ' HB1' ' C' ' 347' ' ' ALA . . . -59.7 -58.53 8.17 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.152 -0.968 . . . . 0.17999999999999999 110.254 -179.502 . . . . . . . . 2 2 . 1 . 033 nuclear build core ' D' D ' 348' ' ' LEU . . . . . 0.598 HD22 ' N ' ' D' ' 348' ' ' LEU . 4.1 mm? -62.02 -42.18 98.88 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.157 -0.964 . . . . 0.31 110.069 -179.256 . . . . . . . . 2 2 . 1 . 033 nuclear build core ' D' D ' 349' ' ' GLU . . . . . . . . . . . . . 9.1 mm-40 -58.6 -34.26 70.92 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.033 -1.042 . . . . 1.95 110.132 -179.349 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' D' D ' 350' ' ' LEU . . . . . 0.614 HD22 HD13 ' C' ' 350' ' ' LEU . 6.4 tt -64.0 -45.15 90.24 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.248 -0.907 . . . . 0.42999999999999999 109.499 -179.633 . . . . . . . . 2 2 . 1 . 033 nuclear build core ' D' D ' 351' ' ' LYS . . . . . . . . . . . . . 48.2 tttt -59.5 -46.08 89.85 Favored 'General case' 0 N--CA 1.488 1.448 0 O-C-N 121.292 -0.88 . . . . 1.3999999999999999 109.676 -179.825 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' D' D ' 352' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -55.27 -45.01 76.14 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.338 -0.851 . . . . 1.1699999999999999 110.119 -179.419 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' D' D ' 353' ' ' ALA . . . . . . . . . . . . . . . -66.71 -29.41 69.39 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 120.794 -1.192 . . . . 0.58999999999999997 109.576 -179.678 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' D' D ' 354' ' ' GLN . . . . . . . . . . . . . 40.8 tt0 . . . . . 0 N--CA 1.489 1.481 0 O-C-N 121.208 -0.933 . . . . 1.4399999999999999 109.798 -179.769 . . . . . . . . 0 0 . 1 . 034 nuclear build core ' A' A ' 326' ' ' GLU . . . . . . . . . . . . . 4.2 mt-10 . . . . . 0 N--CA 1.487 1.409 0 N-CA-C 109.404 -0.591 . . . . 2.1299999999999999 109.404 . . . . . . . . . 0 0 . 1 . 034 nuclear build core ' A' A ' 327' ' ' TYR . . . . . 0.55 ' CE1' ' HG3' ' C' ' 333' ' ' ARG . 39.0 m-85 -148.96 109.81 4.29 Favored 'General case' 0 N--CA 1.489 1.478 0 O-C-N 121.35 -0.844 . . . . 0.47999999999999998 109.463 179.9 . . . . . . . . 2 2 . 1 . 034 nuclear build core ' A' A ' 328' ' ' PHE . . . . . 0.41 ' CE2' ' HA ' ' C' ' 335' ' ' ARG . 88.0 m-85 -113.64 -169.41 1.5 Allowed 'General case' 0 C--N 1.302 -1.464 0 O-C-N 121.353 -0.842 . . . . 0.31 108.934 179.772 . . . . . . . . 2 2 . 1 . 034 nuclear build core ' A' A ' 329' ' ' THR . . . . . . . . . . . . . 23.5 p -153.15 169.77 22.16 Favored 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.013 -1.055 . . . . 0.22 109.517 -179.97 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 330' ' ' LEU . . . . . 0.484 HD21 ' HB2' ' C' ' 345' ' ' ASN . 17.4 tp -150.83 127.2 10.68 Favored 'General case' 0 N--CA 1.488 1.46 0 O-C-N 121.288 -0.882 . . . . 0.28000000000000003 109.529 -179.809 . . . . . . . . 2 2 . 1 . 034 nuclear build core ' A' A ' 331' ' ' GLN . . . . . 0.449 ' OE1' ' O ' ' C' ' 328' ' ' PHE . 3.7 tp-100 -87.77 119.91 28.57 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.19 -0.944 . . . . 0.91000000000000003 109.401 179.846 . . . . . . . . 2 2 . 1 . 034 nuclear build core ' A' A ' 332' ' ' ILE . . . . . 0.619 HG21 ' HA ' ' A' ' 338' ' ' PHE . 97.9 mt -103.38 107.99 23.41 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.596 0 O-C-N 121.299 -0.875 . . . . 0.26000000000000001 109.519 179.898 . . . . . . . . 2 2 . 1 . 034 nuclear build core ' A' A ' 333' ' ' ARG . . . . . 0.488 ' HG2' ' CE2' ' C' ' 327' ' ' TYR . 1.4 mtt-85 -72.18 131.54 42.91 Favored 'General case' 0 N--CA 1.488 1.463 0 O-C-N 121.206 -0.934 . . . . 2.9199999999999999 109.569 -179.988 . . . . . . . . 2 2 . 1 . 034 nuclear build core ' A' A ' 334' ' ' GLY . . . . . . . . . . . . . . . 87.71 138.88 6.02 Favored Glycine 0 N--CA 1.49 2.298 0 N-CA-C 109.809 -1.316 . . . . 0.40000000000000002 109.809 179.817 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 335' ' ' ARG . . . . . 0.429 ' O ' ' HB3' ' A' ' 338' ' ' PHE . 37.5 ttt180 -79.78 -29.04 40.27 Favored 'General case' 0 N--CA 1.489 1.488 0 O-C-N 121.316 -1.108 . . . . 3.0099999999999998 109.676 -179.978 . . . . . . . . 2 2 . 1 . 034 nuclear build core ' A' A ' 336' ' ' GLU . . . . . . . . . . . . . 38.7 mt-10 -56.45 -61.95 2.06 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.211 -0.93 . . . . 2.29 109.843 -179.732 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 337' ' ' ARG . . . . . 0.487 ' CZ ' HD12 ' C' ' 348' ' ' LEU . 0.0 OUTLIER -60.52 -26.67 67.02 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.151 -0.968 . . . . 2.9300000000000002 109.686 -179.776 . . . . . . . . 3 3 . 1 . 034 nuclear build core ' A' A ' 338' ' ' PHE . . . . . 0.619 ' HA ' HG21 ' A' ' 332' ' ' ILE . 91.5 t80 -56.31 -53.58 55.57 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.163 -0.961 . . . . 0.38 110.01 -179.694 . . . . . . . . 2 2 . 1 . 034 nuclear build core ' A' A ' 339' ' ' GLU . . . . . . . . . . . . . 6.8 mt-10 -54.6 -39.52 67.95 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.019 -1.05 . . . . 1.97 110.533 -179.369 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 340' ' ' MET . . . . . . . . . . . . . 30.9 ttp -64.37 -53.4 49.15 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.044 -1.035 . . . . 0.31 110.877 -178.788 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 341' ' ' PHE . . . . . 0.551 ' CZ ' ' HA ' ' C' ' 345' ' ' ASN . 56.7 m-85 -60.57 -48.71 80.58 Favored 'General case' 0 N--CA 1.494 1.761 0 O-C-N 120.91 -1.119 . . . . 0.17999999999999999 110.291 -179.018 . . . . . . . . 2 2 . 1 . 034 nuclear build core ' A' A ' 342' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -48.9 -44.4 40.09 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.075 -1.016 . . . . 2.4199999999999999 110.136 -179.6 . . . . . . . . 2 2 . 1 . 034 nuclear build core ' A' A ' 343' ' ' GLU . . . . . . . . . . . . . 2.1 tp10 -57.81 -41.99 83.33 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.102 -0.999 . . . . 2.3500000000000001 109.745 -179.585 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 344' ' ' LEU . . . . . . . . . . . . . 45.8 mt -63.63 -47.16 82.48 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.173 -0.955 . . . . 0.17999999999999999 109.92 -179.828 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 345' ' ' ASN . . . . . 0.642 ' HB2' HD21 ' C' ' 330' ' ' LEU . 39.3 t-20 -54.83 -48.3 73.01 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.16 -0.962 . . . . 1.0900000000000001 109.737 -179.616 . . . . . . . . 2 2 . 1 . 034 nuclear build core ' A' A ' 346' ' ' GLU . . . . . . . . . . . . . 56.5 tt0 -61.83 -35.88 79.53 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.194 -0.941 . . . . 1.6499999999999999 109.749 -179.882 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 347' ' ' ALA . . . . . 0.689 ' HB1' ' HB1' ' B' ' 347' ' ' ALA . . . -59.94 -55.83 29.26 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.249 -0.907 . . . . 0.17999999999999999 110.049 -179.623 . . . . . . . . 2 2 . 1 . 034 nuclear build core ' A' A ' 348' ' ' LEU . . . . . 0.587 HD22 ' N ' ' A' ' 348' ' ' LEU . 3.8 mm? -60.02 -41.72 92.79 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.199 -0.938 . . . . 0.29999999999999999 109.655 -179.653 . . . . . . . . 2 2 . 1 . 034 nuclear build core ' A' A ' 349' ' ' GLU . . . . . . . . . . . . . 88.3 mt-10 -58.6 -33.48 70.04 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.254 -0.903 . . . . 1.9399999999999999 109.785 -179.694 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 350' ' ' LEU . . . . . 0.623 HD23 ' O ' ' A' ' 350' ' ' LEU . 5.3 tt -63.16 -49.13 75.54 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.201 -0.937 . . . . 0.46000000000000002 109.162 179.944 . . . . . . . . 2 2 . 1 . 034 nuclear build core ' A' A ' 351' ' ' LYS . . . . . . . . . . . . . 6.5 ttmm -58.49 -44.79 89.51 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.259 -0.901 . . . . 1.3999999999999999 109.303 -179.989 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 352' ' ' ASP . . . . . . . . . . . . . 14.5 m-20 -57.04 -42.95 81.45 Favored 'General case' 0 N--CA 1.489 1.484 0 O-C-N 121.319 -0.863 . . . . 1.1599999999999999 109.676 179.922 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 353' ' ' ALA . . . . . . . . . . . . . . . -67.35 -22.08 65.6 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.277 -0.889 . . . . 0.63 109.691 -179.787 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 354' ' ' GLN . . . . . 0.453 ' OE1' HD11 ' B' ' 350' ' ' LEU . 2.0 tt0 . . . . . 0 N--CA 1.488 1.475 0 O-C-N 121.237 -0.914 . . . . 1.47 109.274 179.944 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' B' B ' 326' ' ' GLU . . . . . . . . . . . . . 4.4 mt-10 . . . . . 0 N--CA 1.489 1.482 0 CA-C-O 121.345 0.593 . . . . 2.1299999999999999 109.497 . . . . . . . . . 0 0 . 1 . 034 nuclear build core ' B' B ' 327' ' ' TYR . . . . . . . . . . . . . 39.3 m-85 -148.92 109.73 4.28 Favored 'General case' 0 N--CA 1.489 1.49 0 O-C-N 121.353 -0.842 . . . . 0.47999999999999998 109.51 179.854 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' B' B ' 328' ' ' PHE . . . . . 0.403 ' O ' HG23 ' B' ' 329' ' ' THR . 87.8 m-85 -113.61 -169.25 1.47 Allowed 'General case' 0 C--N 1.301 -1.522 0 O-C-N 121.305 -0.872 . . . . 0.32000000000000001 108.965 179.748 . . . . . . . . 2 2 . 1 . 034 nuclear build core ' B' B ' 329' ' ' THR . . . . . 0.403 HG23 ' O ' ' B' ' 328' ' ' PHE . 23.8 p -153.37 169.1 23.94 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.072 -1.017 . . . . 0.23000000000000001 109.728 -179.776 . . . . . . . . 2 2 . 1 . 034 nuclear build core ' B' B ' 330' ' ' LEU . . . . . 0.551 HD21 ' HB2' ' D' ' 345' ' ' ASN . 17.2 tp -150.61 126.89 10.64 Favored 'General case' 0 N--CA 1.488 1.452 0 O-C-N 121.262 -0.899 . . . . 0.28000000000000003 109.592 -179.768 . . . . . . . . 2 2 . 1 . 034 nuclear build core ' B' B ' 331' ' ' GLN . . . . . 0.439 ' OE1' ' O ' ' D' ' 328' ' ' PHE . 3.7 tp-100 -87.2 120.07 28.1 Favored 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.253 -0.904 . . . . 0.91000000000000003 109.378 179.876 . . . . . . . . 2 2 . 1 . 034 nuclear build core ' B' B ' 332' ' ' ILE . . . . . 0.615 HG21 ' HA ' ' B' ' 338' ' ' PHE . 97.9 mt -103.56 107.92 23.31 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.564 0 O-C-N 121.136 -0.978 . . . . 0.23999999999999999 109.433 179.867 . . . . . . . . 2 2 . 1 . 034 nuclear build core ' B' B ' 333' ' ' ARG . . . . . 0.454 HH11 ' CG ' ' B' ' 333' ' ' ARG . 1.4 mtt-85 -72.2 131.67 43.07 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.267 -0.896 . . . . 2.9300000000000002 109.439 -179.979 . . . . . . . . 2 2 . 1 . 034 nuclear build core ' B' B ' 334' ' ' GLY . . . . . . . . . . . . . . . 88.18 138.58 6.17 Favored Glycine 0 N--CA 1.49 2.27 0 N-CA-C 109.749 -1.341 . . . . 0.40000000000000002 109.749 179.704 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' B' B ' 335' ' ' ARG . . . . . 0.445 ' O ' ' HB3' ' B' ' 338' ' ' PHE . 39.1 ttt180 -79.88 -28.85 39.87 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.313 -1.11 . . . . 3.0099999999999998 109.655 179.991 . . . . . . . . 2 2 . 1 . 034 nuclear build core ' B' B ' 336' ' ' GLU . . . . . . . . . . . . . 39.3 mt-10 -56.74 -61.77 2.2 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.309 -0.869 . . . . 2.2799999999999998 109.811 -179.67 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' B' B ' 337' ' ' ARG . . . . . 0.497 ' NH1' ' HG2' ' B' ' 337' ' ' ARG . 0.0 OUTLIER -60.54 -27.06 67.36 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.314 -0.866 . . . . 2.9300000000000002 109.602 -179.8 . . . . . . . . 3 3 . 1 . 034 nuclear build core ' B' B ' 338' ' ' PHE . . . . . 0.615 ' HA ' HG21 ' B' ' 332' ' ' ILE . 91.4 t80 -56.11 -53.64 54.61 Favored 'General case' 0 C--N 1.303 -1.418 0 O-C-N 121.199 -0.938 . . . . 0.37 110.045 -179.623 . . . . . . . . 2 2 . 1 . 034 nuclear build core ' B' B ' 339' ' ' GLU . . . . . . . . . . . . . 7.0 mt-10 -54.75 -39.46 68.34 Favored 'General case' 0 N--CA 1.494 1.769 0 O-C-N 121.073 -1.017 . . . . 1.98 110.679 -179.459 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' B' B ' 340' ' ' MET . . . . . . . . . . . . . 30.5 ttp -64.12 -53.47 49.03 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 120.946 -1.096 . . . . 0.32000000000000001 110.89 -178.845 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' B' B ' 341' ' ' PHE . . . . . 0.446 ' CZ ' ' HA ' ' D' ' 345' ' ' ASN . 56.2 m-85 -60.72 -48.15 83.1 Favored 'General case' 0 N--CA 1.494 1.725 0 O-C-N 120.96 -1.087 . . . . 0.17999999999999999 110.412 -178.983 . . . . . . . . 2 2 . 1 . 034 nuclear build core ' B' B ' 342' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -49.58 -43.85 46.48 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.137 -0.977 . . . . 2.4199999999999999 110.124 -179.579 . . . . . . . . 2 2 . 1 . 034 nuclear build core ' B' B ' 343' ' ' GLU . . . . . . . . . . . . . 2.1 tp10 -57.99 -42.46 85.19 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.178 -0.951 . . . . 2.3500000000000001 109.607 -179.665 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' B' B ' 344' ' ' LEU . . . . . . . . . . . . . 46.5 mt -63.5 -47.06 83.27 Favored 'General case' 0 N--CA 1.488 1.473 0 O-C-N 121.306 -0.871 . . . . 0.17999999999999999 109.931 -179.722 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' B' B ' 345' ' ' ASN . . . . . 0.582 ' HB2' HD21 ' D' ' 330' ' ' LEU . 0.5 OUTLIER -55.06 -47.95 74.14 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.123 -0.986 . . . . 1.0900000000000001 109.679 -179.615 . . . . . . . . 3 3 . 1 . 034 nuclear build core ' B' B ' 346' ' ' GLU . . . . . . . . . . . . . 56.3 tt0 -61.99 -35.86 79.77 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.118 -0.989 . . . . 1.6599999999999999 109.661 -179.863 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' B' B ' 347' ' ' ALA . . . . . 0.689 ' HB1' ' HB1' ' A' ' 347' ' ' ALA . . . -59.93 -55.37 34.88 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.293 -0.879 . . . . 0.17000000000000001 110.184 -179.478 . . . . . . . . 2 2 . 1 . 034 nuclear build core ' B' B ' 348' ' ' LEU . . . . . 0.576 HD22 ' N ' ' B' ' 348' ' ' LEU . 3.8 mm? -60.72 -41.0 94.38 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.214 -0.929 . . . . 0.28999999999999998 109.678 -179.595 . . . . . . . . 2 2 . 1 . 034 nuclear build core ' B' B ' 349' ' ' GLU . . . . . . . . . . . . . 86.8 mt-10 -59.05 -33.07 70.34 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.269 -0.894 . . . . 1.95 109.75 -179.729 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' B' B ' 350' ' ' LEU . . . . . 0.616 HD23 ' O ' ' B' ' 350' ' ' LEU . 5.3 tt -63.67 -48.97 75.02 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.192 -0.942 . . . . 0.45000000000000001 109.286 179.882 . . . . . . . . 2 2 . 1 . 034 nuclear build core ' B' B ' 351' ' ' LYS . . . . . . . . . . . . . 6.2 ttmm -58.5 -44.76 89.56 Favored 'General case' 0 N--CA 1.489 1.483 0 O-C-N 121.309 -0.869 . . . . 1.3799999999999999 109.254 179.894 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' B' B ' 352' ' ' ASP . . . . . . . . . . . . . 16.6 m-20 -57.18 -43.04 82.26 Favored 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.305 -0.872 . . . . 1.1599999999999999 109.549 179.956 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' B' B ' 353' ' ' ALA . . . . . . . . . . . . . . . -67.32 -21.92 65.64 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.228 -0.92 . . . . 0.60999999999999999 109.585 -179.776 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' B' B ' 354' ' ' GLN . . . . . . . . . . . . . 2.0 tt0 . . . . . 0 N--CA 1.488 1.471 0 O-C-N 121.246 -0.909 . . . . 1.45 109.52 179.913 . . . . . . . . 0 0 . 1 . 034 nuclear build core ' C' C ' 326' ' ' GLU . . . . . . . . . . . . . 10.3 mt-10 . . . . . 0 N--CA 1.49 1.559 0 CA-C-O 121.41 0.624 . . . . 2.1699999999999999 110.134 . . . . . . . . . 0 0 . 1 . 034 nuclear build core ' C' C ' 327' ' ' TYR . . . . . 0.488 ' CE2' ' HG2' ' A' ' 333' ' ' ARG . 40.3 m-85 -148.03 116.5 6.61 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.482 -0.761 . . . . 0.47999999999999998 109.248 -179.945 . . . . . . . . 2 2 . 1 . 034 nuclear build core ' C' C ' 328' ' ' PHE . . . . . 0.449 ' O ' ' OE1' ' A' ' 331' ' ' GLN . 72.1 m-85 -113.29 -170.15 1.63 Allowed 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.176 -0.952 . . . . 0.33000000000000002 109.49 -179.889 . . . . . . . . 2 2 . 1 . 034 nuclear build core ' C' C ' 329' ' ' THR . . . . . 0.428 ' HA ' ' O ' ' A' ' 330' ' ' LEU . 17.8 p -152.66 168.22 26.36 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.266 -0.896 . . . . 0.23000000000000001 109.483 -179.913 . . . . . . . . 2 2 . 1 . 034 nuclear build core ' C' C ' 330' ' ' LEU . . . . . 0.642 HD21 ' HB2' ' A' ' 345' ' ' ASN . 16.5 tp -150.99 125.42 9.49 Favored 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.25 -0.906 . . . . 0.28000000000000003 109.567 -179.677 . . . . . . . . 2 2 . 1 . 034 nuclear build core ' C' C ' 331' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -88.91 113.16 24.15 Favored 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.224 -0.923 . . . . 1.48 109.522 179.965 . . . . . . . . 2 2 . 1 . 034 nuclear build core ' C' C ' 332' ' ' ILE . . . . . 0.559 HD13 ' CD2' ' C' ' 341' ' ' PHE . 42.0 mt -104.12 113.9 42.29 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.631 0 O-C-N 121.171 -0.955 . . . . 0.23999999999999999 109.589 179.73 . . . . . . . . 2 2 . 1 . 034 nuclear build core ' C' C ' 333' ' ' ARG . . . . . 0.55 ' HG3' ' CE1' ' A' ' 327' ' ' TYR . 0.1 OUTLIER -73.59 144.18 46.1 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.195 -0.941 . . . . 2.7400000000000002 109.586 179.868 . . . . . . . . 3 3 . 1 . 034 nuclear build core ' C' C ' 334' ' ' GLY . . . . . . . . . . . . . . . 88.11 135.74 5.07 Favored Glycine 0 N--CA 1.493 2.465 0 N-CA-C 110.033 -1.227 . . . . 0.34999999999999998 110.033 179.629 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' C' C ' 335' ' ' ARG . . . . . 0.454 ' O ' ' HB3' ' C' ' 338' ' ' PHE . 13.2 ttm180 -80.44 -41.49 24.38 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.384 -1.068 . . . . 2.5299999999999998 109.704 179.938 . . . . . . . . 2 2 . 1 . 034 nuclear build core ' C' C ' 336' ' ' GLU . . . . . . . . . . . . . 4.2 mt-10 -56.46 -53.7 54.38 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.245 -0.91 . . . . 2.6200000000000001 109.5 -179.778 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' C' C ' 337' ' ' ARG . . . . . 0.426 HH11 ' HG3' ' C' ' 337' ' ' ARG . 0.1 OUTLIER -60.24 -33.61 72.52 Favored 'General case' 0 N--CA 1.489 1.499 0 O-C-N 121.149 -0.969 . . . . 2.8100000000000001 109.128 179.782 . . . . . . . . 3 3 . 1 . 034 nuclear build core ' C' C ' 338' ' ' PHE . . . . . 0.454 ' HB3' ' O ' ' C' ' 335' ' ' ARG . 86.6 t80 -56.33 -55.39 34.04 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.418 -0.801 . . . . 0.40000000000000002 109.768 179.839 . . . . . . . . 2 2 . 1 . 034 nuclear build core ' C' C ' 339' ' ' GLU . . . . . . . . . . . . . 47.6 mt-10 -50.13 -35.99 28.07 Favored 'General case' 0 N--CA 1.494 1.748 0 O-C-N 121.255 -0.903 . . . . 2.0499999999999998 110.131 -179.75 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' C' C ' 340' ' ' MET . . . . . . . . . . . . . 37.0 ttp -63.98 -52.41 59.75 Favored 'General case' 0 N--CA 1.493 1.717 0 O-C-N 121.199 -0.938 . . . . 0.32000000000000001 110.608 -179.153 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' C' C ' 341' ' ' PHE . . . . . 0.559 ' CD2' HD13 ' C' ' 332' ' ' ILE . 50.3 m-85 -61.73 -44.38 97.02 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.216 -0.928 . . . . 0.17999999999999999 110.509 -178.976 . . . . . . . . 2 2 . 1 . 034 nuclear build core ' C' C ' 342' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -50.39 -43.25 54.46 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 120.99 -1.069 . . . . 2.9100000000000001 110.285 -179.491 . . . . . . . . 2 2 . 1 . 034 nuclear build core ' C' C ' 343' ' ' GLU . . . . . . . . . . . . . 80.1 tt0 -59.07 -45.55 90.54 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.121 -0.987 . . . . 2.1400000000000001 110.057 -179.388 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' C' C ' 344' ' ' LEU . . . . . . . . . . . . . 65.2 mt -62.87 -43.97 97.38 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.155 -0.966 . . . . 0.22 110.125 -179.502 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' C' C ' 345' ' ' ASN . . . . . 0.551 ' HA ' ' CZ ' ' A' ' 341' ' ' PHE . 64.6 t-20 -57.03 -51.23 70.1 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.171 -0.956 . . . . 1.0800000000000001 109.868 -179.518 . . . . . . . . 2 2 . 1 . 034 nuclear build core ' C' C ' 346' ' ' GLU . . . . . . . . . . . . . 10.8 tt0 -60.53 -30.52 69.8 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.089 -1.007 . . . . 2.21 109.431 -179.875 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' C' C ' 347' ' ' ALA . . . . . 0.824 ' HB1' ' HB1' ' D' ' 347' ' ' ALA . . . -60.23 -58.07 10.1 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.282 -0.886 . . . . 0.17999999999999999 109.981 -179.946 . . . . . . . . 2 2 . 1 . 034 nuclear build core ' C' C ' 348' ' ' LEU . . . . . 0.634 ' N ' HD22 ' C' ' 348' ' ' LEU . 4.0 mm? -61.66 -40.86 96.44 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.21 -0.931 . . . . 0.32000000000000001 109.659 -179.7 . . . . . . . . 2 2 . 1 . 034 nuclear build core ' C' C ' 349' ' ' GLU . . . . . . . . . . . . . 53.3 mm-40 -56.99 -36.11 70.0 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.223 -0.923 . . . . 2.1899999999999999 109.552 -179.878 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' C' C ' 350' ' ' LEU . . . . . 0.783 HD13 HD22 ' D' ' 350' ' ' LEU . 4.5 tt -63.05 -47.1 84.43 Favored 'General case' 0 N--CA 1.488 1.46 0 O-C-N 121.236 -0.915 . . . . 0.46000000000000002 109.227 179.996 . . . . . . . . 2 2 . 1 . 034 nuclear build core ' C' C ' 351' ' ' LYS . . . . . . . . . . . . . 16.8 tttm -59.66 -42.11 92.09 Favored 'General case' 0 N--CA 1.49 1.525 0 O-C-N 121.211 -0.93 . . . . 1.3500000000000001 109.547 179.879 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' C' C ' 352' ' ' ASP . . . . . . . . . . . . . 86.2 m-20 -56.13 -38.34 70.68 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.272 -0.893 . . . . 1.1899999999999999 109.655 -179.941 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' C' C ' 353' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 1.625 0 O-C-N 121.24 -0.912 . . . . 0.56999999999999995 109.613 -179.645 . . . . . . . . 0 0 . 1 . 034 nuclear build core ' D' D ' 326' ' ' GLU . . . . . . . . . . . . . 4.7 mt-10 . . . . . 0 N--CA 1.489 1.5 0 CA-C-O 121.339 0.59 . . . . 2.1299999999999999 109.468 . . . . . . . . . 0 0 . 1 . 034 nuclear build core ' D' D ' 327' ' ' TYR . . . . . . . . . . . . . 39.0 m-85 -148.75 109.66 4.29 Favored 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.406 -0.809 . . . . 0.46999999999999997 109.612 179.919 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' D' D ' 328' ' ' PHE . . . . . 0.439 ' O ' ' OE1' ' B' ' 331' ' ' GLN . 88.1 m-85 -113.56 -169.77 1.57 Allowed 'General case' 0 N--CA 1.488 1.467 0 O-C-N 121.268 -0.895 . . . . 0.29999999999999999 109.055 179.76 . . . . . . . . 2 2 . 1 . 034 nuclear build core ' D' D ' 329' ' ' THR . . . . . 0.441 ' HA ' ' O ' ' B' ' 330' ' ' LEU . 23.8 p -153.0 169.2 23.48 Favored 'General case' 0 N--CA 1.489 1.486 0 O-C-N 121.122 -0.986 . . . . 0.22 109.555 -179.845 . . . . . . . . 2 2 . 1 . 034 nuclear build core ' D' D ' 330' ' ' LEU . . . . . 0.582 HD21 ' HB2' ' B' ' 345' ' ' ASN . 17.4 tp -150.72 127.09 10.68 Favored 'General case' 0 N--CA 1.488 1.457 0 O-C-N 121.297 -0.877 . . . . 0.28000000000000003 109.427 -179.737 . . . . . . . . 2 2 . 1 . 034 nuclear build core ' D' D ' 331' ' ' GLN . . . . . . . . . . . . . 3.6 tp-100 -87.42 120.12 28.39 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.266 -0.897 . . . . 0.93000000000000005 109.377 179.862 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' D' D ' 332' ' ' ILE . . . . . 0.625 HG21 ' HA ' ' D' ' 338' ' ' PHE . 97.9 mt -103.36 108.59 24.79 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.566 0 O-C-N 121.184 -0.947 . . . . 0.25 109.354 179.814 . . . . . . . . 2 2 . 1 . 034 nuclear build core ' D' D ' 333' ' ' ARG . . . . . 0.441 HH11 ' CG ' ' D' ' 333' ' ' ARG . 1.5 mtt-85 -72.76 131.81 42.81 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.229 -0.919 . . . . 2.9300000000000002 109.488 -179.953 . . . . . . . . 2 2 . 1 . 034 nuclear build core ' D' D ' 334' ' ' GLY . . . . . . . . . . . . . . . 88.05 138.9 6.23 Favored Glycine 0 N--CA 1.491 2.314 0 N-CA-C 109.648 -1.381 . . . . 0.40999999999999998 109.648 179.741 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' D' D ' 335' ' ' ARG . . . . . 0.446 ' O ' ' HB3' ' D' ' 338' ' ' PHE . 40.7 ttt180 -80.12 -29.08 38.89 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.284 -1.127 . . . . 3.0299999999999998 109.594 -179.906 . . . . . . . . 2 2 . 1 . 034 nuclear build core ' D' D ' 336' ' ' GLU . . . . . . . . . . . . . 41.1 mt-10 -56.41 -62.29 1.82 Allowed 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.306 -0.871 . . . . 2.2599999999999998 109.78 -179.715 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' D' D ' 337' ' ' ARG . . . . . 0.465 ' NH1' ' HG2' ' D' ' 337' ' ' ARG . 0.0 OUTLIER -59.92 -27.23 66.59 Favored 'General case' 0 N--CA 1.489 1.501 0 O-C-N 121.238 -0.914 . . . . 2.9199999999999999 109.68 -179.813 . . . . . . . . 3 3 . 1 . 034 nuclear build core ' D' D ' 338' ' ' PHE . . . . . 0.625 ' HA ' HG21 ' D' ' 332' ' ' ILE . 91.5 t80 -55.81 -54.26 46.68 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.175 -0.953 . . . . 0.37 109.923 -179.749 . . . . . . . . 2 2 . 1 . 034 nuclear build core ' D' D ' 339' ' ' GLU . . . . . . . . . . . . . 6.9 mt-10 -54.04 -39.6 66.35 Favored 'General case' 0 N--CA 1.494 1.759 0 O-C-N 121.095 -1.003 . . . . 1.99 110.68 -179.345 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' D' D ' 340' ' ' MET . . . . . . . . . . . . . 30.0 ttp -64.43 -53.16 52.8 Favored 'General case' 0 N--CA 1.495 1.785 0 O-C-N 121.061 -1.025 . . . . 0.31 110.862 -178.703 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' D' D ' 341' ' ' PHE . . . . . 0.563 ' CZ ' ' HA ' ' B' ' 345' ' ' ASN . 56.8 m-85 -60.83 -48.43 81.82 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 120.958 -1.089 . . . . 0.17999999999999999 110.364 -179.084 . . . . . . . . 2 2 . 1 . 034 nuclear build core ' D' D ' 342' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -49.28 -44.06 43.64 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.155 -0.965 . . . . 2.4100000000000001 110.054 -179.58 . . . . . . . . 2 2 . 1 . 034 nuclear build core ' D' D ' 343' ' ' GLU . . . . . . . . . . . . . 2.1 tp10 -57.88 -42.5 84.72 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.101 -0.999 . . . . 2.3500000000000001 109.652 -179.657 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' D' D ' 344' ' ' LEU . . . . . . . . . . . . . 46.4 mt -63.31 -46.97 84.23 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.199 -0.938 . . . . 0.19 109.984 -179.878 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' D' D ' 345' ' ' ASN . . . . . 0.551 ' HB2' HD21 ' B' ' 330' ' ' LEU . 0.5 OUTLIER -55.14 -48.31 73.87 Favored 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.174 -0.954 . . . . 1.0900000000000001 109.672 -179.48 . . . . . . . . 3 3 . 1 . 034 nuclear build core ' D' D ' 346' ' ' GLU . . . . . . . . . . . . . 56.2 tt0 -61.69 -36.0 79.63 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.088 -1.007 . . . . 1.6899999999999999 109.681 179.997 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' D' D ' 347' ' ' ALA . . . . . 0.824 ' HB1' ' HB1' ' C' ' 347' ' ' ALA . . . -59.84 -55.79 29.85 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.185 -0.947 . . . . 0.17999999999999999 110.044 -179.499 . . . . . . . . 2 2 . 1 . 034 nuclear build core ' D' D ' 348' ' ' LEU . . . . . 0.569 HD22 ' N ' ' D' ' 348' ' ' LEU . 3.8 mm? -60.1 -41.24 92.11 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.304 -0.873 . . . . 0.31 109.69 -179.645 . . . . . . . . 2 2 . 1 . 034 nuclear build core ' D' D ' 349' ' ' GLU . . . . . . . . . . . . . 84.6 mt-10 -59.07 -32.99 70.28 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.178 -0.952 . . . . 1.95 109.877 -179.652 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' D' D ' 350' ' ' LEU . . . . . 0.783 HD22 HD13 ' C' ' 350' ' ' LEU . 5.2 tt -63.69 -48.86 75.42 Favored 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.148 -0.97 . . . . 0.42999999999999999 109.184 179.875 . . . . . . . . 2 2 . 1 . 034 nuclear build core ' D' D ' 351' ' ' LYS . . . . . . . . . . . . . 6.0 ttmm -58.67 -44.67 90.25 Favored 'General case' 0 N--CA 1.488 1.431 0 O-C-N 121.347 -0.846 . . . . 1.3999999999999999 109.378 179.881 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' D' D ' 352' ' ' ASP . . . . . . . . . . . . . 20.0 m-20 -57.26 -42.81 82.26 Favored 'General case' 0 N--CA 1.488 1.438 0 O-C-N 121.293 -0.88 . . . . 1.1699999999999999 109.566 179.859 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' D' D ' 353' ' ' ALA . . . . . . . . . . . . . . . -67.58 -21.49 65.43 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.28 -0.888 . . . . 0.58999999999999997 109.768 -179.739 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' D' D ' 354' ' ' GLN . . . . . . . . . . . . . 2.1 tt0 . . . . . 0 N--CA 1.49 1.553 0 O-C-N 121.229 -0.919 . . . . 1.4399999999999999 109.31 179.961 . . . . . . . . 0 0 . 1 . 035 nuclear build core ' A' A ' 326' ' ' GLU . . . . . . . . . . . . . 2.1 mt-10 . . . . . 0 N--CA 1.489 1.5 0 N-CA-C 109.424 -0.584 . . . . 2.1299999999999999 109.424 . . . . . . . . . 0 0 . 1 . 035 nuclear build core ' A' A ' 327' ' ' TYR . . . . . . . . . . . . . 48.1 m-85 -148.87 109.06 4.11 Favored 'General case' 0 C--N 1.303 -1.415 0 O-C-N 121.259 -0.901 . . . . 0.47999999999999998 109.413 179.989 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 328' ' ' PHE . . . . . 0.519 ' CZ ' ' HG3' ' C' ' 335' ' ' ARG . 88.4 m-85 -113.83 -169.01 1.43 Allowed 'General case' 0 N--CA 1.489 1.492 0 O-C-N 121.353 -0.842 . . . . 0.31 109.04 179.873 . . . . . . . . 2 2 . 1 . 035 nuclear build core ' A' A ' 329' ' ' THR . . . . . . . . . . . . . 32.4 p -152.57 168.16 26.5 Favored 'General case' 0 C--N 1.302 -1.49 0 O-C-N 121.142 -0.973 . . . . 0.22 109.311 -179.925 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 330' ' ' LEU . . . . . . . . . . . . . 41.9 tp -149.72 127.69 11.89 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.196 -0.94 . . . . 0.28000000000000003 109.694 -179.688 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 331' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -88.3 114.65 25.13 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.23 -0.919 . . . . 0.91000000000000003 109.206 179.661 . . . . . . . . 2 2 . 1 . 035 nuclear build core ' A' A ' 332' ' ' ILE . . . . . 0.651 HD12 ' HD1' ' A' ' 338' ' ' PHE . 23.0 mt -103.32 112.74 37.9 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.57 0 O-C-N 121.194 -0.941 . . . . 0.26000000000000001 109.524 179.957 . . . . . . . . 2 2 . 1 . 035 nuclear build core ' A' A ' 333' ' ' ARG . . . . . 0.44 ' HG2' ' CE1' ' C' ' 327' ' ' TYR . 2.4 mtt180 -72.5 145.24 47.65 Favored 'General case' 0 N--CA 1.488 1.459 0 O-C-N 121.332 -0.855 . . . . 2.9199999999999999 109.31 179.918 . . . . . . . . 2 2 . 1 . 035 nuclear build core ' A' A ' 334' ' ' GLY . . . . . . . . . . . . . . . 83.11 127.72 1.23 Allowed Glycine 0 N--CA 1.492 2.387 0 N-CA-C 109.567 -1.413 . . . . 0.40000000000000002 109.567 179.936 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 335' ' ' ARG . . . . . 0.443 ' CG ' HH11 ' A' ' 335' ' ' ARG . 0.4 OUTLIER -75.01 -35.12 61.99 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.233 -1.157 . . . . 3.0099999999999998 109.345 -179.965 . . . . . . . . 3 3 . 1 . 035 nuclear build core ' A' A ' 336' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -58.06 -59.29 5.5 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.319 -0.863 . . . . 2.29 109.451 179.98 . . . . . . . . 2 2 . 1 . 035 nuclear build core ' A' A ' 337' ' ' ARG . . . . . 0.668 ' NH2' HD12 ' C' ' 348' ' ' LEU . 6.0 mmt180 -60.72 -31.61 70.9 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.33 -0.856 . . . . 2.9300000000000002 109.466 179.981 . . . . . . . . 2 2 . 1 . 035 nuclear build core ' A' A ' 338' ' ' PHE . . . . . 0.651 ' HD1' HD12 ' A' ' 332' ' ' ILE . 52.5 t80 -55.43 -55.78 27.72 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.195 -0.94 . . . . 0.38 109.411 179.968 . . . . . . . . 2 2 . 1 . 035 nuclear build core ' A' A ' 339' ' ' GLU . . . . . . . . . . . . . 4.9 mt-10 -52.07 -32.96 37.0 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.318 -0.864 . . . . 1.97 109.952 -179.812 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 340' ' ' MET . . . . . . . . . . . . . 21.8 ttp -63.52 -52.69 60.1 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.242 -0.911 . . . . 0.31 110.041 -179.519 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 341' ' ' PHE . . . . . 0.453 ' HB2' HD13 ' A' ' 332' ' ' ILE . 56.7 m-85 -62.22 -43.11 99.56 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.112 -0.993 . . . . 0.17999999999999999 110.012 -179.384 . . . . . . . . 2 2 . 1 . 035 nuclear build core ' A' A ' 342' ' ' ARG . . . . . 0.449 ' CG ' HH11 ' A' ' 342' ' ' ARG . 0.0 OUTLIER -50.8 -46.45 59.7 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.299 -0.876 . . . . 2.4199999999999999 110.023 -179.655 . . . . . . . . 3 3 . 1 . 035 nuclear build core ' A' A ' 343' ' ' GLU . . . . . . . . . . . . . 4.9 tt0 -59.29 -43.55 92.57 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.167 -0.958 . . . . 2.3500000000000001 109.928 -179.562 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 344' ' ' LEU . . . . . . . . . . . . . 53.2 mt -62.19 -36.61 82.44 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.202 -0.936 . . . . 0.17999999999999999 109.715 -179.793 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 345' ' ' ASN . . . . . 0.518 ' HB2' HD21 ' C' ' 330' ' ' LEU . 56.7 t-20 -58.47 -55.59 33.1 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.284 -0.885 . . . . 1.0900000000000001 109.612 -179.787 . . . . . . . . 2 2 . 1 . 035 nuclear build core ' A' A ' 346' ' ' GLU . . . . . . . . . . . . . 3.5 tt0 -60.41 -29.42 68.97 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.281 -0.887 . . . . 1.6499999999999999 109.575 -179.803 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 347' ' ' ALA . . . . . . . . . . . . . . . -60.77 -59.08 5.95 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.243 -0.911 . . . . 0.17999999999999999 109.954 179.96 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 348' ' ' LEU . . . . . 0.57 HD22 ' N ' ' A' ' 348' ' ' LEU . 4.0 mm? -61.47 -45.44 94.26 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.265 -0.897 . . . . 0.29999999999999999 110.026 -179.565 . . . . . . . . 2 2 . 1 . 035 nuclear build core ' A' A ' 349' ' ' GLU . . . . . . . . . . . . . 3.8 mm-40 -55.78 -34.21 65.08 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.166 -0.959 . . . . 1.9399999999999999 109.439 -179.623 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 350' ' ' LEU . . . . . 0.542 HD22 HD13 ' B' ' 350' ' ' LEU . 6.0 tt -63.36 -45.69 90.0 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.223 -0.923 . . . . 0.46000000000000002 109.086 179.667 . . . . . . . . 2 2 . 1 . 035 nuclear build core ' A' A ' 351' ' ' LYS . . . . . . . . . . . . . 30.4 tttt -59.72 -45.88 90.81 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.382 -0.824 . . . . 1.3999999999999999 109.692 -179.943 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 352' ' ' ASP . . . . . . . . . . . . . 7.8 m-20 -54.81 -49.85 69.97 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.248 -0.908 . . . . 1.1599999999999999 109.889 -179.717 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 353' ' ' ALA . . . . . . . . . . . . . . . -67.12 -23.85 65.86 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.192 -0.943 . . . . 0.63 109.681 -179.715 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 354' ' ' GLN . . . . . 0.482 ' OE1' HD11 ' B' ' 350' ' ' LEU . 4.6 tt0 . . . . . 0 N--CA 1.492 1.628 0 O-C-N 121.278 -0.889 . . . . 1.47 109.797 -179.932 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' B' B ' 326' ' ' GLU . . . . . . . . . . . . . 2.1 mt-10 . . . . . 0 N--CA 1.489 1.512 0 N-CA-C 109.366 -0.605 . . . . 2.1299999999999999 109.366 . . . . . . . . . 0 0 . 1 . 035 nuclear build core ' B' B ' 327' ' ' TYR . . . . . . . . . . . . . 47.9 m-85 -148.62 108.97 4.13 Favored 'General case' 0 N--CA 1.489 1.481 0 O-C-N 121.199 -0.938 . . . . 0.47999999999999998 109.427 -179.974 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' B' B ' 328' ' ' PHE . . . . . 0.49 ' CZ ' ' HG3' ' D' ' 335' ' ' ARG . 88.5 m-85 -113.62 -169.07 1.43 Allowed 'General case' 0 N--CA 1.487 1.419 0 O-C-N 121.254 -0.904 . . . . 0.32000000000000001 109.044 179.897 . . . . . . . . 2 2 . 1 . 035 nuclear build core ' B' B ' 329' ' ' THR . . . . . . . . . . . . . 30.3 p -152.45 168.11 26.56 Favored 'General case' 0 N--CA 1.489 1.494 0 O-C-N 121.217 -0.927 . . . . 0.23000000000000001 109.325 -179.965 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' B' B ' 330' ' ' LEU . . . . . 0.695 HD11 HD22 ' D' ' 345' ' ' ASN . 39.9 tp -149.78 127.7 11.84 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.24 -0.913 . . . . 0.28000000000000003 109.656 -179.742 . . . . . . . . 2 2 . 1 . 035 nuclear build core ' B' B ' 331' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -88.43 114.58 25.2 Favored 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.35 -0.844 . . . . 0.91000000000000003 109.299 179.708 . . . . . . . . 2 2 . 1 . 035 nuclear build core ' B' B ' 332' ' ' ILE . . . . . 0.662 HD12 ' HD1' ' B' ' 338' ' ' PHE . 22.2 mt -103.18 112.57 37.13 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.542 0 O-C-N 121.107 -0.995 . . . . 0.23999999999999999 109.563 -179.923 . . . . . . . . 2 2 . 1 . 035 nuclear build core ' B' B ' 333' ' ' ARG . . . . . 0.473 ' HG2' ' CE1' ' D' ' 327' ' ' TYR . 2.3 mtt180 -72.19 145.15 48.22 Favored 'General case' 0 N--CA 1.489 1.49 0 O-C-N 121.306 -0.871 . . . . 2.9300000000000002 109.312 179.86 . . . . . . . . 2 2 . 1 . 035 nuclear build core ' B' B ' 334' ' ' GLY . . . . . . . . . . . . . . . 83.08 127.87 1.24 Allowed Glycine 0 N--CA 1.49 2.269 0 N-CA-C 109.646 -1.382 . . . . 0.40000000000000002 109.646 -179.999 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' B' B ' 335' ' ' ARG . . . . . 0.437 HH11 ' CG ' ' B' ' 335' ' ' ARG . 0.3 OUTLIER -75.16 -35.38 61.63 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.338 -1.095 . . . . 3.0099999999999998 109.34 179.935 . . . . . . . . 3 3 . 1 . 035 nuclear build core ' B' B ' 336' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -57.93 -59.15 5.69 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.296 -0.877 . . . . 2.2799999999999998 109.403 179.941 . . . . . . . . 2 2 . 1 . 035 nuclear build core ' B' B ' 337' ' ' ARG . . . . . 0.58 ' NH2' HD12 ' D' ' 348' ' ' LEU . 6.2 mmt180 -60.86 -31.86 71.3 Favored 'General case' 0 N--CA 1.489 1.495 0 O-C-N 121.337 -0.852 . . . . 2.9300000000000002 109.434 -179.944 . . . . . . . . 2 2 . 1 . 035 nuclear build core ' B' B ' 338' ' ' PHE . . . . . 0.662 ' HD1' HD12 ' B' ' 332' ' ' ILE . 52.7 t80 -55.14 -55.88 26.17 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.297 -0.877 . . . . 0.37 109.495 179.909 . . . . . . . . 2 2 . 1 . 035 nuclear build core ' B' B ' 339' ' ' GLU . . . . . . . . . . . . . 4.9 mt-10 -51.77 -33.18 34.04 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.316 -0.865 . . . . 1.98 110.019 -179.865 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' B' B ' 340' ' ' MET . . . . . . . . . . . . . 20.9 ttp -63.45 -52.63 60.63 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.198 -0.939 . . . . 0.32000000000000001 110.113 -179.428 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' B' B ' 341' ' ' PHE . . . . . 0.46 ' CZ ' ' HA ' ' D' ' 345' ' ' ASN . 56.2 m-85 -62.42 -42.99 99.86 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.171 -0.956 . . . . 0.17999999999999999 109.988 -179.466 . . . . . . . . 2 2 . 1 . 035 nuclear build core ' B' B ' 342' ' ' ARG . . . . . 0.448 ' CG ' ' NH1' ' B' ' 342' ' ' ARG . 0.0 OUTLIER -50.97 -46.51 61.24 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.315 -0.866 . . . . 2.4199999999999999 110.049 -179.647 . . . . . . . . 3 3 . 1 . 035 nuclear build core ' B' B ' 343' ' ' GLU . . . . . . . . . . . . . 5.1 tt0 -59.23 -43.39 92.35 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.121 -0.987 . . . . 2.3500000000000001 109.953 -179.696 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' B' B ' 344' ' ' LEU . . . . . . . . . . . . . 55.7 mt -62.31 -36.56 82.51 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.184 -0.948 . . . . 0.17999999999999999 109.75 -179.774 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' B' B ' 345' ' ' ASN . . . . . 0.601 HD22 HD11 ' D' ' 330' ' ' LEU . 56.9 t-20 -58.61 -55.02 40.4 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.239 -0.913 . . . . 1.0900000000000001 109.689 -179.838 . . . . . . . . 2 2 . 1 . 035 nuclear build core ' B' B ' 346' ' ' GLU . . . . . . . . . . . . . 3.4 tt0 -60.77 -29.49 69.45 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.354 -0.841 . . . . 1.6599999999999999 109.574 -179.815 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' B' B ' 347' ' ' ALA . . . . . . . . . . . . . . . -60.88 -58.91 6.43 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.292 -0.88 . . . . 0.17000000000000001 109.924 -179.896 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' B' B ' 348' ' ' LEU . . . . . 0.761 HD12 ' NH2' ' D' ' 337' ' ' ARG . 4.0 mm? -61.45 -45.93 92.22 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.196 -0.94 . . . . 0.28999999999999998 109.887 -179.622 . . . . . . . . 2 2 . 1 . 035 nuclear build core ' B' B ' 349' ' ' GLU . . . . . . . . . . . . . 3.9 mm-40 -55.38 -34.23 64.14 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.17 -0.957 . . . . 1.95 109.534 -179.705 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' B' B ' 350' ' ' LEU . . . . . 0.542 HD13 HD22 ' A' ' 350' ' ' LEU . 6.1 tt -63.32 -45.77 89.78 Favored 'General case' 0 N--CA 1.488 1.457 0 O-C-N 121.205 -0.934 . . . . 0.45000000000000001 109.173 179.69 . . . . . . . . 2 2 . 1 . 035 nuclear build core ' B' B ' 351' ' ' LYS . . . . . . . . . . . . . 30.5 tttt -59.79 -45.87 90.98 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.442 -0.786 . . . . 1.3799999999999999 109.713 -179.967 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' B' B ' 352' ' ' ASP . . . . . . . . . . . . . 7.8 m-20 -54.88 -49.58 70.84 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.22 -0.925 . . . . 1.1599999999999999 109.84 -179.735 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' B' B ' 353' ' ' ALA . . . . . . . . . . . . . . . -67.32 -24.03 65.7 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.19 -0.943 . . . . 0.60999999999999999 109.601 -179.749 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' B' B ' 354' ' ' GLN . . . . . 0.457 ' OE1' HD11 ' A' ' 350' ' ' LEU . 4.5 tt0 . . . . . 0 N--CA 1.491 1.592 0 O-C-N 121.233 -0.917 . . . . 1.45 109.779 -179.883 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' C' C ' 326' ' ' GLU . . . . . 0.49 ' HB3' ' CE1' ' C' ' 328' ' ' PHE . 60.7 mm-40 . . . . . 0 N--CA 1.488 1.451 0 N-CA-C 109.204 -0.665 . . . . 2.1699999999999999 109.204 . . . . . . . . . 1 1 . 1 . 035 nuclear build core ' C' C ' 327' ' ' TYR . . . . . 0.44 ' CE1' ' HG2' ' A' ' 333' ' ' ARG . 37.0 m-85 -149.22 109.59 4.18 Favored 'General case' 0 C--N 1.302 -1.462 0 O-C-N 121.354 -0.841 . . . . 0.47999999999999998 109.41 179.94 . . . . . . . . 2 2 . 1 . 035 nuclear build core ' C' C ' 328' ' ' PHE . . . . . 0.49 ' CE1' ' HB3' ' C' ' 326' ' ' GLU . 65.2 m-85 -113.58 -167.72 1.24 Allowed 'General case' 0 N--CA 1.489 1.477 0 O-C-N 121.431 -0.793 . . . . 0.33000000000000002 109.393 179.969 . . . . . . . . 2 2 . 1 . 035 nuclear build core ' C' C ' 329' ' ' THR . . . . . . . . . . . . . 14.6 p -151.86 168.66 24.43 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.242 -0.911 . . . . 0.23000000000000001 109.342 -179.865 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' C' C ' 330' ' ' LEU . . . . . 0.518 HD21 ' HB2' ' A' ' 345' ' ' ASN . 30.6 tp -149.48 127.02 11.58 Favored 'General case' 0 C--N 1.303 -1.453 0 O-C-N 121.201 -0.937 . . . . 0.28000000000000003 109.505 -179.741 . . . . . . . . 2 2 . 1 . 035 nuclear build core ' C' C ' 331' ' ' GLN . . . . . 0.536 ' CG ' ' NH2' ' C' ' 333' ' ' ARG . 6.9 tp-100 -87.23 114.22 23.65 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.312 -0.868 . . . . 1.48 109.46 179.941 . . . . . . . . 2 2 . 1 . 035 nuclear build core ' C' C ' 332' ' ' ILE . . . . . 0.612 HG21 ' HA ' ' C' ' 338' ' ' PHE . 84.7 mt -103.7 110.99 31.7 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.548 0 O-C-N 121.297 -0.877 . . . . 0.23999999999999999 109.687 179.925 . . . . . . . . 2 2 . 1 . 035 nuclear build core ' C' C ' 333' ' ' ARG . . . . . 0.536 ' NH2' ' CG ' ' C' ' 331' ' ' GLN . 0.0 OUTLIER -72.92 147.3 45.42 Favored 'General case' 0 N--CA 1.488 1.439 0 O-C-N 121.156 -0.965 . . . . 2.7400000000000002 109.277 179.711 . . . . . . . . 3 3 . 1 . 035 nuclear build core ' C' C ' 334' ' ' GLY . . . . . . . . . . . . . . . 76.65 131.73 0.45 Allowed Glycine 0 N--CA 1.492 2.388 0 N-CA-C 109.632 -1.387 . . . . 0.34999999999999998 109.632 179.815 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' C' C ' 335' ' ' ARG . . . . . 0.519 ' HG3' ' CZ ' ' A' ' 328' ' ' PHE . 1.1 tmt_? -76.84 -30.51 56.35 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.327 -1.102 . . . . 2.5299999999999998 109.61 -179.994 . . . . . . . . 2 2 . 1 . 035 nuclear build core ' C' C ' 336' ' ' GLU . . . . . . . . . . . . . 21.2 mt-10 -57.62 -60.08 4.21 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.345 -0.847 . . . . 2.6200000000000001 109.729 -179.725 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' C' C ' 337' ' ' ARG . . . . . 0.495 ' HD2' ' N ' ' C' ' 337' ' ' ARG . 11.4 mmm180 -59.85 -31.52 69.83 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.305 -0.872 . . . . 2.8100000000000001 109.609 -179.592 . . . . . . . . 2 2 . 1 . 035 nuclear build core ' C' C ' 338' ' ' PHE . . . . . 0.612 ' HA ' HG21 ' C' ' 332' ' ' ILE . 61.3 t80 -56.12 -56.74 17.21 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.365 -0.834 . . . . 0.40000000000000002 109.858 -179.724 . . . . . . . . 2 2 . 1 . 035 nuclear build core ' C' C ' 339' ' ' GLU . . . . . . . . . . . . . 3.8 mt-10 -49.45 -38.38 29.45 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.254 -0.904 . . . . 2.0499999999999998 110.302 -179.462 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' C' C ' 340' ' ' MET . . . . . . . . . . . . . 35.1 ttp -64.61 -47.15 79.68 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.11 -0.994 . . . . 0.32000000000000001 110.279 -179.396 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' C' C ' 341' ' ' PHE . . . . . 0.458 ' CZ ' ' HA ' ' A' ' 345' ' ' ASN . 38.0 m-85 -62.47 -52.87 61.82 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.173 -0.954 . . . . 0.17999999999999999 110.139 -179.352 . . . . . . . . 2 2 . 1 . 035 nuclear build core ' C' C ' 342' ' ' ARG . . . . . . . . . . . . . 7.4 tmm_? -46.51 -40.08 11.95 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.267 -0.896 . . . . 2.9100000000000001 109.718 -179.751 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' C' C ' 343' ' ' GLU . . . . . . . . . . . . . 6.4 tp10 -59.06 -50.2 74.98 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.236 -0.915 . . . . 2.1400000000000001 109.721 -179.956 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' C' C ' 344' ' ' LEU . . . . . . . . . . . . . 41.0 mt -61.91 -28.36 69.47 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.263 -0.898 . . . . 0.22 109.419 179.992 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' C' C ' 345' ' ' ASN . . . . . 0.5 ' ND2' ' OE2' ' C' ' 349' ' ' GLU . 13.9 t-20 -57.8 -59.64 4.91 Favored 'General case' 0 N--CA 1.489 1.484 0 O-C-N 121.243 -0.911 . . . . 1.0800000000000001 109.45 179.929 . . . . . . . . 2 2 . 1 . 035 nuclear build core ' C' C ' 346' ' ' GLU . . . . . . . . . . . . . 1.3 tt0 -61.74 -24.23 66.67 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.431 -0.793 . . . . 2.21 109.655 -179.954 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' C' C ' 347' ' ' ALA . . . . . 0.496 ' HB1' ' HB1' ' D' ' 347' ' ' ALA . . . -61.71 -62.8 1.55 Allowed 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.204 -0.935 . . . . 0.17999999999999999 110.025 -179.76 . . . . . . . . 2 2 . 1 . 035 nuclear build core ' C' C ' 348' ' ' LEU . . . . . 0.668 HD12 ' NH2' ' A' ' 337' ' ' ARG . 3.6 mm? -61.9 -45.0 95.64 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.19 -0.944 . . . . 0.32000000000000001 110.018 -179.405 . . . . . . . . 2 2 . 1 . 035 nuclear build core ' C' C ' 349' ' ' GLU . . . . . 0.5 ' OE2' ' ND2' ' C' ' 345' ' ' ASN . 3.6 mt-10 -56.37 -34.16 66.4 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.153 -0.967 . . . . 2.1899999999999999 109.525 -179.629 . . . . . . . . 2 2 . 1 . 035 nuclear build core ' C' C ' 350' ' ' LEU . . . . . 0.637 HD22 HD13 ' D' ' 350' ' ' LEU . 7.4 tt -65.0 -41.29 95.51 Favored 'General case' 0 N--CA 1.489 1.483 0 O-C-N 121.217 -0.927 . . . . 0.46000000000000002 109.188 179.674 . . . . . . . . 2 2 . 1 . 035 nuclear build core ' C' C ' 351' ' ' LYS . . . . . . . . . . . . . 13.7 tttt -60.3 -48.9 79.78 Favored 'General case' 0 N--CA 1.489 1.501 0 O-C-N 121.353 -0.842 . . . . 1.3500000000000001 109.621 -179.919 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' C' C ' 352' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -57.23 -44.24 83.58 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.244 -0.91 . . . . 1.1899999999999999 109.774 -179.902 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' C' C ' 353' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 1.606 0 O-C-N 121.296 -0.877 . . . . 0.56999999999999995 109.764 -179.825 . . . . . . . . 0 0 . 1 . 035 nuclear build core ' D' D ' 326' ' ' GLU . . . . . . . . . . . . . 2.1 mt-10 . . . . . 0 N--CA 1.489 1.515 0 N-CA-C 109.355 -0.609 . . . . 2.1299999999999999 109.355 . . . . . . . . . 0 0 . 1 . 035 nuclear build core ' D' D ' 327' ' ' TYR . . . . . 0.473 ' CE1' ' HG2' ' B' ' 333' ' ' ARG . 47.0 m-85 -148.91 108.65 4.02 Favored 'General case' 0 N--CA 1.488 1.444 0 O-C-N 121.318 -0.864 . . . . 0.46999999999999997 109.453 -179.934 . . . . . . . . 2 2 . 1 . 035 nuclear build core ' D' D ' 328' ' ' PHE . . . . . 0.415 ' CZ ' ' HG3' ' B' ' 335' ' ' ARG . 88.7 m-85 -113.47 -169.02 1.42 Allowed 'General case' 0 N--CA 1.489 1.481 0 O-C-N 121.356 -0.84 . . . . 0.29999999999999999 109.103 179.936 . . . . . . . . 2 2 . 1 . 035 nuclear build core ' D' D ' 329' ' ' THR . . . . . . . . . . . . . 31.1 p -152.44 168.18 26.32 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.208 -0.932 . . . . 0.22 109.336 -179.968 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' D' D ' 330' ' ' LEU . . . . . 0.601 HD11 HD22 ' B' ' 345' ' ' ASN . 38.5 tp -149.96 127.2 11.34 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.197 -0.94 . . . . 0.28000000000000003 109.642 -179.667 . . . . . . . . 2 2 . 1 . 035 nuclear build core ' D' D ' 331' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -87.83 114.56 24.55 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.312 -0.868 . . . . 0.93000000000000005 109.299 179.604 . . . . . . . . 2 2 . 1 . 035 nuclear build core ' D' D ' 332' ' ' ILE . . . . . 0.666 HD12 ' HD1' ' D' ' 338' ' ' PHE . 21.9 mt -103.29 112.88 38.41 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.55 0 O-C-N 121.121 -0.987 . . . . 0.25 109.493 179.925 . . . . . . . . 2 2 . 1 . 035 nuclear build core ' D' D ' 333' ' ' ARG . . . . . . . . . . . . . 2.3 mtt180 -72.43 145.23 47.77 Favored 'General case' 0 N--CA 1.488 1.445 0 O-C-N 121.141 -0.974 . . . . 2.9300000000000002 109.365 179.938 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' D' D ' 334' ' ' GLY . . . . . . . . . . . . . . . 83.08 127.57 1.2 Allowed Glycine 0 N--CA 1.49 2.271 0 N-CA-C 109.608 -1.397 . . . . 0.40999999999999998 109.608 179.861 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' D' D ' 335' ' ' ARG . . . . . 0.49 ' HG3' ' CZ ' ' B' ' 328' ' ' PHE . 0.4 OUTLIER -74.75 -35.23 62.62 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.225 -1.162 . . . . 3.0299999999999998 109.466 179.953 . . . . . . . . 3 3 . 1 . 035 nuclear build core ' D' D ' 336' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -58.02 -59.29 5.5 Favored 'General case' 0 N--CA 1.489 1.484 0 O-C-N 121.253 -0.904 . . . . 2.2599999999999998 109.522 179.956 . . . . . . . . 2 2 . 1 . 035 nuclear build core ' D' D ' 337' ' ' ARG . . . . . 0.761 ' NH2' HD12 ' B' ' 348' ' ' LEU . 6.2 mmt180 -60.73 -31.77 71.06 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.317 -0.865 . . . . 2.9199999999999999 109.426 -179.97 . . . . . . . . 2 2 . 1 . 035 nuclear build core ' D' D ' 338' ' ' PHE . . . . . 0.666 ' HD1' HD12 ' D' ' 332' ' ' ILE . 52.9 t80 -55.19 -55.9 26.05 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.234 -0.916 . . . . 0.37 109.517 179.927 . . . . . . . . 2 2 . 1 . 035 nuclear build core ' D' D ' 339' ' ' GLU . . . . . . . . . . . . . 5.0 mt-10 -51.94 -33.06 35.78 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.261 -0.899 . . . . 1.99 109.893 -179.755 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' D' D ' 340' ' ' MET . . . . . . . . . . . . . 21.1 ttp -63.53 -52.51 60.86 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.262 -0.898 . . . . 0.31 110.12 -179.422 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' D' D ' 341' ' ' PHE . . . . . 0.569 ' CZ ' ' HA ' ' B' ' 345' ' ' ASN . 57.0 m-85 -62.38 -43.17 99.45 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.137 -0.977 . . . . 0.17999999999999999 110.016 -179.515 . . . . . . . . 2 2 . 1 . 035 nuclear build core ' D' D ' 342' ' ' ARG . . . . . 0.447 ' CG ' ' NH1' ' D' ' 342' ' ' ARG . 0.0 OUTLIER -50.77 -46.47 59.49 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.229 -0.92 . . . . 2.4100000000000001 110.017 -179.657 . . . . . . . . 3 3 . 1 . 035 nuclear build core ' D' D ' 343' ' ' GLU . . . . . . . . . . . . . 4.7 tt0 -59.12 -43.71 91.96 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.181 -0.949 . . . . 2.3500000000000001 109.887 -179.636 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' D' D ' 344' ' ' LEU . . . . . . . . . . . . . 54.4 mt -62.18 -36.54 82.19 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.175 -0.953 . . . . 0.19 109.783 -179.79 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' D' D ' 345' ' ' ASN . . . . . 0.695 HD22 HD11 ' B' ' 330' ' ' LEU . 56.5 t-20 -58.61 -55.43 35.17 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.243 -0.911 . . . . 1.0900000000000001 109.664 -179.824 . . . . . . . . 2 2 . 1 . 035 nuclear build core ' D' D ' 346' ' ' GLU . . . . . . . . . . . . . 3.3 tt0 -60.52 -29.44 69.11 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.193 -0.942 . . . . 1.6899999999999999 109.534 -179.777 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' D' D ' 347' ' ' ALA . . . . . 0.496 ' HB1' ' HB1' ' C' ' 347' ' ' ALA . . . -60.91 -58.84 6.74 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.154 -0.966 . . . . 0.17999999999999999 109.885 -179.943 . . . . . . . . 2 2 . 1 . 035 nuclear build core ' D' D ' 348' ' ' LEU . . . . . 0.58 HD12 ' NH2' ' B' ' 337' ' ' ARG . 4.0 mm? -61.53 -45.82 92.55 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.212 -0.93 . . . . 0.31 109.9 -179.557 . . . . . . . . 2 2 . 1 . 035 nuclear build core ' D' D ' 349' ' ' GLU . . . . . . . . . . . . . 3.9 mm-40 -55.51 -34.17 64.41 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.273 -0.892 . . . . 1.95 109.607 -179.622 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' D' D ' 350' ' ' LEU . . . . . 0.637 HD13 HD22 ' C' ' 350' ' ' LEU . 6.1 tt -63.44 -45.79 89.31 Favored 'General case' 0 N--CA 1.489 1.484 0 O-C-N 121.273 -0.892 . . . . 0.42999999999999999 109.069 179.701 . . . . . . . . 2 2 . 1 . 035 nuclear build core ' D' D ' 351' ' ' LYS . . . . . . . . . . . . . 30.2 tttt -59.77 -45.74 91.34 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.402 -0.811 . . . . 1.3999999999999999 109.664 -179.942 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' D' D ' 352' ' ' ASP . . . . . . . . . . . . . 7.6 m-20 -54.91 -49.85 70.25 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.293 -0.879 . . . . 1.1699999999999999 109.845 -179.766 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' D' D ' 353' ' ' ALA . . . . . . . . . . . . . . . -67.22 -23.88 65.77 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.198 -0.939 . . . . 0.58999999999999997 109.651 -179.731 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' D' D ' 354' ' ' GLN . . . . . . . . . . . . . 4.6 tt0 . . . . . 0 N--CA 1.49 1.572 0 O-C-N 121.249 -0.907 . . . . 1.4399999999999999 109.728 -179.889 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 319' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.49 1.533 0 CA-C-O 121.334 0.587 . . . . 7.5499999999999998 109.504 . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 320' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER 54.96 -94.51 0.04 OUTLIER 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.183 -0.948 . . . . 6.4299999999999997 109.556 -179.942 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 321' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -158.35 132.26 5.0 Favored Pre-proline 0 N--CA 1.49 1.546 0 O-C-N 121.129 -0.982 . . . . 6.1299999999999999 109.419 179.91 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 322' ' ' PRO . . . . . . . . . . . . . 1.1 Cg_endo -64.13 -81.78 0.01 OUTLIER 'Trans proline' 0 C--N 1.312 -1.382 0 C-N-CA 122.045 1.83 . . . . 2.8300000000000001 110.348 -179.868 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 323' ' ' LEU . . . . . . . . . . . . . 73.1 mt -81.99 114.92 20.9 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.155 -0.965 . . . . 2.8300000000000001 109.622 -179.893 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 324' ' ' ASP . . . . . 0.484 ' N ' ' OD1' ' A' ' 324' ' ' ASP . 1.8 m-20 -79.67 142.75 35.25 Favored 'General case' 0 N--CA 1.488 1.455 0 O-C-N 121.299 -0.876 . . . . 1.53 108.955 179.631 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 325' ' ' GLY . . . . . . . . . . . . . . . -67.39 179.21 16.09 Favored Glycine 0 N--CA 1.488 2.129 0 N-CA-C 109.259 -1.537 . . . . 0.60999999999999999 109.259 -179.884 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 326' ' ' GLU . . . . . . . . . . . . . 4.2 mm-40 -56.89 -179.75 0.04 OUTLIER 'General case' 0 N--CA 1.487 1.424 0 O-C-N 121.177 -1.19 . . . . 2.1299999999999999 109.235 -179.878 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 327' ' ' TYR . . . . . . . . . . . . . 42.2 m-85 -147.31 96.28 2.68 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.248 -0.908 . . . . 0.47999999999999998 109.437 -179.974 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 328' ' ' PHE . . . . . 0.564 ' CE2' ' HG3' ' C' ' 335' ' ' ARG . 56.8 m-85 -103.46 -160.34 0.77 Allowed 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.319 -0.863 . . . . 0.31 109.588 -179.759 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 329' ' ' THR . . . . . 0.455 ' HA ' ' O ' ' C' ' 330' ' ' LEU . 34.8 p -154.11 169.22 24.07 Favored 'General case' 0 N--CA 1.489 1.49 0 O-C-N 121.455 -0.778 . . . . 0.22 108.922 179.894 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 330' ' ' LEU . . . . . 0.478 ' O ' ' HA ' ' C' ' 329' ' ' THR . 24.4 tp -151.42 132.97 14.76 Favored 'General case' 0 N--CA 1.488 1.474 0 O-C-N 121.071 -1.018 . . . . 0.28000000000000003 109.768 -179.717 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 331' ' ' GLN . . . . . . . . . . . . . 7.1 tp-100 -85.66 115.94 23.64 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.343 -0.848 . . . . 0.91000000000000003 108.946 179.695 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 332' ' ' ILE . . . . . 0.794 HG21 ' HA ' ' A' ' 338' ' ' PHE . 75.0 mt -103.17 104.25 16.34 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.555 0 O-C-N 121.261 -0.899 . . . . 0.26000000000000001 109.819 -179.714 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 333' ' ' ARG . . . . . 0.554 ' CG ' ' CE1' ' C' ' 327' ' ' TYR . 1.9 mpt_? -72.74 138.86 46.78 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.376 -0.828 . . . . 2.9199999999999999 109.35 179.744 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 334' ' ' GLY . . . . . . . . . . . . . . . 91.25 130.21 4.69 Favored Glycine 0 N--CA 1.491 2.367 0 N-CA-C 109.573 -1.411 . . . . 0.40000000000000002 109.573 179.868 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 335' ' ' ARG . . . . . 0.424 ' O ' ' HB3' ' A' ' 338' ' ' PHE . 57.5 ttt180 -79.36 -37.8 36.55 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.34 -1.094 . . . . 3.0099999999999998 109.653 179.919 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 336' ' ' GLU . . . . . . . . . . . . . 5.0 mt-10 -58.0 -60.87 3.07 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.187 -0.946 . . . . 2.29 109.671 -179.863 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 337' ' ' ARG . . . . . . . . . . . . . 4.0 mtt180 -59.98 -28.58 67.8 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.232 -0.918 . . . . 2.9300000000000002 109.603 -179.831 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 338' ' ' PHE . . . . . 0.794 ' HA ' HG21 ' A' ' 332' ' ' ILE . 59.1 t80 -54.51 -60.24 3.62 Favored 'General case' 0 N--CA 1.489 1.494 0 O-C-N 121.175 -0.953 . . . . 0.38 109.477 -179.996 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 339' ' ' GLU . . . . . . . . . . . . . 5.8 mt-10 -51.36 -31.29 21.65 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.291 -0.881 . . . . 1.97 109.771 -179.917 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 340' ' ' MET . . . . . . . . . . . . . 27.7 ttp -64.19 -52.61 58.11 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.128 -0.982 . . . . 0.31 109.881 -179.703 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 341' ' ' PHE . . . . . . . . . . . . . 39.2 m-85 -61.79 -47.84 83.31 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.205 -0.935 . . . . 0.17999999999999999 109.766 -179.623 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 342' ' ' ARG . . . . . . . . . . . . . 9.7 ttt180 -49.67 -40.21 39.16 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.21 -0.931 . . . . 2.4199999999999999 109.779 -179.811 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 343' ' ' GLU . . . . . . . . . . . . . 4.3 tt0 -59.29 -49.7 76.84 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.196 -0.94 . . . . 2.3500000000000001 109.8 -179.762 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 344' ' ' LEU . . . . . 0.548 ' CD2' HD22 ' B' ' 344' ' ' LEU . 45.4 mt -61.84 -31.47 71.73 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.148 -0.97 . . . . 0.17999999999999999 109.569 -179.805 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 345' ' ' ASN . . . . . . . . . . . . . 15.9 t-20 -57.87 -57.87 10.87 Favored 'General case' 0 N--CA 1.489 1.477 0 O-C-N 121.229 -0.919 . . . . 1.0900000000000001 109.53 -179.965 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 346' ' ' GLU . . . . . . . . . . . . . 37.3 tt0 -60.98 -29.06 69.46 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.296 -0.878 . . . . 1.6499999999999999 109.628 -179.848 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 347' ' ' ALA . . . . . 0.4 ' HB1' ' HB1' ' B' ' 347' ' ' ALA . . . -59.45 -58.43 8.65 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.195 -0.941 . . . . 0.17999999999999999 109.843 -179.83 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 348' ' ' LEU . . . . . 0.608 HD22 ' N ' ' A' ' 348' ' ' LEU . 4.2 mm? -61.52 -38.73 88.45 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.282 -0.887 . . . . 0.29999999999999999 109.71 -179.671 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 349' ' ' GLU . . . . . . . . . . . . . 9.2 mt-10 -57.83 -38.31 75.41 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.337 -0.852 . . . . 1.9399999999999999 110.063 -179.57 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 350' ' ' LEU . . . . . 0.664 HD22 HD13 ' B' ' 350' ' ' LEU . 6.1 tt -62.75 -48.74 77.88 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.165 -0.96 . . . . 0.46000000000000002 109.73 -179.755 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 351' ' ' LYS . . . . . . . . . . . . . 5.8 tttt -59.33 -36.92 76.55 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.221 -0.924 . . . . 1.3999999999999999 109.471 -179.808 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 352' ' ' ASP . . . . . 0.403 ' OD1' ' CZ ' ' C' ' 337' ' ' ARG . 55.3 m-20 -56.36 -42.3 77.57 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.254 -0.904 . . . . 1.1599999999999999 109.709 -179.974 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 353' ' ' ALA . . . . . . . . . . . . . . . -67.62 -23.02 65.32 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.271 -0.893 . . . . 0.63 109.93 -179.573 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 354' ' ' GLN . . . . . . . . . . . . . 2.4 mt-30 -83.48 -10.61 58.24 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.185 -0.947 . . . . 1.47 109.746 -179.736 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 355' ' ' ALA . . . . . . . . . . . . . . . -72.35 -2.41 19.1 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.173 -0.955 . . . . 1.01 109.813 179.945 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 356' ' ' GLY . . . . . . . . . . . . . . . -72.93 -60.83 3.73 Favored Glycine 0 N--CA 1.492 2.372 0 N-CA-C 109.878 -1.289 . . . . 1.3 109.878 -179.803 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 357' ' ' LYS . . . . . . . . . . . . . 25.3 mttt -84.87 143.05 29.29 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.212 -1.17 . . . . 4.0999999999999996 109.696 -179.68 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 358' ' ' GLU . . . . . . . . . . . . . 5.3 mt-10 -50.04 159.77 0.75 Allowed Pre-proline 0 N--CA 1.49 1.54 0 O-C-N 121.249 -0.907 . . . . 5.75 109.503 179.926 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 359' ' ' PRO . . . . . . . . . . . . . 2.5 Cg_endo -62.46 134.87 50.28 Favored 'Trans proline' 0 C--N 1.309 -1.543 0 C-N-CA 122.277 1.984 . . . . 5.0 110.182 179.918 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 360' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.309 0 CA-C-O 117.988 -1.451 . . . . 6.9699999999999998 109.544 179.953 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' B' B ' 319' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.489 1.495 0 N-CA-C 109.48 -0.563 . . . . 7.5499999999999998 109.48 . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 320' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER 55.04 -94.45 0.04 OUTLIER 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.293 -0.879 . . . . 6.4400000000000004 109.464 -179.983 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 321' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -158.43 132.24 4.96 Favored Pre-proline 0 N--CA 1.49 1.552 0 O-C-N 121.05 -1.031 . . . . 6.1299999999999999 109.438 179.989 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 322' ' ' PRO . . . . . . . . . . . . . 1.1 Cg_endo -64.19 -81.83 0.01 OUTLIER 'Trans proline' 0 C--N 1.311 -1.414 0 C-N-CA 122.048 1.832 . . . . 2.8199999999999998 110.272 -179.845 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 323' ' ' LEU . . . . . . . . . . . . . 73.0 mt -81.94 115.07 20.94 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.267 -0.895 . . . . 2.8399999999999999 109.669 -179.872 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 324' ' ' ASP . . . . . 0.481 ' N ' ' OD1' ' B' ' 324' ' ' ASP . 1.8 m-20 -80.17 141.3 35.81 Favored 'General case' 0 N--CA 1.489 1.497 0 O-C-N 121.23 -0.919 . . . . 1.53 109.163 179.764 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 325' ' ' GLY . . . . . . . . . . . . . . . -65.26 179.17 9.27 Favored Glycine 0 N--CA 1.489 2.197 0 N-CA-C 109.374 -1.49 . . . . 0.58999999999999997 109.374 179.968 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 326' ' ' GLU . . . . . . . . . . . . . 4.1 mm-40 -57.27 -179.34 0.04 OUTLIER 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.23 -1.159 . . . . 2.1299999999999999 109.208 179.971 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 327' ' ' TYR . . . . . 0.606 ' CE2' ' HG2' ' D' ' 333' ' ' ARG . 42.3 m-85 -147.55 96.1 2.63 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.322 -0.861 . . . . 0.47999999999999998 109.426 179.986 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 328' ' ' PHE . . . . . . . . . . . . . 58.1 m-85 -103.27 -160.2 0.76 Allowed 'General case' 0 N--CA 1.489 1.482 0 O-C-N 121.323 -0.861 . . . . 0.32000000000000001 109.57 -179.841 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 329' ' ' THR . . . . . . . . . . . . . 35.4 p -154.18 169.2 24.17 Favored 'General case' 0 N--CA 1.489 1.482 0 O-C-N 121.354 -0.841 . . . . 0.23000000000000001 108.987 179.825 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 330' ' ' LEU . . . . . . . . . . . . . 25.0 tp -151.34 133.04 14.89 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.084 -1.01 . . . . 0.28000000000000003 109.735 -179.765 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 331' ' ' GLN . . . . . . . . . . . . . 7.1 tp-100 -85.65 116.1 23.73 Favored 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.283 -0.885 . . . . 0.91000000000000003 108.999 179.546 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 332' ' ' ILE . . . . . 0.783 HG21 ' HA ' ' B' ' 338' ' ' PHE . 75.3 mt -103.44 104.3 16.46 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.523 0 O-C-N 121.258 -0.901 . . . . 0.23999999999999999 109.761 -179.669 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 333' ' ' ARG . . . . . 0.527 ' CG ' ' CE2' ' D' ' 327' ' ' TYR . 1.9 mpt_? -72.87 139.05 46.66 Favored 'General case' 0 N--CA 1.489 1.493 0 O-C-N 121.271 -0.893 . . . . 2.9300000000000002 109.352 179.737 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 334' ' ' GLY . . . . . . . . . . . . . . . 91.24 129.89 4.58 Favored Glycine 0 N--CA 1.489 2.206 0 N-CA-C 109.679 -1.369 . . . . 0.40000000000000002 109.679 179.906 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 335' ' ' ARG . . . . . 0.421 ' O ' ' HB3' ' B' ' 338' ' ' PHE . 57.5 ttt180 -79.15 -37.88 37.37 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.34 -1.094 . . . . 3.0099999999999998 109.581 -179.955 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 336' ' ' GLU . . . . . . . . . . . . . 5.0 mt-10 -57.95 -60.81 3.14 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.348 -0.845 . . . . 2.2799999999999998 109.719 -179.823 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 337' ' ' ARG . . . . . 0.511 ' CZ ' ' OD1' ' D' ' 352' ' ' ASP . 4.0 mtt180 -60.02 -28.53 67.81 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.188 -0.945 . . . . 2.9300000000000002 109.641 -179.806 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 338' ' ' PHE . . . . . 0.783 ' HA ' HG21 ' B' ' 332' ' ' ILE . 59.4 t80 -54.42 -60.41 3.38 Favored 'General case' 0 N--CA 1.488 1.458 0 O-C-N 121.184 -0.948 . . . . 0.37 109.397 179.969 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 339' ' ' GLU . . . . . . . . . . . . . 5.7 mt-10 -51.31 -31.23 20.88 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.248 -0.907 . . . . 1.98 109.781 -179.88 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 340' ' ' MET . . . . . . . . . . . . . 27.5 ttp -64.19 -52.64 57.92 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.221 -0.924 . . . . 0.32000000000000001 109.982 -179.711 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 341' ' ' PHE . . . . . . . . . . . . . 39.1 m-85 -61.72 -47.87 83.3 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.103 -0.998 . . . . 0.17999999999999999 109.78 -179.694 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 342' ' ' ARG . . . . . . . . . . . . . 9.8 ttt180 -49.62 -40.16 38.28 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.294 -0.879 . . . . 2.4199999999999999 109.828 -179.846 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 343' ' ' GLU . . . . . . . . . . . . . 4.2 tt0 -59.36 -49.64 77.04 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.227 -0.92 . . . . 2.3500000000000001 109.742 -179.745 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 344' ' ' LEU . . . . . 0.548 HD22 ' CD2' ' A' ' 344' ' ' LEU . 45.4 mt -61.88 -31.56 71.85 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.234 -0.916 . . . . 0.17999999999999999 109.597 -179.788 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 345' ' ' ASN . . . . . . . . . . . . . 16.7 t-20 -57.64 -58.0 10.26 Favored 'General case' 0 N--CA 1.489 1.483 0 O-C-N 121.235 -0.916 . . . . 1.0900000000000001 109.571 179.956 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 346' ' ' GLU . . . . . . . . . . . . . 36.8 tt0 -60.84 -29.35 69.45 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.354 -0.841 . . . . 1.6599999999999999 109.658 -179.901 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 347' ' ' ALA . . . . . 0.4 ' HB1' ' HB1' ' A' ' 347' ' ' ALA . . . -59.29 -58.41 8.76 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.24 -0.912 . . . . 0.17000000000000001 109.891 -179.774 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 348' ' ' LEU . . . . . 0.609 HD22 ' N ' ' B' ' 348' ' ' LEU . 4.1 mm? -61.5 -38.68 88.22 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.19 -0.944 . . . . 0.28999999999999998 109.737 -179.737 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 349' ' ' GLU . . . . . . . . . . . . . 9.3 mt-10 -57.86 -38.42 75.67 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.247 -0.908 . . . . 1.95 110.074 -179.539 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 350' ' ' LEU . . . . . 0.664 HD13 HD22 ' A' ' 350' ' ' LEU . 6.1 tt -62.69 -48.82 77.64 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.197 -0.94 . . . . 0.45000000000000001 109.659 -179.705 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 351' ' ' LYS . . . . . . . . . . . . . 5.8 tttt -59.26 -36.92 76.38 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.115 -0.99 . . . . 1.3799999999999999 109.525 -179.847 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 352' ' ' ASP . . . . . . . . . . . . . 55.4 m-20 -56.33 -42.34 77.53 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.26 -0.9 . . . . 1.1599999999999999 109.668 -179.96 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 353' ' ' ALA . . . . . . . . . . . . . . . -67.6 -23.22 65.36 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.217 -0.927 . . . . 0.60999999999999999 109.868 -179.504 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 354' ' ' GLN . . . . . . . . . . . . . 2.5 mt-30 -83.24 -10.67 58.43 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.194 -0.941 . . . . 1.45 109.812 -179.86 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 355' ' ' ALA . . . . . . . . . . . . . . . -72.25 -2.23 18.16 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.156 -0.965 . . . . 0.97999999999999998 109.771 179.924 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 356' ' ' GLY . . . . . . . . . . . . . . . -73.22 -60.88 3.63 Favored Glycine 0 N--CA 1.491 2.331 0 N-CA-C 109.797 -1.321 . . . . 1.29 109.797 -179.725 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 357' ' ' LYS . . . . . . . . . . . . . 25.5 mttt -84.82 143.2 29.24 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.199 -1.177 . . . . 4.0899999999999999 109.73 -179.757 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 358' ' ' GLU . . . . . . . . . . . . . 5.2 mt-10 -50.18 159.69 0.78 Allowed Pre-proline 0 N--CA 1.49 1.538 0 O-C-N 121.324 -0.86 . . . . 5.7199999999999998 109.417 179.997 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 359' ' ' PRO . . . . . . . . . . . . . 2.5 Cg_endo -62.42 135.0 51.11 Favored 'Trans proline' 0 C--N 1.31 -1.48 0 C-N-CA 122.132 1.888 . . . . 4.9800000000000004 110.185 -179.997 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 360' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.318 0 CA-C-O 117.984 -1.453 . . . . 6.9800000000000004 109.597 179.929 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' C' C ' 319' ' ' LYS . . . . . 0.458 ' O ' ' HB2' ' C' ' 320' ' ' LYS . 0.0 OUTLIER . . . . . 0 N--CA 1.489 1.514 0 N-CA-C 109.528 -0.545 . . . . 6.8200000000000003 109.528 . . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 320' ' ' LYS . . . . . 0.458 ' HB2' ' O ' ' C' ' 319' ' ' LYS . 16.8 mtpp 61.08 100.65 0.03 OUTLIER 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.291 -0.881 . . . . 6.4900000000000002 109.802 179.799 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 321' ' ' LYS . . . . . . . . . . . . . 8.9 mttm -82.96 153.24 66.84 Favored Pre-proline 0 N--CA 1.491 1.583 0 O-C-N 121.244 -0.91 . . . . 6.4000000000000004 109.297 179.684 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 322' ' ' PRO . . . . . . . . . . . . . 2.0 Cg_endo -62.36 172.12 4.65 Favored 'Trans proline' 0 C--N 1.311 -1.439 0 C-N-CA 122.298 1.999 . . . . 3.4199999999999999 110.702 -179.746 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 323' ' ' LEU . . . . . . . . . . . . . 28.7 mt -80.44 110.09 15.56 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.353 -0.842 . . . . 3.9500000000000002 109.167 179.705 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 324' ' ' ASP . . . . . . . . . . . . . 23.0 m-20 -80.78 -151.97 0.08 Allowed 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.216 -0.928 . . . . 1.6299999999999999 109.813 -179.667 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 325' ' ' GLY . . . . . . . . . . . . . . . -69.24 -168.23 5.69 Favored Glycine 0 N--CA 1.492 2.421 0 N-CA-C 109.781 -1.328 . . . . 0.72999999999999998 109.781 -179.677 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 326' ' ' GLU . . . . . . . . . . . . . 3.2 mm-40 -57.48 -171.81 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.319 -1.106 . . . . 2.1699999999999999 109.47 -179.975 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 327' ' ' TYR . . . . . 0.554 ' CE1' ' CG ' ' A' ' 333' ' ' ARG . 49.3 m-85 -149.05 101.71 3.18 Favored 'General case' 0 N--CA 1.488 1.46 0 O-C-N 121.333 -0.854 . . . . 0.47999999999999998 109.505 179.891 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 328' ' ' PHE . . . . . . . . . . . . . 63.9 m-85 -103.15 -165.85 1.21 Allowed 'General case' 0 N--CA 1.488 1.472 0 O-C-N 121.381 -0.824 . . . . 0.33000000000000002 109.129 179.985 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 329' ' ' THR . . . . . 0.478 ' HA ' ' O ' ' A' ' 330' ' ' LEU . 43.1 p -150.71 167.04 28.57 Favored 'General case' 0 N--CA 1.488 1.468 0 O-C-N 121.204 -0.935 . . . . 0.23000000000000001 109.353 -179.952 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 330' ' ' LEU . . . . . 0.455 ' O ' ' HA ' ' A' ' 329' ' ' THR . 17.7 tp -150.67 125.94 10.03 Favored 'General case' 0 C--N 1.303 -1.451 0 O-C-N 121.184 -0.948 . . . . 0.28000000000000003 109.939 -179.585 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 331' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -87.0 110.29 19.96 Favored 'General case' 0 N--CA 1.488 1.433 0 N-CA-C 108.554 -0.906 . . . . 1.48 108.554 179.236 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 332' ' ' ILE . . . . . 0.482 HG21 ' HA ' ' C' ' 338' ' ' PHE . 51.5 mt -100.87 111.44 30.56 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.521 0 O-C-N 121.232 -0.917 . . . . 0.23999999999999999 109.622 -179.382 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 333' ' ' ARG . . . . . 0.476 ' NH1' ' HG2' ' C' ' 333' ' ' ARG . 0.0 OUTLIER -72.71 153.07 41.34 Favored 'General case' 0 C--N 1.304 -1.374 0 O-C-N 121.395 -0.815 . . . . 2.7400000000000002 109.421 179.848 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' C' C ' 334' ' ' GLY . . . . . . . . . . . . . . . 73.97 118.67 0.08 OUTLIER Glycine 0 N--CA 1.491 2.323 0 N-CA-C 109.464 -1.455 . . . . 0.34999999999999998 109.464 -179.933 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 335' ' ' ARG . . . . . 0.564 ' HG3' ' CE2' ' A' ' 328' ' ' PHE . 4.6 ttt-85 -69.76 -30.39 67.96 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.251 -1.147 . . . . 2.5299999999999998 109.611 -179.826 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 336' ' ' GLU . . . . . . . . . . . . . 4.2 tt0 -57.89 -62.92 1.46 Allowed 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.134 -0.979 . . . . 2.6200000000000001 109.552 -179.828 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 337' ' ' ARG . . . . . 0.403 ' CZ ' ' OD1' ' A' ' 352' ' ' ASP . 2.3 mpt_? -60.5 -27.1 67.32 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.217 -0.927 . . . . 2.8100000000000001 109.588 -179.918 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 338' ' ' PHE . . . . . 0.482 ' HA ' HG21 ' C' ' 332' ' ' ILE . 61.2 t80 -54.58 -59.33 4.84 Favored 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.259 -0.901 . . . . 0.40000000000000002 109.536 -179.903 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 339' ' ' GLU . . . . . . . . . . . . . 1.5 mt-10 -52.56 -34.13 48.91 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.326 -0.859 . . . . 2.0499999999999998 109.884 -179.917 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 340' ' ' MET . . . . . . . . . . . . . 38.5 ttp -62.85 -49.98 72.76 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.194 -0.942 . . . . 0.32000000000000001 109.901 -179.558 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 341' ' ' PHE . . . . . 0.403 ' CD2' HD13 ' C' ' 332' ' ' ILE . 41.6 m-85 -62.59 -41.81 99.19 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.191 -0.943 . . . . 0.17999999999999999 109.724 -179.826 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 342' ' ' ARG . . . . . 0.449 ' NH1' ' HG3' ' C' ' 342' ' ' ARG . 0.0 OUTLIER -50.94 -43.68 60.23 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.323 -0.861 . . . . 2.9100000000000001 109.922 -179.83 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' C' C ' 343' ' ' GLU . . . . . . . . . . . . . 3.3 tp10 -58.53 -45.72 88.27 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.166 -0.959 . . . . 2.1400000000000001 109.725 -179.599 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 344' ' ' LEU . . . . . 0.465 HD22 ' CD2' ' D' ' 344' ' ' LEU . 81.0 mt -61.76 -37.63 85.01 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.18 -0.95 . . . . 0.22 109.499 -179.809 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 345' ' ' ASN . . . . . 0.436 ' O ' ' HG3' ' C' ' 349' ' ' GLU . 16.9 t-20 -58.74 -54.18 50.01 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.232 -0.917 . . . . 1.0800000000000001 109.567 179.929 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 346' ' ' GLU . . . . . . . . . . . . . 1.3 tm-20 -60.3 -32.12 70.91 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.283 -0.886 . . . . 2.21 109.792 -179.661 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 347' ' ' ALA . . . . . 0.703 ' HB1' ' HB1' ' D' ' 347' ' ' ALA . . . -59.44 -60.55 3.68 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.142 -0.974 . . . . 0.17999999999999999 109.828 -179.856 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 348' ' ' LEU . . . . . 0.637 ' N ' HD22 ' C' ' 348' ' ' LEU . 4.0 mm? -61.05 -31.57 71.22 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.2 -0.938 . . . . 0.32000000000000001 109.453 -179.836 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 349' ' ' GLU . . . . . 0.436 ' HG3' ' O ' ' C' ' 345' ' ' ASN . 7.6 mt-10 -59.46 -48.4 81.8 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.247 -0.908 . . . . 2.1899999999999999 110.013 -179.644 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 350' ' ' LEU . . . . . 0.66 HD13 HD22 ' D' ' 350' ' ' LEU . 6.6 tt -62.83 -38.56 91.25 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.069 -1.019 . . . . 0.46000000000000002 109.73 -179.623 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 351' ' ' LYS . . . . . . . . . . . . . 20.8 ttmt -58.08 -46.7 85.04 Favored 'General case' 0 N--CA 1.487 1.42 0 O-C-N 121.138 -0.976 . . . . 1.3500000000000001 109.204 179.921 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 352' ' ' ASP . . . . . . . . . . . . . 3.4 m-20 -56.71 -41.21 77.01 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.261 -0.899 . . . . 1.1899999999999999 109.576 179.863 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 353' ' ' ALA . . . . . . . . . . . . . . . -67.43 -25.26 65.83 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.29 -0.881 . . . . 0.56999999999999995 109.805 -179.647 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 354' ' ' GLN . . . . . . . . . . . . . 10.2 tt0 -81.52 -8.83 59.77 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.166 -0.959 . . . . 1.47 109.357 179.94 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 355' ' ' ALA . . . . . . . . . . . . . . . -70.77 -39.7 73.07 Favored 'General case' 0 N--CA 1.488 1.465 0 O-C-N 121.223 -0.923 . . . . 0.93000000000000005 109.014 179.673 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 356' ' ' GLY . . . . . . . . . . . . . . . -80.23 1.82 79.14 Favored Glycine 0 N--CA 1.49 2.245 0 N-CA-C 109.663 -1.375 . . . . 1.3300000000000001 109.663 179.82 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 357' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -84.74 170.36 13.32 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.146 -1.208 . . . . 4.0099999999999998 109.501 -179.907 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 358' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -49.49 160.19 0.6 Allowed Pre-proline 0 N--CA 1.49 1.567 0 O-C-N 121.263 -0.898 . . . . 5.75 109.453 -179.903 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 359' ' ' PRO . . . . . . . . . . . . . 1.0 OUTLIER -65.8 -6.38 13.95 Favored 'Trans proline' 0 C--N 1.31 -1.457 0 C-N-CA 122.194 1.929 . . . . 4.9400000000000004 110.406 179.904 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 360' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.302 0 N-CA-C 109.465 -1.454 . . . . 6.5 109.465 179.907 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' D' D ' 319' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.49 1.556 0 N-CA-C 109.5 -0.555 . . . . 7.5300000000000002 109.5 . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' D' D ' 320' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER 55.07 -94.46 0.04 OUTLIER 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.281 -0.887 . . . . 6.4100000000000001 109.488 -179.904 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' D' D ' 321' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -158.46 132.22 4.94 Favored Pre-proline 0 N--CA 1.491 1.579 0 O-C-N 121.161 -0.962 . . . . 6.1100000000000003 109.392 179.939 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' D' D ' 322' ' ' PRO . . . . . . . . . . . . . 1.1 Cg_endo -64.15 -81.72 0.01 OUTLIER 'Trans proline' 0 C--N 1.312 -1.354 0 C-N-CA 121.984 1.789 . . . . 2.8199999999999998 110.33 -179.87 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' D' D ' 323' ' ' LEU . . . . . . . . . . . . . 72.9 mt -82.01 115.01 20.97 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.202 -0.936 . . . . 2.8300000000000001 109.625 -179.878 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' D' D ' 324' ' ' ASP . . . . . 0.47 ' N ' ' OD1' ' D' ' 324' ' ' ASP . 1.8 m-20 -79.81 142.33 35.42 Favored 'General case' 0 N--CA 1.488 1.452 0 O-C-N 121.262 -0.899 . . . . 1.54 109.049 179.659 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' D' D ' 325' ' ' GLY . . . . . . . . . . . . . . . -66.74 179.16 13.44 Favored Glycine 0 N--CA 1.489 2.22 0 N-CA-C 109.241 -1.544 . . . . 0.58999999999999997 109.241 -179.948 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' D' D ' 326' ' ' GLU . . . . . . . . . . . . . 4.2 mm-40 -56.98 -179.6 0.04 OUTLIER 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.155 -1.203 . . . . 2.1299999999999999 109.214 -179.961 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' D' D ' 327' ' ' TYR . . . . . 0.527 ' CE2' ' CG ' ' B' ' 333' ' ' ARG . 42.1 m-85 -147.38 96.04 2.64 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.299 -0.875 . . . . 0.46999999999999997 109.396 -179.967 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' D' D ' 328' ' ' PHE . . . . . . . . . . . . . 58.1 m-85 -103.27 -160.35 0.77 Allowed 'General case' 0 N--CA 1.489 1.48 0 O-C-N 121.395 -0.816 . . . . 0.29999999999999999 109.639 -179.842 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' D' D ' 329' ' ' THR . . . . . . . . . . . . . 35.7 p -154.1 169.24 24.02 Favored 'General case' 0 N--CA 1.489 1.477 0 O-C-N 121.355 -0.841 . . . . 0.22 108.95 179.869 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' D' D ' 330' ' ' LEU . . . . . . . . . . . . . 24.9 tp -151.4 133.09 14.87 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.206 -0.934 . . . . 0.28000000000000003 109.796 -179.692 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' D' D ' 331' ' ' GLN . . . . . . . . . . . . . 7.1 tp-100 -85.82 115.96 23.78 Favored 'General case' 0 N--CA 1.489 1.494 0 O-C-N 121.325 -0.859 . . . . 0.93000000000000005 109.037 179.646 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' D' D ' 332' ' ' ILE . . . . . 0.78 HG21 ' HA ' ' D' ' 338' ' ' PHE . 75.3 mt -103.35 104.42 16.62 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.558 0 O-C-N 121.166 -0.959 . . . . 0.25 109.8 -179.603 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' D' D ' 333' ' ' ARG . . . . . 0.606 ' HG2' ' CE2' ' B' ' 327' ' ' TYR . 2.0 mpt_? -72.73 138.82 46.78 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.294 -0.879 . . . . 2.9300000000000002 109.36 179.738 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' D' D ' 334' ' ' GLY . . . . . . . . . . . . . . . 91.31 129.9 4.61 Favored Glycine 0 N--CA 1.491 2.313 0 N-CA-C 109.645 -1.382 . . . . 0.40999999999999998 109.645 179.838 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' D' D ' 335' ' ' ARG . . . . . 0.415 ' O ' ' HB3' ' D' ' 338' ' ' PHE . 57.6 ttt180 -79.12 -37.9 37.48 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.36 -1.082 . . . . 3.0299999999999998 109.57 -179.957 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' D' D ' 336' ' ' GLU . . . . . . . . . . . . . 5.1 mt-10 -57.9 -60.94 2.95 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.292 -0.88 . . . . 2.2599999999999998 109.774 -179.86 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' D' D ' 337' ' ' ARG . . . . . . . . . . . . . 4.0 mtt180 -59.96 -28.43 67.64 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.15 -0.968 . . . . 2.9199999999999999 109.693 -179.908 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' D' D ' 338' ' ' PHE . . . . . 0.78 ' HA ' HG21 ' D' ' 332' ' ' ILE . 59.5 t80 -54.56 -60.19 3.69 Favored 'General case' 0 N--CA 1.488 1.464 0 O-C-N 121.244 -0.91 . . . . 0.37 109.486 179.991 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' D' D ' 339' ' ' GLU . . . . . . . . . . . . . 5.7 mt-10 -51.35 -31.27 21.46 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.191 -0.943 . . . . 1.99 109.76 -179.951 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' D' D ' 340' ' ' MET . . . . . . . . . . . . . 27.4 ttp -64.18 -52.69 57.72 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.286 -0.884 . . . . 0.31 109.964 -179.715 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' D' D ' 341' ' ' PHE . . . . . . . . . . . . . 38.9 m-85 -61.83 -47.72 83.8 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.138 -0.976 . . . . 0.17999999999999999 109.794 -179.638 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' D' D ' 342' ' ' ARG . . . . . . . . . . . . . 9.8 ttt180 -49.7 -40.12 39.23 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.21 -0.931 . . . . 2.4100000000000001 109.85 -179.864 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' D' D ' 343' ' ' GLU . . . . . . . . . . . . . 4.2 tt0 -59.32 -49.81 76.41 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.147 -0.971 . . . . 2.3500000000000001 109.742 -179.76 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' D' D ' 344' ' ' LEU . . . . . 0.465 ' CD2' HD22 ' C' ' 344' ' ' LEU . 45.2 mt -61.85 -31.34 71.59 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.276 -0.89 . . . . 0.19 109.616 -179.787 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' D' D ' 345' ' ' ASN . . . . . . . . . . . . . 16.3 t-20 -57.88 -57.81 11.14 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.279 -0.888 . . . . 1.0900000000000001 109.526 -179.978 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' D' D ' 346' ' ' GLU . . . . . . . . . . . . . 36.6 tt0 -61.03 -29.2 69.58 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.43 -0.794 . . . . 1.6899999999999999 109.682 -179.878 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' D' D ' 347' ' ' ALA . . . . . 0.703 ' HB1' ' HB1' ' C' ' 347' ' ' ALA . . . -59.36 -58.35 9.0 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.239 -0.913 . . . . 0.17999999999999999 109.827 -179.827 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' D' D ' 348' ' ' LEU . . . . . 0.608 HD22 ' N ' ' D' ' 348' ' ' LEU . 4.1 mm? -61.65 -38.55 88.13 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.271 -0.893 . . . . 0.31 109.772 -179.656 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' D' D ' 349' ' ' GLU . . . . . . . . . . . . . 9.3 mt-10 -58.02 -38.33 76.0 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.228 -0.92 . . . . 1.95 110.013 -179.588 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' D' D ' 350' ' ' LEU . . . . . 0.66 HD22 HD13 ' C' ' 350' ' ' LEU . 6.1 tt -62.7 -48.83 77.57 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.11 -0.994 . . . . 0.42999999999999999 109.697 -179.757 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' D' D ' 351' ' ' LYS . . . . . . . . . . . . . 5.9 tttt -59.21 -36.86 76.14 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.14 -0.975 . . . . 1.3999999999999999 109.6 -179.895 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' D' D ' 352' ' ' ASP . . . . . 0.511 ' OD1' ' CZ ' ' B' ' 337' ' ' ARG . 55.5 m-20 -56.47 -42.33 78.05 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.332 -0.855 . . . . 1.1699999999999999 109.664 -179.972 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' D' D ' 353' ' ' ALA . . . . . . . . . . . . . . . -67.59 -23.07 65.35 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.219 -0.925 . . . . 0.58999999999999997 109.913 -179.598 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' D' D ' 354' ' ' GLN . . . . . . . . . . . . . 2.5 mt-30 -83.29 -10.76 58.33 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.048 -1.033 . . . . 1.4399999999999999 109.762 -179.844 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' D' D ' 355' ' ' ALA . . . . . . . . . . . . . . . -72.23 -2.41 18.78 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.262 -0.898 . . . . 0.97999999999999998 109.913 179.959 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' D' D ' 356' ' ' GLY . . . . . . . . . . . . . . . -73.16 -60.67 3.73 Favored Glycine 0 N--CA 1.491 2.354 0 N-CA-C 109.825 -1.31 . . . . 1.28 109.825 -179.73 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' D' D ' 357' ' ' LYS . . . . . . . . . . . . . 25.8 mttt -84.91 143.13 29.2 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.154 -1.204 . . . . 4.0899999999999999 109.663 -179.731 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' D' D ' 358' ' ' GLU . . . . . . . . . . . . . 5.2 mt-10 -50.16 159.67 0.78 Allowed Pre-proline 0 N--CA 1.491 1.587 0 O-C-N 121.298 -0.876 . . . . 5.71 109.423 179.941 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' D' D ' 359' ' ' PRO . . . . . . . . . . . . . 2.5 Cg_endo -62.47 134.89 50.34 Favored 'Trans proline' 0 C--N 1.31 -1.474 0 C-N-CA 122.233 1.955 . . . . 4.9699999999999998 110.126 -179.981 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' D' D ' 360' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.323 0 N-CA-C 109.538 -1.425 . . . . 6.9699999999999998 109.538 -179.988 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 319' ' ' LYS . . . . . . . . . . . . . 6.6 mttt . . . . . 0 N--CA 1.491 1.594 0 N-CA-C 109.268 -0.642 . . . . 7.5499999999999998 109.268 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 320' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 61.54 84.88 0.13 Allowed 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.256 -0.903 . . . . 6.4299999999999997 109.58 179.936 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 321' ' ' LYS . . . . . . . . . . . . . 13.2 mtpt -157.5 98.36 1.94 Allowed Pre-proline 0 N--CA 1.491 1.587 0 O-C-N 121.399 -0.813 . . . . 6.1299999999999999 109.339 -179.954 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 322' ' ' PRO . . . . . . . . . . . . . 3.0 Cg_exo -61.22 -81.99 0.01 OUTLIER 'Trans proline' 0 C--N 1.311 -1.428 0 C-N-CA 122.021 1.814 . . . . 2.8300000000000001 109.889 -179.881 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 323' ' ' LEU . . . . . . . . . . . . . 30.5 mt -81.47 111.86 18.19 Favored 'General case' 0 N--CA 1.488 1.467 0 O-C-N 121.264 -0.897 . . . . 2.8300000000000001 109.307 179.634 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 324' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -80.03 -126.15 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.276 -0.89 . . . . 1.53 109.432 -179.784 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 325' ' ' GLY . . . . . 0.45 ' O ' ' CE1' ' A' ' 327' ' ' TYR . . . -69.18 -165.93 4.46 Favored Glycine 0 N--CA 1.491 2.35 0 N-CA-C 109.554 -1.418 . . . . 0.60999999999999999 109.554 -179.99 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 326' ' ' GLU . . . . . 0.427 ' O ' ' CD1' ' A' ' 327' ' ' TYR . 70.0 mm-40 -59.14 -179.61 0.08 Allowed 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.413 -1.051 . . . . 2.1299999999999999 109.579 179.785 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 327' ' ' TYR . . . . . 0.604 ' CE2' ' HG2' ' C' ' 333' ' ' ARG . 46.6 m-85 -149.54 110.15 4.26 Favored 'General case' 0 N--CA 1.487 1.42 0 O-C-N 121.484 -0.76 . . . . 0.47999999999999998 109.0 179.573 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 328' ' ' PHE . . . . . 0.424 ' CE1' ' HB3' ' A' ' 326' ' ' GLU . 54.8 m-85 -112.22 -167.99 1.26 Allowed 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.185 -0.947 . . . . 0.31 109.602 -179.696 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 329' ' ' THR . . . . . . . . . . . . . 53.3 p -152.06 164.81 36.46 Favored 'General case' 0 N--CA 1.488 1.457 0 O-C-N 121.416 -0.802 . . . . 0.22 108.973 -179.878 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 330' ' ' LEU . . . . . 0.435 ' O ' ' HA ' ' C' ' 329' ' ' THR . 19.1 tp -151.2 131.22 13.41 Favored 'General case' 0 C--N 1.301 -1.507 0 O-C-N 121.127 -0.983 . . . . 0.28000000000000003 109.769 -179.606 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 331' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -85.37 116.49 23.73 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.223 -0.923 . . . . 0.91000000000000003 108.989 179.524 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 332' ' ' ILE . . . . . 0.797 HG21 ' HA ' ' A' ' 338' ' ' PHE . 86.3 mt -101.52 103.44 14.91 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.53 0 O-C-N 121.281 -0.887 . . . . 0.26000000000000001 109.742 -179.619 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 333' ' ' ARG . . . . . 0.601 ' HG3' ' CD1' ' C' ' 327' ' ' TYR . 3.7 mpt_? -70.27 149.42 47.44 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.238 -0.914 . . . . 2.9199999999999999 109.199 179.632 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 334' ' ' GLY . . . . . . . . . . . . . . . 78.29 125.37 0.37 Allowed Glycine 0 N--CA 1.49 2.294 0 N-CA-C 109.6 -1.4 . . . . 0.40000000000000002 109.6 -179.799 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 335' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -74.62 -36.02 62.93 Favored 'General case' 0 N--CA 1.489 1.494 0 O-C-N 121.36 -1.082 . . . . 3.0099999999999998 109.546 179.956 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 336' ' ' GLU . . . . . . . . . . . . . 27.8 mt-10 -57.77 -58.95 6.1 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.149 -0.969 . . . . 2.29 109.739 -179.562 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 337' ' ' ARG . . . . . 0.644 ' NH1' HD12 ' C' ' 348' ' ' LEU . 15.8 mmt180 -60.77 -28.92 69.1 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.222 -0.924 . . . . 2.9300000000000002 110.178 -179.573 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 338' ' ' PHE . . . . . 0.797 ' HA ' HG21 ' A' ' 332' ' ' ILE . 41.8 t80 -57.31 -58.88 6.33 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.087 -1.008 . . . . 0.38 110.126 -179.655 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 339' ' ' GLU . . . . . . . . . . . . . 3.5 mt-10 -52.07 -33.91 41.35 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.132 -0.98 . . . . 1.97 110.165 -179.399 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 340' ' ' MET . . . . . . . . . . . . . 32.8 ttp -63.72 -49.94 71.1 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.21 -0.931 . . . . 0.31 109.965 -179.577 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 341' ' ' PHE . . . . . 0.519 ' CZ ' ' HA ' ' C' ' 345' ' ' ASN . 35.6 m-85 -62.14 -44.1 97.37 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.117 -0.99 . . . . 0.17999999999999999 110.038 -179.646 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 342' ' ' ARG . . . . . 0.479 ' HG2' ' NH1' ' A' ' 342' ' ' ARG . 0.1 OUTLIER -48.98 -45.48 42.29 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.236 -0.915 . . . . 2.4199999999999999 110.118 -179.537 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 343' ' ' GLU . . . . . . . . . . . . . 5.4 tt0 -57.83 -47.9 81.3 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.28 -0.888 . . . . 2.3500000000000001 109.977 -179.606 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 344' ' ' LEU . . . . . 0.413 ' O ' ' HB3' ' A' ' 347' ' ' ALA . 50.0 mt -61.36 -32.05 71.95 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.055 -1.028 . . . . 0.17999999999999999 109.734 -179.715 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 345' ' ' ASN . . . . . 0.464 ' HA ' ' CZ ' ' C' ' 341' ' ' PHE . 17.0 t-20 -56.81 -60.73 3.13 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.326 -0.858 . . . . 1.0900000000000001 109.752 -179.783 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 346' ' ' GLU . . . . . . . . . . . . . 4.3 tt0 -61.19 -24.41 66.3 Favored 'General case' 0 N--CA 1.488 1.438 0 O-C-N 121.269 -0.895 . . . . 1.6499999999999999 109.785 -179.801 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 347' ' ' ALA . . . . . 0.496 ' HB1' ' HB1' ' B' ' 347' ' ' ALA . . . -60.34 -61.76 2.37 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.213 -0.929 . . . . 0.17999999999999999 110.097 -179.728 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 348' ' ' LEU . . . . . 0.806 HD12 ' NH1' ' C' ' 337' ' ' ARG . 3.5 mm? -61.52 -47.43 85.63 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.165 -0.96 . . . . 0.29999999999999999 109.857 -179.455 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 349' ' ' GLU . . . . . . . . . . . . . 3.3 mm-40 -56.21 -30.6 62.53 Favored 'General case' 0 C--N 1.301 -1.539 0 O-C-N 121.17 -0.956 . . . . 1.9399999999999999 109.87 -179.307 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 350' ' ' LEU . . . . . 0.803 HD23 ' O ' ' A' ' 350' ' ' LEU . 4.0 tt -65.1 -45.1 86.58 Favored 'General case' 0 N--CA 1.488 1.463 0 O-C-N 121.217 -0.927 . . . . 0.46000000000000002 109.621 -179.743 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 351' ' ' LYS . . . . . . . . . . . . . 28.5 tttt -59.94 -50.72 72.64 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.263 -0.898 . . . . 1.3999999999999999 109.587 -179.836 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 352' ' ' ASP . . . . . . . . . . . . . 66.0 m-20 -55.8 -37.56 68.77 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.153 -0.967 . . . . 1.1599999999999999 109.689 -179.848 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 353' ' ' ALA . . . . . . . . . . . . . . . -65.36 -35.65 81.6 Favored 'General case' 0 N--CA 1.488 1.467 0 O-C-N 121.269 -0.894 . . . . 0.63 109.492 -179.834 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 354' ' ' GLN . . . . . . . . . . . . . 12.2 tt0 -82.92 -11.19 58.38 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.287 -0.883 . . . . 1.47 109.353 179.839 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 355' ' ' ALA . . . . . . . . . . . . . . . -72.78 -30.72 64.33 Favored 'General case' 0 N--CA 1.488 1.474 0 O-C-N 121.153 -0.967 . . . . 1.01 109.429 179.936 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 356' ' ' GLY . . . . . . . . . . . . . . . -79.78 -6.84 88.91 Favored Glycine 0 N--CA 1.489 2.211 0 N-CA-C 109.562 -1.415 . . . . 1.3 109.562 -179.902 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 357' ' ' LYS . . . . . . . . . . . . . 28.8 mtpt -92.13 -11.76 34.78 Favored 'General case' 0 N--CA 1.488 1.443 0 O-C-N 121.22 -1.165 . . . . 4.0999999999999996 109.201 179.691 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 358' ' ' GLU . . . . . 0.428 ' HG2' ' HD2' ' A' ' 359' ' ' PRO . 0.3 OUTLIER -54.78 128.16 62.42 Favored Pre-proline 0 N--CA 1.49 1.569 0 O-C-N 121.309 -0.87 . . . . 5.75 109.636 -179.814 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 359' ' ' PRO . . . . . 0.428 ' HD2' ' HG2' ' A' ' 358' ' ' GLU . 1.9 Cg_endo -64.51 110.55 1.44 Allowed 'Trans proline' 0 C--N 1.313 -1.326 0 C-N-CA 121.802 1.668 . . . . 5.0 109.637 179.478 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 360' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.196 0 N-CA-C 109.49 -1.444 . . . . 6.9699999999999998 109.49 -179.987 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' B' B ' 319' ' ' LYS . . . . . . . . . . . . . 7.2 mttt . . . . . 0 N--CA 1.491 1.614 0 CA-C-O 121.218 0.532 . . . . 7.5499999999999998 109.604 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' B' B ' 320' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 61.95 85.18 0.13 Allowed 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.276 -0.89 . . . . 6.4400000000000004 109.41 179.89 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 321' ' ' LYS . . . . . . . . . . . . . 10.7 mtpt -157.94 98.03 1.86 Allowed Pre-proline 0 N--CA 1.489 1.522 0 O-C-N 121.215 -0.928 . . . . 6.1299999999999999 109.225 179.953 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 322' ' ' PRO . . . . . . . . . . . . . 2.6 Cg_endo -61.69 -81.1 0.01 OUTLIER 'Trans proline' 0 C--N 1.312 -1.348 0 C-N-CA 121.997 1.798 . . . . 2.8199999999999998 110.005 -179.92 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 323' ' ' LEU . . . . . . . . . . . . . 27.8 mt -81.96 112.24 18.87 Favored 'General case' 0 C--N 1.303 -1.437 0 O-C-N 121.008 -1.058 . . . . 2.8399999999999999 109.145 179.674 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 324' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -80.2 -126.03 0.02 OUTLIER 'General case' 0 C--N 1.304 -1.408 0 O-C-N 121.179 -0.951 . . . . 1.53 109.3 -179.882 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 325' ' ' GLY . . . . . 0.45 ' O ' ' CE1' ' B' ' 327' ' ' TYR . . . -69.54 -166.15 4.98 Favored Glycine 0 N--CA 1.49 2.285 0 N-CA-C 109.877 -1.289 . . . . 0.58999999999999997 109.877 -179.841 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 326' ' ' GLU . . . . . 0.425 ' HB3' ' CE1' ' B' ' 328' ' ' PHE . 70.8 mm-40 -59.19 -179.39 0.07 Allowed 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.255 -1.144 . . . . 2.1299999999999999 109.535 -179.868 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 327' ' ' TYR . . . . . 0.59 ' CE2' ' HG3' ' D' ' 333' ' ' ARG . 45.8 m-85 -150.15 109.46 3.96 Favored 'General case' 0 N--CA 1.487 1.421 0 O-C-N 121.274 -0.891 . . . . 0.47999999999999998 108.851 179.769 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 328' ' ' PHE . . . . . 0.442 ' HB2' ' CD1' ' D' ' 338' ' ' PHE . 53.0 m-85 -111.84 -167.44 1.18 Allowed 'General case' 0 N--CA 1.488 1.473 0 O-C-N 121.326 -0.859 . . . . 0.32000000000000001 109.666 -179.635 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 329' ' ' THR . . . . . . . . . . . . . 59.1 p -152.28 163.64 39.04 Favored 'General case' 0 C--N 1.302 -1.477 0 O-C-N 121.389 -0.82 . . . . 0.23000000000000001 109.144 -179.889 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 330' ' ' LEU . . . . . . . . . . . . . 17.3 tp -150.12 131.68 14.84 Favored 'General case' 0 N--CA 1.488 1.46 0 O-C-N 121.166 -0.958 . . . . 0.28000000000000003 109.743 -179.84 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 331' ' ' GLN . . . . . . . . . . . . . 1.4 tt0 -85.77 116.78 24.24 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.373 -0.829 . . . . 0.91000000000000003 108.906 179.587 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 332' ' ' ILE . . . . . 0.79 HG21 ' HA ' ' B' ' 338' ' ' PHE . 85.1 mt -101.97 104.04 15.83 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.489 0 O-C-N 121.207 -0.933 . . . . 0.23999999999999999 109.513 -179.573 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 333' ' ' ARG . . . . . 0.518 ' HG3' ' CE2' ' D' ' 327' ' ' TYR . 4.1 mpt_? -71.21 150.48 45.27 Favored 'General case' 0 C--N 1.305 -1.365 0 O-C-N 121.255 -0.903 . . . . 2.9300000000000002 109.011 179.746 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 334' ' ' GLY . . . . . . . . . . . . . . . 77.58 126.17 0.33 Allowed Glycine 0 N--CA 1.489 2.175 0 N-CA-C 109.388 -1.485 . . . . 0.40000000000000002 109.388 -179.986 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 335' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -75.22 -36.91 61.32 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.413 -1.051 . . . . 3.0099999999999998 109.608 -179.727 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 336' ' ' GLU . . . . . . . . . . . . . 38.7 mt-10 -56.96 -57.49 12.29 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.39 -0.819 . . . . 2.2799999999999998 110.069 -179.593 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 337' ' ' ARG . . . . . . . . . . . . . 17.0 mmt180 -62.38 -29.24 70.34 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.229 -0.919 . . . . 2.9300000000000002 109.877 -179.635 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 338' ' ' PHE . . . . . 0.79 ' HA ' HG21 ' B' ' 332' ' ' ILE . 44.5 t80 -56.57 -59.94 4.27 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.26 -0.9 . . . . 0.37 110.121 -179.692 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 339' ' ' GLU . . . . . . . . . . . . . 4.2 mt-10 -51.98 -33.44 38.0 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.238 -0.914 . . . . 1.98 110.102 -179.347 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 340' ' ' MET . . . . . . . . . . . . . 31.8 ttp -63.89 -49.68 71.74 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.066 -1.021 . . . . 0.32000000000000001 109.822 -179.578 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 341' ' ' PHE . . . . . . . . . . . . . 35.4 m-85 -62.31 -44.28 96.87 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.163 -0.961 . . . . 0.17999999999999999 110.04 -179.54 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 342' ' ' ARG . . . . . 0.474 ' NH1' ' HG2' ' B' ' 342' ' ' ARG . 0.1 OUTLIER -49.33 -44.62 44.58 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.283 -0.886 . . . . 2.4199999999999999 110.096 -179.576 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' B' B ' 343' ' ' GLU . . . . . . . . . . . . . 4.6 tt0 -58.18 -47.27 83.92 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.196 -0.94 . . . . 2.3500000000000001 109.914 -179.393 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 344' ' ' LEU . . . . . . . . . . . . . 50.3 mt -62.11 -31.68 72.16 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.309 -0.87 . . . . 0.17999999999999999 109.954 -179.825 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 345' ' ' ASN . . . . . 0.49 ' HA ' ' CZ ' ' D' ' 341' ' ' PHE . 17.0 t-20 -57.43 -60.48 3.58 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.232 -0.918 . . . . 1.0900000000000001 109.849 -179.683 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 346' ' ' GLU . . . . . . . . . . . . . 4.0 tt0 -61.1 -24.61 66.37 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.304 -0.872 . . . . 1.6599999999999999 109.791 -179.655 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 347' ' ' ALA . . . . . 0.496 ' HB1' ' HB1' ' A' ' 347' ' ' ALA . . . -60.18 -61.86 2.29 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.147 -0.971 . . . . 0.17000000000000001 110.016 -179.7 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 348' ' ' LEU . . . . . 0.589 HD22 ' N ' ' B' ' 348' ' ' LEU . 3.5 mm? -61.3 -47.73 84.61 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.234 -0.916 . . . . 0.28999999999999998 109.917 -179.418 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 349' ' ' GLU . . . . . . . . . . . . . 3.6 mm-40 -56.25 -30.3 62.21 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.174 -0.954 . . . . 1.95 109.825 -179.383 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 350' ' ' LEU . . . . . 0.756 HD23 ' O ' ' B' ' 350' ' ' LEU . 4.2 tt -65.17 -45.95 82.79 Favored 'General case' 0 N--CA 1.489 1.492 0 O-C-N 121.116 -0.99 . . . . 0.45000000000000001 109.328 179.912 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 351' ' ' LYS . . . . . . . . . . . . . 29.3 tttt -59.33 -51.5 69.69 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.233 -0.917 . . . . 1.3799999999999999 109.646 -179.898 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 352' ' ' ASP . . . . . . . . . . . . . 67.3 m-20 -55.35 -37.62 67.72 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.236 -0.915 . . . . 1.1599999999999999 109.748 -179.757 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 353' ' ' ALA . . . . . . . . . . . . . . . -65.68 -34.94 79.37 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.377 -0.827 . . . . 0.60999999999999999 109.403 -179.581 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 354' ' ' GLN . . . . . . . . . . . . . 14.4 tt0 -83.46 -11.79 57.1 Favored 'General case' 0 N--CA 1.487 1.421 0 O-C-N 121.201 -0.937 . . . . 1.45 109.225 179.775 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 355' ' ' ALA . . . . . . . . . . . . . . . -72.03 -31.28 66.02 Favored 'General case' 0 N--CA 1.488 1.467 0 O-C-N 121.07 -1.019 . . . . 0.97999999999999998 109.419 179.999 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 356' ' ' GLY . . . . . . . . . . . . . . . -79.22 -6.88 88.78 Favored Glycine 0 N--CA 1.49 2.263 0 N-CA-C 109.504 -1.438 . . . . 1.29 109.504 -179.97 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 357' ' ' LYS . . . . . . . . . . . . . 27.6 mtpt -90.66 -12.52 36.53 Favored 'General case' 0 N--CA 1.489 1.482 0 O-C-N 121.137 -1.213 . . . . 4.0899999999999999 109.134 179.578 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 358' ' ' GLU . . . . . 0.435 ' HG2' ' HD2' ' B' ' 359' ' ' PRO . 0.3 OUTLIER -54.19 127.5 55.86 Favored Pre-proline 0 N--CA 1.49 1.556 0 O-C-N 121.372 -0.83 . . . . 5.7199999999999998 109.787 -179.842 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' B' B ' 359' ' ' PRO . . . . . 0.435 ' HD2' ' HG2' ' B' ' 358' ' ' GLU . 1.7 Cg_endo -64.83 110.79 1.54 Allowed 'Trans proline' 0 C--N 1.312 -1.395 0 C-N-CA 122.123 1.882 . . . . 4.9800000000000004 109.649 179.37 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 360' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.272 0 CA-C-O 117.873 -1.515 . . . . 6.9800000000000004 109.571 -179.954 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' C' C ' 319' ' ' LYS . . . . . . . . . . . . . 6.4 mttm . . . . . 0 N--CA 1.493 1.677 0 N-CA-C 109.354 -0.61 . . . . 6.8200000000000003 109.354 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' C' C ' 320' ' ' LYS . . . . . . . . . . . . . 1.5 tttt 67.72 94.62 0.07 Allowed 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.206 -0.934 . . . . 6.4900000000000002 109.934 179.399 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 321' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -161.98 93.03 1.34 Allowed Pre-proline 0 N--CA 1.49 1.565 0 O-C-N 121.271 -0.893 . . . . 6.4000000000000004 109.462 179.787 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' C' C ' 322' ' ' PRO . . . . . . . . . . . . . 3.5 Cg_exo -60.06 111.0 0.86 Allowed 'Trans proline' 0 C--N 1.309 -1.543 0 C-N-CA 122.034 1.823 . . . . 3.4199999999999999 110.271 179.731 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 323' ' ' LEU . . . . . . . . . . . . . 45.1 mt -80.86 119.91 24.03 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.401 -0.812 . . . . 3.9500000000000002 109.08 179.966 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 324' ' ' ASP . . . . . . . . . . . . . 15.6 m-20 -83.94 31.26 0.49 Allowed 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.196 -0.94 . . . . 1.6299999999999999 110.034 -179.949 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 325' ' ' GLY . . . . . 0.579 ' O ' ' CD2' ' C' ' 327' ' ' TYR . . . -67.1 167.36 39.41 Favored Glycine 0 N--CA 1.487 2.074 0 N-CA-C 108.427 -1.869 . . . . 0.72999999999999998 108.427 179.634 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' C' C ' 326' ' ' GLU . . . . . 0.424 ' HB3' ' CE1' ' C' ' 328' ' ' PHE . 3.0 mm-40 -56.71 162.17 2.44 Favored 'General case' 0 C--N 1.302 -1.488 0 O-C-N 120.885 -1.362 . . . . 2.1699999999999999 108.972 -179.729 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' C' C ' 327' ' ' TYR . . . . . 0.601 ' CD1' ' HG3' ' A' ' 333' ' ' ARG . 42.2 m-85 -146.82 100.54 3.33 Favored 'General case' 0 C--N 1.302 -1.5 0 O-C-N 121.238 -0.914 . . . . 0.47999999999999998 108.973 -179.885 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' C' C ' 328' ' ' PHE . . . . . 0.424 ' CE1' ' HB3' ' C' ' 326' ' ' GLU . 87.6 m-85 -103.2 -166.41 1.27 Allowed 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.278 -0.889 . . . . 0.33000000000000002 109.711 -179.449 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' C' C ' 329' ' ' THR . . . . . 0.435 ' HA ' ' O ' ' A' ' 330' ' ' LEU . 24.7 p -152.97 161.44 42.53 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.413 -0.804 . . . . 0.23000000000000001 109.014 -179.865 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' C' C ' 330' ' ' LEU . . . . . . . . . . . . . 17.2 tp -149.95 133.42 16.57 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.158 -0.963 . . . . 0.28000000000000003 109.508 -179.525 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 331' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -87.72 116.22 25.7 Favored 'General case' 0 N--CA 1.488 1.47 0 O-C-N 121.352 -0.843 . . . . 1.48 109.36 179.802 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' C' C ' 332' ' ' ILE . . . . . 0.806 HG21 ' HA ' ' C' ' 338' ' ' PHE . 15.1 mt -104.24 104.76 17.3 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.68 0 O-C-N 121.247 -0.908 . . . . 0.23999999999999999 109.607 179.961 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' C' C ' 333' ' ' ARG . . . . . 0.604 ' HG2' ' CE2' ' A' ' 327' ' ' TYR . 0.7 OUTLIER -73.04 143.38 47.52 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.392 -0.817 . . . . 2.7400000000000002 109.423 179.582 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' C' C ' 334' ' ' GLY . . . . . . . . . . . . . . . 80.63 131.61 1.06 Allowed Glycine 0 N--CA 1.495 2.623 0 N-CA-C 109.722 -1.351 . . . . 0.34999999999999998 109.722 179.848 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 335' ' ' ARG . . . . . 0.522 ' NH1' ' HG2' ' C' ' 335' ' ' ARG . 0.0 OUTLIER -79.48 -32.75 42.58 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.241 -1.152 . . . . 2.5299999999999998 109.725 179.975 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' C' C ' 336' ' ' GLU . . . . . . . . . . . . . 49.2 mt-10 -55.55 -61.97 2.0 Allowed 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.238 -0.914 . . . . 2.6200000000000001 109.208 -179.737 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 337' ' ' ARG . . . . . 0.806 ' NH1' HD12 ' A' ' 348' ' ' LEU . 30.5 mmt180 -61.98 -28.56 69.65 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.192 -0.942 . . . . 2.8100000000000001 109.493 179.737 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' C' C ' 338' ' ' PHE . . . . . 0.806 ' HA ' HG21 ' C' ' 332' ' ' ILE . 86.4 t80 -54.94 -61.22 2.46 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.361 -0.837 . . . . 0.40000000000000002 110.135 -179.552 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' C' C ' 339' ' ' GLU . . . . . . . . . . . . . 50.1 mt-10 -51.2 -34.2 30.86 Favored 'General case' 0 N--CA 1.495 1.787 0 O-C-N 121.257 -0.902 . . . . 2.0499999999999998 109.777 -179.836 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 340' ' ' MET . . . . . . . . . . . . . 33.0 ttp -62.66 -50.77 69.89 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.316 -0.865 . . . . 0.32000000000000001 109.791 -179.492 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 341' ' ' PHE . . . . . 0.464 ' CZ ' ' HA ' ' A' ' 345' ' ' ASN . 50.7 m-85 -61.11 -42.52 98.67 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.025 -1.047 . . . . 0.17999999999999999 109.89 -179.772 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' C' C ' 342' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -52.35 -46.11 65.99 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.025 -1.047 . . . . 2.9100000000000001 109.782 179.984 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' C' C ' 343' ' ' GLU . . . . . . . . . . . . . 9.4 tt0 -57.12 -49.14 76.81 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.225 -0.922 . . . . 2.1400000000000001 109.835 -179.528 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 344' ' ' LEU . . . . . . . . . . . . . 85.4 mt -62.25 -28.06 69.44 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.292 -0.88 . . . . 0.22 109.552 179.945 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 345' ' ' ASN . . . . . 0.519 ' HA ' ' CZ ' ' A' ' 341' ' ' PHE . 24.8 t-20 -58.74 -63.21 1.37 Allowed 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.425 -0.797 . . . . 1.0800000000000001 110.303 -179.422 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' C' C ' 346' ' ' GLU . . . . . 0.44 ' O ' ' HB2' ' C' ' 350' ' ' LEU . 17.9 tt0 -61.66 -21.77 64.71 Favored 'General case' 0 C--N 1.301 -1.509 0 O-C-N 121.3 -0.875 . . . . 2.21 109.948 -179.444 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' C' C ' 347' ' ' ALA . . . . . 0.454 ' HB1' ' HB1' ' D' ' 347' ' ' ALA . . . -61.67 -58.43 8.08 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.004 -1.06 . . . . 0.17999999999999999 110.214 -179.617 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' C' C ' 348' ' ' LEU . . . . . 0.644 HD12 ' NH1' ' A' ' 337' ' ' ARG . 3.4 mm? -63.47 -53.94 44.26 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.071 -1.018 . . . . 0.32000000000000001 110.344 -179.214 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' C' C ' 349' ' ' GLU . . . . . . . . . . . . . 1.9 mp0 -57.22 -26.84 61.37 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.002 -1.061 . . . . 2.1899999999999999 109.735 -179.472 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 350' ' ' LEU . . . . . 0.99 ' CD2' HD13 ' D' ' 350' ' ' LEU . 7.7 tt -65.12 -46.7 79.92 Favored 'General case' 0 N--CA 1.488 1.453 0 O-C-N 121.015 -1.053 . . . . 0.46000000000000002 109.165 179.666 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' C' C ' 351' ' ' LYS . . . . . 0.414 ' N ' HD23 ' C' ' 350' ' ' LEU . 42.1 tttt -61.19 -43.63 98.58 Favored 'General case' 0 N--CA 1.488 1.438 0 O-C-N 121.385 -0.822 . . . . 1.3500000000000001 109.473 179.924 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' C' C ' 352' ' ' ASP . . . . . . . . . . . . . 2.9 m-20 -56.28 -47.79 77.9 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.264 -0.898 . . . . 1.1899999999999999 109.655 -179.95 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 353' ' ' ALA . . . . . . . . . . . . . . . -67.6 -19.17 65.2 Favored 'General case' 0 N--CA 1.489 1.499 0 O-C-N 121.189 -0.944 . . . . 0.56999999999999995 109.424 -179.934 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 354' ' ' GLN . . . . . 0.43 ' OE1' HD11 ' D' ' 350' ' ' LEU . 5.8 tt0 -83.26 -12.91 56.26 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.199 -0.938 . . . . 1.47 109.525 179.988 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' C' C ' 355' ' ' ALA . . . . . . . . . . . . . . . -71.38 -46.34 60.58 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.334 -0.854 . . . . 0.93000000000000005 109.199 179.808 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 356' ' ' GLY . . . . . . . . . . . . . . . -80.99 -10.73 84.63 Favored Glycine 0 N--CA 1.486 2.011 0 N-CA-C 109.612 -1.395 . . . . 1.3300000000000001 109.612 -179.895 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 357' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -87.93 87.57 7.39 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.178 -1.189 . . . . 4.0099999999999998 108.834 179.668 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' C' C ' 358' ' ' GLU . . . . . . . . . . . . . 94.5 mt-10 -54.84 154.3 9.81 Favored Pre-proline 0 N--CA 1.487 1.387 0 O-C-N 121.503 -0.748 . . . . 5.75 109.786 -179.767 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 359' ' ' PRO . . . . . . . . . . . . . 2.1 Cg_endo -63.01 126.83 18.82 Favored 'Trans proline' 0 C--N 1.308 -1.596 0 C-N-CA 122.034 1.822 . . . . 4.9400000000000004 110.037 179.65 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 360' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.223 0 CA-C-O 118.031 -1.427 . . . . 6.5 109.629 179.954 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' D' D ' 319' ' ' LYS . . . . . . . . . . . . . 7.8 mttt . . . . . 0 N--CA 1.491 1.604 0 CA-C-O 121.378 0.609 . . . . 7.5300000000000002 109.422 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' D' D ' 320' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 60.43 85.44 0.11 Allowed 'General case' 0 N--CA 1.488 1.47 0 O-C-N 121.373 -0.83 . . . . 6.4100000000000001 109.737 179.879 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' D' D ' 321' ' ' LYS . . . . . . . . . . . . . 8.5 mtpt -157.48 97.65 1.97 Allowed Pre-proline 0 N--CA 1.492 1.629 0 O-C-N 121.298 -0.876 . . . . 6.1100000000000003 109.332 179.994 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' D' D ' 322' ' ' PRO . . . . . . . . . . . . . 2.5 Cg_endo -61.35 -81.59 0.01 OUTLIER 'Trans proline' 0 C--N 1.311 -1.436 0 C-N-CA 121.841 1.694 . . . . 2.8199999999999998 109.877 -179.936 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' D' D ' 323' ' ' LEU . . . . . . . . . . . . . 28.0 mt -81.57 111.64 18.05 Favored 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.184 -0.947 . . . . 2.8300000000000001 109.501 179.681 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' D' D ' 324' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -79.54 -126.89 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.32 -0.862 . . . . 1.54 109.652 -179.849 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' D' D ' 325' ' ' GLY . . . . . 0.451 ' O ' ' CE1' ' D' ' 327' ' ' TYR . . . -69.44 -166.47 5.03 Favored Glycine 0 N--CA 1.49 2.272 0 N-CA-C 109.648 -1.381 . . . . 0.58999999999999997 109.648 -179.846 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' D' D ' 326' ' ' GLU . . . . . 0.433 ' O ' ' CD1' ' D' ' 327' ' ' TYR . 71.8 mm-40 -58.95 -179.45 0.07 Allowed 'General case' 0 N--CA 1.488 1.437 0 O-C-N 121.372 -1.076 . . . . 2.1299999999999999 109.617 -179.863 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' D' D ' 327' ' ' TYR . . . . . 0.518 ' CE2' ' HG3' ' B' ' 333' ' ' ARG . 47.4 m-85 -150.12 109.49 3.98 Favored 'General case' 0 C--N 1.302 -1.5 0 O-C-N 121.276 -0.89 . . . . 0.46999999999999997 109.082 179.817 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' D' D ' 328' ' ' PHE . . . . . 0.417 ' CE1' ' HB3' ' D' ' 326' ' ' GLU . 52.0 m-85 -111.35 -166.71 1.1 Allowed 'General case' 0 N--CA 1.488 1.472 0 O-C-N 121.398 -0.814 . . . . 0.29999999999999999 109.623 -179.674 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' D' D ' 329' ' ' THR . . . . . . . . . . . . . 66.4 p -152.56 163.33 39.8 Favored 'General case' 0 N--CA 1.488 1.425 0 O-C-N 121.34 -0.85 . . . . 0.22 108.843 179.991 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' D' D ' 330' ' ' LEU . . . . . . . . . . . . . 17.7 tp -149.85 131.35 14.8 Favored 'General case' 0 C--N 1.301 -1.507 0 O-C-N 121.158 -0.964 . . . . 0.28000000000000003 109.655 -179.702 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' D' D ' 331' ' ' GLN . . . . . . . . . . . . . 1.5 tt0 -86.0 116.66 24.36 Favored 'General case' 0 C--N 1.303 -1.433 0 O-C-N 121.347 -0.846 . . . . 0.93000000000000005 108.804 179.593 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' D' D ' 332' ' ' ILE . . . . . 0.774 HG21 ' HA ' ' D' ' 338' ' ' PHE . 80.4 mt -102.4 103.68 15.36 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.452 0 O-C-N 121.344 -0.848 . . . . 0.25 109.572 -179.545 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' D' D ' 333' ' ' ARG . . . . . 0.59 ' HG3' ' CE2' ' B' ' 327' ' ' TYR . 4.5 mpt_? -70.64 151.22 45.2 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.282 -0.886 . . . . 2.9300000000000002 109.294 179.731 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' D' D ' 334' ' ' GLY . . . . . . . . . . . . . . . 77.07 126.77 0.29 Allowed Glycine 0 N--CA 1.489 2.199 0 N-CA-C 109.389 -1.485 . . . . 0.40999999999999998 109.389 -179.953 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' D' D ' 335' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -75.68 -36.83 59.96 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.426 -1.043 . . . . 3.0299999999999998 109.56 -179.815 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' D' D ' 336' ' ' GLU . . . . . . . . . . . . . 43.8 mt-10 -56.8 -58.77 6.67 Favored 'General case' 0 C--N 1.301 -1.505 0 O-C-N 121.281 -0.887 . . . . 2.2599999999999998 109.778 -179.633 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' D' D ' 337' ' ' ARG . . . . . 0.475 ' CZ ' HD12 ' B' ' 348' ' ' LEU . 16.9 mmt180 -60.94 -28.94 69.33 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.195 -0.941 . . . . 2.9199999999999999 110.196 -179.578 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' D' D ' 338' ' ' PHE . . . . . 0.774 ' HA ' HG21 ' D' ' 332' ' ' ILE . 40.5 t80 -57.22 -60.29 3.83 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.261 -0.899 . . . . 0.37 110.081 -179.45 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' D' D ' 339' ' ' GLU . . . . . . . . . . . . . 5.3 mt-10 -51.89 -33.0 34.8 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.328 -0.858 . . . . 1.99 110.218 -179.203 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' D' D ' 340' ' ' MET . . . . . . . . . . . . . 30.2 ttp -63.96 -49.94 70.6 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.065 -1.022 . . . . 0.31 109.755 -179.659 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' D' D ' 341' ' ' PHE . . . . . 0.49 ' CZ ' ' HA ' ' B' ' 345' ' ' ASN . 36.2 m-85 -61.97 -43.96 97.74 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.314 -0.866 . . . . 0.17999999999999999 110.106 -179.721 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' D' D ' 342' ' ' ARG . . . . . 0.493 ' NH1' ' HG2' ' D' ' 342' ' ' ARG . 0.1 OUTLIER -49.32 -44.54 44.49 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.401 -0.812 . . . . 2.4100000000000001 110.042 -179.54 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' D' D ' 343' ' ' GLU . . . . . . . . . . . . . 4.4 tt0 -58.49 -47.85 82.73 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.247 -0.908 . . . . 2.3500000000000001 109.949 -179.448 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' D' D ' 344' ' ' LEU . . . . . . . . . . . . . 47.3 mt -61.58 -32.03 72.11 Favored 'General case' 0 N--CA 1.489 1.493 0 O-C-N 121.065 -1.022 . . . . 0.19 109.979 -179.66 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' D' D ' 345' ' ' ASN . . . . . . . . . . . . . 16.3 t-20 -57.09 -60.39 3.66 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.23 -0.919 . . . . 1.0900000000000001 109.85 -179.538 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' D' D ' 346' ' ' GLU . . . . . . . . . . . . . 3.9 tt0 -61.09 -24.71 66.44 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.391 -0.818 . . . . 1.6899999999999999 109.699 -179.549 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' D' D ' 347' ' ' ALA . . . . . 0.454 ' HB1' ' HB1' ' C' ' 347' ' ' ALA . . . -60.15 -61.7 2.41 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.162 -0.961 . . . . 0.17999999999999999 110.058 -179.719 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' D' D ' 348' ' ' LEU . . . . . 0.606 HD22 ' N ' ' D' ' 348' ' ' LEU . 3.5 mm? -61.4 -47.72 84.52 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.144 -0.972 . . . . 0.31 110.219 -179.616 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' D' D ' 349' ' ' GLU . . . . . . . . . . . . . 3.5 mm-40 -56.71 -29.81 62.84 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.131 -0.981 . . . . 1.95 109.723 -179.327 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' D' D ' 350' ' ' LEU . . . . . 0.99 HD13 ' CD2' ' C' ' 350' ' ' LEU . 4.3 tt -64.95 -45.92 83.75 Favored 'General case' 0 N--CA 1.488 1.469 0 O-C-N 121.252 -0.905 . . . . 0.42999999999999999 109.368 179.947 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' D' D ' 351' ' ' LYS . . . . . . . . . . . . . 29.3 tttt -60.04 -51.62 68.85 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.504 -0.748 . . . . 1.3999999999999999 109.584 179.959 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' D' D ' 352' ' ' ASP . . . . . . . . . . . . . 69.3 m-20 -55.3 -38.04 68.13 Favored 'General case' 0 N--CA 1.489 1.48 0 O-C-N 121.343 -0.848 . . . . 1.1699999999999999 109.382 -179.916 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' D' D ' 353' ' ' ALA . . . . . . . . . . . . . . . -65.17 -35.17 80.24 Favored 'General case' 0 N--CA 1.489 1.489 0 O-C-N 121.146 -0.971 . . . . 0.58999999999999997 109.552 -179.998 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' D' D ' 354' ' ' GLN . . . . . . . . . . . . . 15.1 tt0 -83.51 -11.24 57.68 Favored 'General case' 0 N--CA 1.488 1.457 0 O-C-N 121.151 -0.968 . . . . 1.4399999999999999 109.557 -179.944 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' D' D ' 355' ' ' ALA . . . . . . . . . . . . . . . -72.08 -31.99 66.61 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.261 -0.9 . . . . 0.97999999999999998 109.479 179.832 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' D' D ' 356' ' ' GLY . . . . . . . . . . . . . . . -78.71 -7.31 88.25 Favored Glycine 0 N--CA 1.49 2.293 0 N-CA-C 109.588 -1.405 . . . . 1.28 109.588 -179.93 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' D' D ' 357' ' ' LYS . . . . . . . . . . . . . 27.0 mtpt -90.66 -11.74 38.91 Favored 'General case' 0 N--CA 1.489 1.499 0 O-C-N 121.234 -1.157 . . . . 4.0899999999999999 108.98 179.465 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' D' D ' 358' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -54.92 126.38 59.05 Favored Pre-proline 0 N--CA 1.488 1.466 0 O-C-N 121.299 -0.876 . . . . 5.71 109.535 -179.99 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' D' D ' 359' ' ' PRO . . . . . . . . . . . . . 1.7 Cg_endo -64.13 111.55 1.62 Allowed 'Trans proline' 0 C--N 1.313 -1.307 0 C-N-CA 121.967 1.778 . . . . 4.9699999999999998 109.666 179.567 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' D' D ' 360' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.19 0 CA-C-O 118.038 -1.423 . . . . 6.9699999999999998 109.746 -179.92 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 319' ' ' LYS . . . . . 0.418 ' O ' ' HB2' ' A' ' 320' ' ' LYS . 0.9 OUTLIER . . . . . 0 N--CA 1.488 1.461 0 N-CA-C 109.454 -0.573 . . . . 7.5499999999999998 109.454 . . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 320' ' ' LYS . . . . . 0.418 ' HB2' ' O ' ' A' ' 319' ' ' LYS . 35.2 mttp 60.47 -88.72 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.277 -0.89 . . . . 6.4299999999999997 109.752 179.757 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 321' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -156.83 76.58 4.24 Favored Pre-proline 0 N--CA 1.492 1.669 0 O-C-N 121.121 -0.987 . . . . 6.1299999999999999 109.389 179.854 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 322' ' ' PRO . . . . . . . . . . . . . 2.9 Cg_endo -62.33 110.41 1.04 Allowed 'Trans proline' 0 C--N 1.309 -1.526 0 C-N-CA 122.335 2.023 . . . . 2.8300000000000001 110.319 -179.779 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 323' ' ' LEU . . . . . . . . . . . . . 36.4 mt -82.64 111.82 18.96 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.314 -0.866 . . . . 2.8300000000000001 109.317 179.841 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 324' ' ' ASP . . . . . . . . . . . . . 32.5 m-20 -80.46 107.56 13.36 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.087 -1.008 . . . . 1.53 109.41 179.856 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 325' ' ' GLY . . . . . 0.552 ' O ' ' CD2' ' A' ' 327' ' ' TYR . . . -68.11 -169.41 5.01 Favored Glycine 0 N--CA 1.49 2.299 0 N-CA-C 109.512 -1.435 . . . . 0.60999999999999999 109.512 -179.961 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 326' ' ' GLU . . . . . 0.453 ' HB3' ' CE2' ' A' ' 328' ' ' PHE . 43.5 mm-40 -59.18 163.93 3.44 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.261 -1.14 . . . . 2.1299999999999999 109.093 179.941 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 327' ' ' TYR . . . . . 0.611 ' CE1' ' HG2' ' C' ' 333' ' ' ARG . 41.2 m-85 -149.69 104.83 3.37 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.169 -0.957 . . . . 0.47999999999999998 109.428 -179.894 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 328' ' ' PHE . . . . . 0.453 ' CE2' ' HB3' ' A' ' 326' ' ' GLU . 88.9 m-85 -111.46 -166.19 1.06 Allowed 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.419 -0.801 . . . . 0.31 109.576 -179.72 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 329' ' ' THR . . . . . 0.404 ' HA ' ' O ' ' C' ' 330' ' ' LEU . 33.5 p -153.61 160.92 42.56 Favored 'General case' 0 N--CA 1.488 1.435 0 O-C-N 121.451 -0.781 . . . . 0.22 108.923 -179.826 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 330' ' ' LEU . . . . . 0.59 HD11 HD22 ' C' ' 345' ' ' ASN . 25.9 tp -150.78 129.84 12.62 Favored 'General case' 0 N--CA 1.488 1.465 0 O-C-N 121.167 -0.958 . . . . 0.28000000000000003 109.738 -179.611 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 331' ' ' GLN . . . . . . . . . . . . . 1.3 tt0 -88.82 113.81 24.77 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.22 -0.925 . . . . 0.91000000000000003 109.189 179.732 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 332' ' ' ILE . . . . . 0.478 HD12 ' CD1' ' A' ' 338' ' ' PHE . 38.5 mt -103.41 111.76 34.35 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.505 0 O-C-N 121.08 -1.013 . . . . 0.26000000000000001 109.911 -179.864 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 333' ' ' ARG . . . . . 0.594 ' CG ' ' CE1' ' C' ' 327' ' ' TYR . 0.0 OUTLIER -73.12 149.28 43.17 Favored 'General case' 0 C--N 1.302 -1.47 0 O-C-N 121.27 -0.894 . . . . 2.9199999999999999 109.488 179.725 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 334' ' ' GLY . . . . . . . . . . . . . . . 84.77 132.57 2.53 Favored Glycine 0 N--CA 1.49 2.259 0 N-CA-C 109.514 -1.434 . . . . 0.40000000000000002 109.514 -179.917 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 335' ' ' ARG . . . . . . . . . . . . . 36.0 ttt180 -78.92 -42.48 26.98 Favored 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.199 -1.177 . . . . 3.0099999999999998 109.59 -179.83 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 336' ' ' GLU . . . . . . . . . . . . . 3.5 pt-20 -57.22 -53.08 62.14 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.232 -0.917 . . . . 2.29 110.115 -179.589 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 337' ' ' ARG . . . . . 0.604 ' CZ ' HD12 ' C' ' 348' ' ' LEU . 12.6 mmt180 -61.97 -34.81 76.82 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 120.97 -1.081 . . . . 2.9300000000000002 109.809 -179.754 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 338' ' ' PHE . . . . . 0.478 ' CD1' HD12 ' A' ' 332' ' ' ILE . 80.8 t80 -55.32 -57.55 11.36 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.173 -0.955 . . . . 0.38 109.802 -179.711 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 339' ' ' GLU . . . . . . . . . . . . . 44.1 mt-10 -51.43 -36.09 42.29 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.224 -0.923 . . . . 1.97 110.425 -179.681 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 340' ' ' MET . . . . . . . . . . . . . 47.1 ttp -62.44 -48.57 79.08 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.119 -0.988 . . . . 0.31 109.808 -179.448 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 341' ' ' PHE . . . . . 0.434 ' CZ ' ' HA ' ' C' ' 345' ' ' ASN . 43.3 m-85 -62.55 -47.81 82.24 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.128 -0.982 . . . . 0.17999999999999999 109.982 -179.614 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 342' ' ' ARG . . . . . . . . . . . . . 19.7 ttt180 -49.23 -42.32 40.18 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.316 -0.865 . . . . 2.4199999999999999 110.21 -179.496 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 343' ' ' GLU . . . . . . . . . . . . . 4.2 tp10 -58.89 -49.05 79.24 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.143 -0.973 . . . . 2.3500000000000001 109.921 -179.611 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 344' ' ' LEU . . . . . 0.569 HD22 ' CD2' ' B' ' 344' ' ' LEU . 37.1 mt -61.34 -31.56 71.43 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.217 -0.927 . . . . 0.17999999999999999 109.76 -179.568 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 345' ' ' ASN . . . . . . . . . . . . . 62.4 t-20 -57.36 -54.3 48.4 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.295 -0.878 . . . . 1.0900000000000001 109.698 -179.717 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 346' ' ' GLU . . . . . . . . . . . . . 6.0 tp10 -62.62 -27.74 69.41 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.331 -0.855 . . . . 1.6499999999999999 110.097 -179.661 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 347' ' ' ALA . . . . . 0.891 ' HB1' ' HB1' ' B' ' 347' ' ' ALA . . . -61.85 -58.82 6.5 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.217 -0.927 . . . . 0.17999999999999999 110.025 -179.609 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 348' ' ' LEU . . . . . 0.583 HD22 ' N ' ' A' ' 348' ' ' LEU . 3.8 mm? -60.72 -48.53 81.37 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.119 -0.988 . . . . 0.29999999999999999 110.053 -179.304 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 349' ' ' GLU . . . . . 0.452 ' OE1' ' NH1' ' C' ' 333' ' ' ARG . 43.4 mt-10 -56.98 -33.13 66.79 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.155 -0.966 . . . . 1.9399999999999999 109.533 -179.47 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 350' ' ' LEU . . . . . 0.817 HD23 ' O ' ' A' ' 350' ' ' LEU . 3.9 tt -63.96 -45.34 89.59 Favored 'General case' 0 C--N 1.302 -1.469 0 O-C-N 121.269 -0.895 . . . . 0.46000000000000002 109.182 179.887 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 351' ' ' LYS . . . . . . . . . . . . . 9.5 tttp -60.5 -45.33 94.19 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.279 -0.888 . . . . 1.3999999999999999 109.624 179.858 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 352' ' ' ASP . . . . . . . . . . . . . 7.0 m-20 -55.19 -37.56 67.23 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.233 -0.917 . . . . 1.1599999999999999 109.633 -179.844 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 353' ' ' ALA . . . . . . . . . . . . . . . -66.08 -30.29 70.78 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.228 -0.92 . . . . 0.63 109.702 -179.795 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 354' ' ' GLN . . . . . . . . . . . . . 2.4 tt0 -82.73 -5.61 58.98 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.239 -0.913 . . . . 1.47 109.727 -179.954 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 355' ' ' ALA . . . . . . . . . . . . . . . -71.45 -5.69 34.77 Favored 'General case' 0 N--CA 1.488 1.465 0 O-C-N 121.251 -0.905 . . . . 1.01 109.605 -179.887 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 356' ' ' GLY . . . . . . . . . . . . . . . -79.95 2.06 76.61 Favored Glycine 0 N--CA 1.492 2.377 0 N-CA-C 109.682 -1.367 . . . . 1.3 109.682 179.936 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 357' ' ' LYS . . . . . . . . . . . . . 1.5 mtpp -86.25 103.81 15.2 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.146 -1.208 . . . . 4.0999999999999996 109.635 -179.823 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 358' ' ' GLU . . . . . 0.575 ' N ' ' HD2' ' A' ' 359' ' ' PRO . 3.6 tt0 -50.84 -53.56 46.04 Favored Pre-proline 0 N--CA 1.491 1.6 0 O-C-N 121.385 -0.822 . . . . 5.75 109.787 179.855 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 359' ' ' PRO . . . . . 0.575 ' HD2' ' N ' ' A' ' 358' ' ' GLU . 2.8 Cg_endo -61.1 -48.29 10.49 Favored 'Trans proline' 0 C--N 1.313 -1.304 0 C-N-CA 121.586 1.524 . . . . 5.0 110.108 -179.879 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 360' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.228 0 N-CA-C 109.527 -1.429 . . . . 6.9699999999999998 109.527 -179.901 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' B' B ' 319' ' ' LYS . . . . . 0.405 ' O ' ' HB2' ' B' ' 320' ' ' LYS . 1.0 OUTLIER . . . . . 0 N--CA 1.49 1.557 0 N-CA-C 109.422 -0.584 . . . . 7.5499999999999998 109.422 . . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 320' ' ' LYS . . . . . 0.405 ' HB2' ' O ' ' B' ' 319' ' ' LYS . 33.6 mttp 60.33 -89.14 0.03 OUTLIER 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.256 -0.903 . . . . 6.4400000000000004 109.715 179.937 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 321' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -156.83 76.97 4.18 Favored Pre-proline 0 N--CA 1.49 1.537 0 O-C-N 121.352 -0.842 . . . . 6.1299999999999999 109.4 179.981 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 322' ' ' PRO . . . . . . . . . . . . . 2.3 Cg_endo -62.71 110.0 1.01 Allowed 'Trans proline' 0 C--N 1.311 -1.404 0 C-N-CA 122.353 2.035 . . . . 2.8199999999999998 110.423 -179.775 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 323' ' ' LEU . . . . . . . . . . . . . 38.8 mt -82.04 112.0 18.71 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.261 -0.899 . . . . 2.8399999999999999 109.32 179.824 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 324' ' ' ASP . . . . . . . . . . . . . 27.5 m-20 -80.77 108.21 14.23 Favored 'General case' 0 N--CA 1.488 1.47 0 O-C-N 121.058 -1.026 . . . . 1.53 109.275 179.777 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 325' ' ' GLY . . . . . 0.572 ' O ' ' CD2' ' B' ' 327' ' ' TYR . . . -68.74 -169.71 5.88 Favored Glycine 0 N--CA 1.489 2.176 0 N-CA-C 109.415 -1.474 . . . . 0.58999999999999997 109.415 -179.968 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 326' ' ' GLU . . . . . 0.452 ' HB3' ' CE2' ' B' ' 328' ' ' PHE . 45.1 mm-40 -58.74 163.63 3.22 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.195 -1.18 . . . . 2.1299999999999999 109.205 179.783 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 327' ' ' TYR . . . . . 0.622 ' CE1' ' CG ' ' D' ' 333' ' ' ARG . 42.9 m-85 -149.16 106.36 3.61 Favored 'General case' 0 C--N 1.301 -1.516 0 O-C-N 121.177 -0.952 . . . . 0.47999999999999998 109.199 179.974 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 328' ' ' PHE . . . . . 0.53 ' CE2' ' HA ' ' D' ' 335' ' ' ARG . 89.3 m-85 -113.57 -167.07 1.15 Allowed 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.331 -0.856 . . . . 0.32000000000000001 109.458 -179.563 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 329' ' ' THR . . . . . . . . . . . . . 33.9 p -152.74 161.32 42.72 Favored 'General case' 0 N--CA 1.488 1.459 0 O-C-N 121.314 -0.866 . . . . 0.23000000000000001 109.08 -179.912 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 330' ' ' LEU . . . . . . . . . . . . . 25.4 tp -151.19 129.09 11.69 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 120.966 -1.084 . . . . 0.28000000000000003 109.779 -179.637 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 331' ' ' GLN . . . . . . . . . . . . . 1.3 tt0 -87.96 114.91 25.03 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.201 -0.937 . . . . 0.91000000000000003 109.185 179.623 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 332' ' ' ILE . . . . . 0.474 HD12 ' CD1' ' B' ' 338' ' ' PHE . 39.1 mt -103.89 111.81 34.97 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.594 0 O-C-N 121.09 -1.006 . . . . 0.23999999999999999 109.718 -179.871 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 333' ' ' ARG . . . . . 0.598 ' HG2' ' CE1' ' D' ' 327' ' ' TYR . 0.0 OUTLIER -73.34 149.21 42.77 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.231 -0.918 . . . . 2.9300000000000002 109.587 179.755 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 334' ' ' GLY . . . . . . . . . . . . . . . 84.23 132.36 2.29 Favored Glycine 0 N--CA 1.492 2.391 0 N-CA-C 109.437 -1.465 . . . . 0.40000000000000002 109.437 -179.834 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 335' ' ' ARG . . . . . 0.492 ' HA ' ' CE2' ' D' ' 328' ' ' PHE . 38.4 ttt180 -78.62 -41.96 30.15 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.332 -1.099 . . . . 3.0099999999999998 109.737 -179.768 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 336' ' ' GLU . . . . . . . . . . . . . 3.7 pt-20 -57.16 -53.2 60.84 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.224 -0.922 . . . . 2.2799999999999998 110.09 -179.677 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 337' ' ' ARG . . . . . . . . . . . . . 13.0 mmt180 -62.05 -34.9 77.12 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.044 -1.035 . . . . 2.9300000000000002 109.929 -179.75 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 338' ' ' PHE . . . . . 0.474 ' CD1' HD12 ' B' ' 332' ' ' ILE . 80.3 t80 -55.61 -56.71 17.2 Favored 'General case' 0 C--N 1.303 -1.455 0 O-C-N 121.211 -0.931 . . . . 0.37 109.88 -179.618 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 339' ' ' GLU . . . . . . . . . . . . . 44.0 mt-10 -52.4 -35.2 51.13 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.222 -0.923 . . . . 1.98 110.337 -179.489 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 340' ' ' MET . . . . . . . . . . . . . 47.4 ttp -63.27 -48.27 78.85 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.135 -0.978 . . . . 0.32000000000000001 109.755 -179.405 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 341' ' ' PHE . . . . . . . . . . . . . 43.9 m-85 -62.49 -47.94 81.74 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.204 -0.935 . . . . 0.17999999999999999 109.848 -179.886 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 342' ' ' ARG . . . . . . . . . . . . . 17.2 ttt180 -49.24 -41.98 39.25 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.246 -0.909 . . . . 2.4199999999999999 110.162 -179.55 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 343' ' ' GLU . . . . . . . . . . . . . 4.3 tp10 -59.16 -48.72 80.57 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.026 -1.046 . . . . 2.3500000000000001 109.839 -179.53 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 344' ' ' LEU . . . . . 0.569 ' CD2' HD22 ' A' ' 344' ' ' LEU . 38.0 mt -61.76 -31.3 71.48 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.207 -0.933 . . . . 0.17999999999999999 109.865 -179.609 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 345' ' ' ASN . . . . . 0.594 ' C ' HD21 ' B' ' 345' ' ' ASN . 0.3 OUTLIER -57.64 -54.65 44.42 Favored 'General case' 0 C--N 1.302 -1.465 0 O-C-N 121.175 -0.953 . . . . 1.0900000000000001 109.641 -179.714 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 346' ' ' GLU . . . . . . . . . . . . . 6.3 tp10 -62.0 -28.06 69.3 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.29 -0.881 . . . . 1.6599999999999999 110.047 -179.659 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 347' ' ' ALA . . . . . 0.891 ' HB1' ' HB1' ' A' ' 347' ' ' ALA . . . -61.62 -58.32 8.55 Favored 'General case' 0 N--CA 1.495 1.795 0 O-C-N 121.138 -0.976 . . . . 0.17000000000000001 110.238 -179.732 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 348' ' ' LEU . . . . . 0.569 HD22 ' N ' ' B' ' 348' ' ' LEU . 3.8 mm? -61.09 -49.54 76.88 Favored 'General case' 0 N--CA 1.493 1.692 0 O-C-N 121.287 -0.883 . . . . 0.28999999999999998 109.869 -179.283 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 349' ' ' GLU . . . . . . . . . . . . . 44.0 mt-10 -56.1 -32.9 64.6 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.047 -1.033 . . . . 1.95 109.617 -179.624 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 350' ' ' LEU . . . . . 0.832 HD23 ' O ' ' B' ' 350' ' ' LEU . 4.0 tt -64.46 -44.38 91.26 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.245 -0.909 . . . . 0.45000000000000001 109.399 179.929 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 351' ' ' LYS . . . . . . . . . . . . . 9.9 tttp -61.56 -45.32 94.65 Favored 'General case' 0 N--CA 1.488 1.45 0 O-C-N 121.337 -0.852 . . . . 1.3799999999999999 109.619 179.872 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 352' ' ' ASP . . . . . . . . . . . . . 6.3 m-20 -55.23 -37.21 66.86 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.201 -0.937 . . . . 1.1599999999999999 109.602 -179.995 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 353' ' ' ALA . . . . . . . . . . . . . . . -66.44 -30.97 71.44 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.164 -0.96 . . . . 0.60999999999999999 109.548 -179.75 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 354' ' ' GLN . . . . . . . . . . . . . 2.4 tt0 -82.19 -5.09 58.24 Favored 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.109 -0.994 . . . . 1.45 109.552 -179.962 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 355' ' ' ALA . . . . . . . . . . . . . . . -71.43 -5.9 36.32 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.134 -0.979 . . . . 0.97999999999999998 109.575 179.926 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 356' ' ' GLY . . . . . . . . . . . . . . . -80.28 3.28 73.08 Favored Glycine 0 N--CA 1.489 2.192 0 N-CA-C 109.813 -1.315 . . . . 1.29 109.813 -179.945 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 357' ' ' LYS . . . . . . . . . . . . . 1.7 mtpp -86.91 104.01 15.84 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.051 -1.264 . . . . 4.0899999999999999 109.471 179.985 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 358' ' ' GLU . . . . . 0.586 ' N ' ' HD2' ' B' ' 359' ' ' PRO . 3.4 tt0 -51.13 -53.08 52.5 Favored Pre-proline 0 C--N 1.302 -1.488 0 O-C-N 121.191 -0.943 . . . . 5.7199999999999998 109.834 179.979 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 359' ' ' PRO . . . . . 0.586 ' HD2' ' N ' ' B' ' 358' ' ' GLU . 2.7 Cg_endo -61.32 -47.39 12.13 Favored 'Trans proline' 0 C--N 1.311 -1.396 0 C-N-CA 121.859 1.706 . . . . 4.9800000000000004 110.135 -179.795 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 360' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.234 0 N-CA-C 109.326 -1.51 . . . . 6.9800000000000004 109.326 -179.947 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' C' C ' 319' ' ' LYS . . . . . 0.463 ' O ' ' O ' ' C' ' 320' ' ' LYS . 0.0 OUTLIER . . . . . 0 N--CA 1.489 1.52 0 N-CA-C 109.332 -0.618 . . . . 6.8200000000000003 109.332 . . . . . . . . . 2 2 . 1 . 003 nuclear build full ' C' C ' 320' ' ' LYS . . . . . 0.463 ' O ' ' O ' ' C' ' 319' ' ' LYS . 0.0 OUTLIER 61.0 130.4 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.483 0 O-C-N 121.198 -0.939 . . . . 6.4900000000000002 109.635 179.82 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' C' C ' 321' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -157.58 79.54 3.41 Favored Pre-proline 0 N--CA 1.489 1.478 0 O-C-N 121.238 -0.914 . . . . 6.4000000000000004 109.335 179.977 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' C' C ' 322' ' ' PRO . . . . . . . . . . . . . 5.4 Cg_exo -58.32 174.75 0.65 Allowed 'Trans proline' 0 C--N 1.308 -1.567 0 C-N-CA 121.96 1.774 . . . . 3.4199999999999999 109.98 179.964 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 323' ' ' LEU . . . . . . . . . . . . . 87.0 mt -78.66 142.43 37.17 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.131 -0.98 . . . . 3.9500000000000002 109.415 -179.844 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 324' ' ' ASP . . . . . 0.432 ' HB3' ' OH ' ' C' ' 327' ' ' TYR . 1.6 m-20 -79.82 149.33 31.06 Favored 'General case' 0 N--CA 1.489 1.5 0 O-C-N 121.343 -0.848 . . . . 1.6299999999999999 109.299 179.99 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' C' C ' 325' ' ' GLY . . . . . . . . . . . . . . . -68.75 -173.28 8.28 Favored Glycine 0 N--CA 1.49 2.242 0 N-CA-C 109.876 -1.29 . . . . 0.72999999999999998 109.876 -179.557 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 326' ' ' GLU . . . . . . . . . . . . . 3.1 mt-10 -58.1 -179.56 0.06 Allowed 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.255 -1.144 . . . . 2.1699999999999999 109.635 -179.968 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 327' ' ' TYR . . . . . 0.594 ' CE1' ' CG ' ' A' ' 333' ' ' ARG . 38.2 m-85 -149.14 111.45 4.69 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.412 -0.805 . . . . 0.47999999999999998 109.512 179.823 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' C' C ' 328' ' ' PHE . . . . . 0.418 ' O ' HG23 ' C' ' 329' ' ' THR . 93.8 m-85 -113.47 -170.17 1.64 Allowed 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.2 -0.938 . . . . 0.33000000000000002 109.578 -179.941 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' C' C ' 329' ' ' THR . . . . . 0.418 HG23 ' O ' ' C' ' 328' ' ' PHE . 6.3 p -153.28 161.78 42.01 Favored 'General case' 0 N--CA 1.491 1.609 0 N-CA-C 108.807 -0.812 . . . . 0.23000000000000001 108.807 179.84 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' C' C ' 330' ' ' LEU . . . . . 0.404 ' O ' ' HA ' ' A' ' 329' ' ' THR . 15.7 tp -150.46 130.01 13.05 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.0 -1.063 . . . . 0.28000000000000003 110.609 -179.027 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' C' C ' 331' ' ' GLN . . . . . . . . . . . . . 1.8 tp60 -89.32 116.0 27.21 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.394 -0.816 . . . . 1.48 108.938 178.885 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 332' ' ' ILE . . . . . . . . . . . . . 58.5 mt -103.7 115.04 44.91 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.695 0 O-C-N 121.011 -1.056 . . . . 0.23999999999999999 109.984 -179.569 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 333' ' ' ARG . . . . . 0.611 ' HG2' ' CE1' ' A' ' 327' ' ' TYR . 0.7 OUTLIER -72.61 146.64 46.5 Favored 'General case' 0 N--CA 1.489 1.494 0 O-C-N 121.319 -0.863 . . . . 2.7400000000000002 109.223 179.58 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' C' C ' 334' ' ' GLY . . . . . . . . . . . . . . . 84.43 127.79 1.6 Allowed Glycine 0 N--CA 1.49 2.272 0 N-CA-C 109.896 -1.282 . . . . 0.34999999999999998 109.896 179.759 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 335' ' ' ARG . . . . . 0.418 ' O ' ' HB3' ' C' ' 338' ' ' PHE . 62.4 ttt180 -78.5 -32.97 48.4 Favored 'General case' 0 C--N 1.301 -1.501 0 O-C-N 121.331 -1.099 . . . . 2.5299999999999998 109.271 179.634 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' C' C ' 336' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -57.74 -62.03 2.09 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.355 -0.841 . . . . 2.6200000000000001 110.027 -179.702 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' C' C ' 337' ' ' ARG . . . . . . . . . . . . . 1.1 mpt_? -60.43 -26.54 66.8 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.287 -0.883 . . . . 2.8100000000000001 109.905 -179.427 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 338' ' ' PHE . . . . . 0.418 ' HB3' ' O ' ' C' ' 335' ' ' ARG . 76.1 t80 -55.89 -58.95 5.71 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.236 -0.915 . . . . 0.40000000000000002 109.855 -179.899 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' C' C ' 339' ' ' GLU . . . . . . . . . . . . . 10.2 mm-40 -51.64 -34.51 38.21 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.309 -0.87 . . . . 2.0499999999999998 109.884 -179.537 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 340' ' ' MET . . . . . . . . . . . . . 33.4 ttp -64.43 -49.53 71.11 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.22 -0.925 . . . . 0.32000000000000001 109.898 -179.665 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 341' ' ' PHE . . . . . . . . . . . . . 41.2 m-85 -60.78 -39.54 89.19 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.177 -0.952 . . . . 0.17999999999999999 109.848 -179.505 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 342' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -51.77 -45.83 63.9 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.119 -0.988 . . . . 2.9100000000000001 109.835 179.879 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' C' C ' 343' ' ' GLU . . . . . . . . . . . . . 2.3 tp10 -59.17 -47.77 84.09 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.309 -0.869 . . . . 2.1400000000000001 110.486 -179.267 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 344' ' ' LEU . . . . . 0.464 ' CD2' HD22 ' D' ' 344' ' ' LEU . 30.2 mt -61.62 -35.0 76.65 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.034 -1.041 . . . . 0.22 110.159 -179.376 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' C' C ' 345' ' ' ASN . . . . . 0.59 HD22 HD11 ' A' ' 330' ' ' LEU . 50.4 t-20 -58.17 -59.76 4.8 Favored 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.245 -0.91 . . . . 1.0800000000000001 110.217 -179.506 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' C' C ' 346' ' ' GLU . . . . . . . . . . . . . 2.6 tt0 -60.55 -22.95 64.22 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.183 -0.948 . . . . 2.21 110.168 -179.375 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 347' ' ' ALA . . . . . 0.652 ' HB1' ' HB1' ' D' ' 347' ' ' ALA . . . -61.52 -57.47 12.0 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.124 -0.985 . . . . 0.17999999999999999 110.159 -179.657 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' C' C ' 348' ' ' LEU . . . . . 0.604 HD12 ' CZ ' ' A' ' 337' ' ' ARG . 4.2 mm? -61.83 -52.92 62.19 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.267 -0.896 . . . . 0.32000000000000001 110.272 -179.165 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' C' C ' 349' ' ' GLU . . . . . . . . . . . . . 21.4 mm-40 -55.75 -31.29 62.42 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.157 -0.964 . . . . 2.1899999999999999 109.995 -179.195 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 350' ' ' LEU . . . . . 1.029 ' CD1' HD13 ' D' ' 350' ' ' LEU . 0.3 OUTLIER -65.22 -49.24 70.46 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.126 -0.984 . . . . 0.46000000000000002 109.342 -179.91 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' C' C ' 351' ' ' LYS . . . . . 0.861 ' N ' HD13 ' C' ' 350' ' ' LEU . 9.6 tttt -61.4 -44.19 97.57 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.322 -0.861 . . . . 1.3500000000000001 109.744 179.696 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' C' C ' 352' ' ' ASP . . . . . . . . . . . . . 77.8 m-20 -55.98 -31.48 63.06 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.47 -0.769 . . . . 1.1899999999999999 110.182 -179.53 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 353' ' ' ALA . . . . . . . . . . . . . . . -64.68 -40.41 95.35 Favored 'General case' 0 N--CA 1.489 1.493 0 O-C-N 121.066 -1.021 . . . . 0.56999999999999995 109.441 -179.676 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 354' ' ' GLN . . . . . 0.605 ' OE1' HD11 ' D' ' 350' ' ' LEU . 96.5 mt-30 -83.5 -4.49 58.57 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.049 -1.032 . . . . 1.47 110.085 -179.943 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' C' C ' 355' ' ' ALA . . . . . . . . . . . . . . . -72.59 -4.8 32.99 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.152 -0.968 . . . . 0.93000000000000005 110.027 -179.815 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 356' ' ' GLY . . . . . . . . . . . . . . . -77.84 -77.58 0.83 Allowed Glycine 0 N--CA 1.493 2.448 0 N-CA-C 109.951 -1.26 . . . . 1.3300000000000001 109.951 -179.645 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 357' ' ' LYS . . . . . . . . . . . . . 51.4 pttt -85.18 27.08 0.82 Allowed 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.293 -1.122 . . . . 4.0099999999999998 109.956 -179.641 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 358' ' ' GLU . . . . . . . . . . . . . 6.9 tm-20 -47.95 112.78 2.35 Favored Pre-proline 0 N--CA 1.49 1.556 0 O-C-N 121.092 -1.005 . . . . 5.75 109.426 179.86 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 359' ' ' PRO . . . . . . . . . . . . . 2.3 Cg_endo -62.43 112.29 1.54 Allowed 'Trans proline' 0 C--N 1.313 -1.316 0 C-N-CA 122.053 1.835 . . . . 4.9400000000000004 110.137 -179.786 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 360' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.336 0 CA-C-O 117.966 -1.463 . . . . 6.5 109.647 -179.929 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' D' D ' 319' ' ' LYS . . . . . 0.412 ' O ' ' HB2' ' D' ' 320' ' ' LYS . 1.1 mmpt? . . . . . 0 N--CA 1.492 1.652 0 N-CA-C 109.337 -0.616 . . . . 7.5300000000000002 109.337 . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' D' D ' 320' ' ' LYS . . . . . 0.412 ' HB2' ' O ' ' D' ' 319' ' ' LYS . 31.7 mttp 59.87 -89.17 0.02 OUTLIER 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.223 -0.923 . . . . 6.4100000000000001 109.692 179.894 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' D' D ' 321' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -156.51 76.94 4.35 Favored Pre-proline 0 N--CA 1.493 1.717 0 O-C-N 121.149 -0.969 . . . . 6.1100000000000003 109.364 179.974 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' D' D ' 322' ' ' PRO . . . . . . . . . . . . . 2.5 Cg_endo -62.49 109.41 0.86 Allowed 'Trans proline' 0 C--N 1.312 -1.372 0 C-N-CA 122.248 1.966 . . . . 2.8199999999999998 110.768 -179.864 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' D' D ' 323' ' ' LEU . . . . . . . . . . . . . 34.3 mt -81.33 112.61 18.78 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.137 -0.977 . . . . 2.8300000000000001 109.383 179.689 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' D' D ' 324' ' ' ASP . . . . . . . . . . . . . 25.2 m-20 -81.35 107.52 14.2 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.124 -0.985 . . . . 1.54 109.218 179.854 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' D' D ' 325' ' ' GLY . . . . . 0.571 ' O ' ' CD2' ' D' ' 327' ' ' TYR . . . -68.15 -169.3 5.0 Favored Glycine 0 N--CA 1.491 2.331 0 N-CA-C 109.484 -1.446 . . . . 0.58999999999999997 109.484 -179.915 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' D' D ' 326' ' ' GLU . . . . . 0.46 ' HB3' ' CE2' ' D' ' 328' ' ' PHE . 48.1 mm-40 -58.93 163.51 3.43 Favored 'General case' 0 N--CA 1.487 1.399 0 O-C-N 121.235 -1.156 . . . . 2.1299999999999999 109.123 179.824 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' D' D ' 327' ' ' TYR . . . . . 0.598 ' CE1' ' HG2' ' B' ' 333' ' ' ARG . 41.8 m-85 -149.16 106.21 3.59 Favored 'General case' 0 C--N 1.302 -1.467 0 O-C-N 121.203 -0.935 . . . . 0.46999999999999997 109.385 179.814 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' D' D ' 328' ' ' PHE . . . . . 0.492 ' CE2' ' HA ' ' B' ' 335' ' ' ARG . 87.8 m-85 -113.09 -166.39 1.08 Allowed 'General case' 0 N--CA 1.488 1.456 0 O-C-N 121.298 -0.876 . . . . 0.29999999999999999 109.623 -179.557 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' D' D ' 329' ' ' THR . . . . . . . . . . . . . 35.2 p -153.51 160.32 42.48 Favored 'General case' 0 N--CA 1.488 1.464 0 O-C-N 121.345 -0.847 . . . . 0.22 109.012 -179.544 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' D' D ' 330' ' ' LEU . . . . . . . . . . . . . 23.4 tp -151.05 129.6 12.2 Favored 'General case' 0 N--CA 1.488 1.475 0 O-C-N 121.152 -0.968 . . . . 0.28000000000000003 109.639 -179.677 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' D' D ' 331' ' ' GLN . . . . . . . . . . . . . 1.3 tt0 -88.44 114.54 25.16 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.367 -0.833 . . . . 0.93000000000000005 109.271 179.865 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' D' D ' 332' ' ' ILE . . . . . 0.478 HD12 ' CD1' ' D' ' 338' ' ' PHE . 38.5 mt -103.52 111.7 34.24 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.447 0 O-C-N 121.094 -1.004 . . . . 0.25 109.849 -179.604 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' D' D ' 333' ' ' ARG . . . . . 0.622 ' CG ' ' CE1' ' B' ' 327' ' ' TYR . 0.0 OUTLIER -73.11 148.9 43.52 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.291 -0.88 . . . . 2.9300000000000002 109.527 179.803 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' D' D ' 334' ' ' GLY . . . . . . . . . . . . . . . 84.97 131.94 2.48 Favored Glycine 0 N--CA 1.492 2.37 0 N-CA-C 109.567 -1.413 . . . . 0.40999999999999998 109.567 179.988 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' D' D ' 335' ' ' ARG . . . . . 0.53 ' HA ' ' CE2' ' B' ' 328' ' ' PHE . 39.7 ttt180 -78.75 -40.66 32.78 Favored 'General case' 0 N--CA 1.49 1.525 0 O-C-N 121.158 -1.201 . . . . 3.0299999999999998 109.558 -179.821 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' D' D ' 336' ' ' GLU . . . . . . . . . . . . . 3.7 pt-20 -58.18 -53.28 60.02 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.173 -0.955 . . . . 2.2599999999999998 110.001 -179.566 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' D' D ' 337' ' ' ARG . . . . . . . . . . . . . 12.9 mmt180 -61.79 -35.98 79.76 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.182 -0.949 . . . . 2.9199999999999999 109.795 -179.719 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' D' D ' 338' ' ' PHE . . . . . 0.478 ' CD1' HD12 ' D' ' 332' ' ' ILE . 80.5 t80 -54.73 -56.66 16.9 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.145 -0.972 . . . . 0.37 110.054 -179.65 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' D' D ' 339' ' ' GLU . . . . . . . . . . . . . 43.4 mt-10 -52.26 -35.9 51.19 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.214 -0.929 . . . . 1.99 110.337 -179.565 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' D' D ' 340' ' ' MET . . . . . . . . . . . . . 46.9 ttp -62.97 -48.03 80.62 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 120.989 -1.069 . . . . 0.31 109.83 -179.454 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' D' D ' 341' ' ' PHE . . . . . . . . . . . . . 44.5 m-85 -62.83 -47.9 81.39 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.207 -0.933 . . . . 0.17999999999999999 109.859 -179.752 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' D' D ' 342' ' ' ARG . . . . . . . . . . . . . 16.7 ttt180 -48.98 -42.26 37.05 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.374 -0.829 . . . . 2.4100000000000001 110.104 -179.544 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' D' D ' 343' ' ' GLU . . . . . . . . . . . . . 4.2 tp10 -59.12 -48.95 79.73 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.037 -1.039 . . . . 2.3500000000000001 109.845 -179.692 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' D' D ' 344' ' ' LEU . . . . . 0.464 HD22 ' CD2' ' C' ' 344' ' ' LEU . 39.0 mt -60.95 -33.03 72.56 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.097 -1.002 . . . . 0.19 109.741 -179.68 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' D' D ' 345' ' ' ASN . . . . . 0.597 ' C ' HD21 ' D' ' 345' ' ' ASN . 0.3 OUTLIER -56.2 -54.6 43.31 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.223 -0.923 . . . . 1.0900000000000001 109.739 -179.928 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' D' D ' 346' ' ' GLU . . . . . . . . . . . . . 6.6 tp10 -62.46 -27.48 69.15 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.124 -0.985 . . . . 1.6899999999999999 110.101 -179.589 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' D' D ' 347' ' ' ALA . . . . . 0.652 ' HB1' ' HB1' ' C' ' 347' ' ' ALA . . . -62.16 -58.48 7.63 Favored 'General case' 0 N--CA 1.493 1.725 0 O-C-N 121.051 -1.03 . . . . 0.17999999999999999 110.221 -179.573 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' D' D ' 348' ' ' LEU . . . . . 0.582 HD22 ' N ' ' D' ' 348' ' ' LEU . 3.8 mm? -60.8 -48.81 80.09 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.26 -0.9 . . . . 0.31 110.017 -179.321 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' D' D ' 349' ' ' GLU . . . . . . . . . . . . . 43.4 mt-10 -56.83 -33.31 66.62 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.073 -1.017 . . . . 1.95 109.594 -179.591 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' D' D ' 350' ' ' LEU . . . . . 1.029 HD13 ' CD1' ' C' ' 350' ' ' LEU . 4.2 tt -64.16 -44.4 92.21 Favored 'General case' 0 N--CA 1.489 1.479 0 O-C-N 121.374 -0.829 . . . . 0.42999999999999999 109.243 179.968 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' D' D ' 351' ' ' LYS . . . . . . . . . . . . . 10.1 tttp -61.51 -44.78 96.45 Favored 'General case' 0 N--CA 1.489 1.486 0 O-C-N 121.393 -0.817 . . . . 1.3999999999999999 109.677 -179.943 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' D' D ' 352' ' ' ASP . . . . . . . . . . . . . 6.0 m-20 -55.96 -37.1 68.57 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.352 -0.842 . . . . 1.1699999999999999 109.701 -179.795 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' D' D ' 353' ' ' ALA . . . . . . . . . . . . . . . -66.44 -30.51 70.88 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.278 -0.889 . . . . 0.58999999999999997 109.722 -179.767 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' D' D ' 354' ' ' GLN . . . . . . . . . . . . . 2.5 tt0 -82.68 -5.23 58.75 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.269 -0.894 . . . . 1.4399999999999999 109.603 -179.947 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' D' D ' 355' ' ' ALA . . . . . . . . . . . . . . . -71.42 -6.04 37.33 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.153 -0.967 . . . . 0.97999999999999998 109.593 179.938 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' D' D ' 356' ' ' GLY . . . . . . . . . . . . . . . -80.25 3.18 73.32 Favored Glycine 0 N--CA 1.49 2.295 0 N-CA-C 109.632 -1.387 . . . . 1.28 109.632 179.941 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' D' D ' 357' ' ' LYS . . . . . . . . . . . . . 2.0 mtpp -86.47 104.0 15.53 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.215 -1.168 . . . . 4.0899999999999999 109.462 179.942 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' D' D ' 358' ' ' GLU . . . . . 0.598 ' N ' ' HD2' ' D' ' 359' ' ' PRO . 3.4 tt0 -51.22 -53.08 52.82 Favored Pre-proline 0 N--CA 1.489 1.48 0 O-C-N 121.248 -0.908 . . . . 5.71 109.811 179.8 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' D' D ' 359' ' ' PRO . . . . . 0.598 ' HD2' ' N ' ' D' ' 358' ' ' GLU . 2.5 Cg_endo -61.52 -47.92 10.52 Favored 'Trans proline' 0 C--N 1.311 -1.432 0 C-N-CA 121.791 1.661 . . . . 4.9699999999999998 110.077 -179.847 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' D' D ' 360' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.488 2.145 0 CA-C-O 117.964 -1.464 . . . . 6.9699999999999998 109.496 179.97 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 319' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 N--CA 1.488 1.438 0 N-CA-C 109.468 -0.567 . . . . 7.5499999999999998 109.468 . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 320' ' ' LYS . . . . . 0.483 ' O ' ' CG ' ' A' ' 321' ' ' LYS . 0.1 OUTLIER 63.62 -142.44 0.33 Allowed 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.305 -0.872 . . . . 6.4299999999999997 109.406 179.874 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 321' ' ' LYS . . . . . 0.483 ' CG ' ' O ' ' A' ' 320' ' ' LYS . 0.9 OUTLIER -157.76 87.75 2.51 Favored Pre-proline 0 N--CA 1.491 1.592 0 O-C-N 121.176 -0.953 . . . . 6.1299999999999999 109.722 -179.611 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 322' ' ' PRO . . . . . . . . . . . . . 4.8 Cg_endo -69.29 -3.92 12.67 Favored 'Trans proline' 0 C--N 1.311 -1.416 0 C-N-CA 122.208 1.939 . . . . 2.8300000000000001 110.455 179.993 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 323' ' ' LEU . . . . . . . . . . . . . 36.1 mt -79.03 100.94 7.55 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.171 -0.956 . . . . 2.8300000000000001 109.331 -179.887 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 324' ' ' ASP . . . . . . . . . . . . . 10.8 m-20 -79.63 176.79 9.39 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.085 -1.009 . . . . 1.53 109.615 -179.867 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 325' ' ' GLY . . . . . . . . . . . . . . . -69.06 -176.73 13.54 Favored Glycine 0 N--CA 1.492 2.367 0 N-CA-C 109.211 -1.556 . . . . 0.60999999999999999 109.211 179.654 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 326' ' ' GLU . . . . . . . . . . . . . 3.5 mt-10 -57.82 -175.82 0.02 OUTLIER 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.319 -1.107 . . . . 2.1299999999999999 109.716 -179.876 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 327' ' ' TYR . . . . . 0.611 ' CE1' ' HG2' ' C' ' 333' ' ' ARG . 39.1 m-85 -149.44 109.66 4.16 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.471 -0.768 . . . . 0.47999999999999998 109.613 -179.877 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 328' ' ' PHE . . . . . 0.45 ' O ' ' OE1' ' C' ' 331' ' ' GLN . 81.2 m-85 -113.01 -166.6 1.09 Allowed 'General case' 0 N--CA 1.489 1.487 0 O-C-N 121.439 -0.788 . . . . 0.31 109.293 179.658 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 329' ' ' THR . . . . . 0.441 ' HA ' ' O ' ' C' ' 330' ' ' LEU . 15.2 p -153.77 167.14 30.63 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.305 -0.872 . . . . 0.22 109.216 179.985 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 330' ' ' LEU . . . . . 0.423 HD11 HD22 ' C' ' 345' ' ' ASN . 15.1 tp -152.79 131.55 12.39 Favored 'General case' 0 C--N 1.303 -1.415 0 O-C-N 121.278 -0.889 . . . . 0.28000000000000003 109.876 -179.698 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 331' ' ' GLN . . . . . 0.406 ' O ' ' NH2' ' A' ' 333' ' ' ARG . 1.5 tt0 -86.4 117.42 25.19 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.29 -0.881 . . . . 0.91000000000000003 108.87 179.635 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 332' ' ' ILE . . . . . 0.586 HG21 ' HA ' ' A' ' 338' ' ' PHE . 61.1 mt -102.91 103.55 15.24 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.526 0 O-C-N 121.042 -1.036 . . . . 0.26000000000000001 109.725 -179.796 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 333' ' ' ARG . . . . . 0.469 ' CG ' HH11 ' A' ' 333' ' ' ARG . 0.0 OUTLIER -69.96 145.86 51.56 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.372 -0.83 . . . . 2.9199999999999999 109.123 179.659 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 334' ' ' GLY . . . . . . . . . . . . . . . 82.5 126.86 1.02 Allowed Glycine 0 N--CA 1.492 2.421 0 N-CA-C 109.654 -1.378 . . . . 0.40000000000000002 109.654 -179.801 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 335' ' ' ARG . . . . . 0.462 ' O ' ' HB3' ' A' ' 338' ' ' PHE . 10.2 ttm180 -74.6 -38.5 62.59 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.387 -1.066 . . . . 3.0099999999999998 109.334 179.881 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 336' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -55.54 -54.94 37.73 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.416 -0.802 . . . . 2.29 109.792 -179.555 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 337' ' ' ARG . . . . . . . . . . . . . 17.8 mtp180 -62.81 -28.65 70.15 Favored 'General case' 0 N--CA 1.496 1.835 0 O-C-N 121.381 -0.824 . . . . 2.9300000000000002 109.87 179.803 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 338' ' ' PHE . . . . . 0.586 ' HA ' HG21 ' A' ' 332' ' ' ILE . 77.9 t80 -55.05 -61.5 2.27 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.035 -1.04 . . . . 0.38 109.833 -179.453 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 339' ' ' GLU . . . . . . . . . . . . . 43.1 mt-10 -50.58 -31.75 16.69 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 120.935 -1.103 . . . . 1.97 109.769 -179.748 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 340' ' ' MET . . . . . . . . . . . . . 27.2 ttp -63.8 -55.06 25.82 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 120.991 -1.068 . . . . 0.31 110.153 -179.519 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 341' ' ' PHE . . . . . . . . . . . . . 43.5 m-85 -61.37 -53.72 53.03 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.346 -0.846 . . . . 0.17999999999999999 109.647 -179.502 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 342' ' ' ARG . . . . . . . . . . . . . 5.4 ttp180 -44.52 -40.57 5.75 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.466 -0.771 . . . . 2.4199999999999999 109.596 -179.866 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 343' ' ' GLU . . . . . . . . . . . . . 21.6 tt0 -58.68 -46.69 86.66 Favored 'General case' 0 N--CA 1.489 1.5 0 O-C-N 121.18 -0.95 . . . . 2.3500000000000001 109.866 -179.689 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 344' ' ' LEU . . . . . 0.616 HD22 ' CD2' ' B' ' 344' ' ' LEU . 49.3 mt -63.36 -45.16 92.46 Favored 'General case' 0 C--N 1.3 -1.552 0 O-C-N 121.269 -0.895 . . . . 0.17999999999999999 109.988 -179.628 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 345' ' ' ASN . . . . . . . . . . . . . 34.5 t-20 -53.02 -48.93 67.18 Favored 'General case' 0 C--N 1.302 -1.478 0 O-C-N 121.247 -0.908 . . . . 1.0900000000000001 109.595 -179.613 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 346' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -59.61 -36.34 76.12 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.178 -0.951 . . . . 1.6499999999999999 109.514 -179.922 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 347' ' ' ALA . . . . . 0.837 ' HB1' ' HB1' ' B' ' 347' ' ' ALA . . . -61.05 -49.44 77.35 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.239 -0.913 . . . . 0.17999999999999999 109.854 -179.924 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 348' ' ' LEU . . . . . 0.518 HD22 ' N ' ' A' ' 348' ' ' LEU . 4.0 mm? -61.84 -41.6 98.0 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 120.949 -1.094 . . . . 0.29999999999999999 109.739 -179.729 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 349' ' ' GLU . . . . . . . . . . . . . 61.5 mt-10 -58.06 -41.02 82.47 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.231 -0.918 . . . . 1.9399999999999999 110.117 -179.441 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 350' ' ' LEU . . . . . 0.621 HD22 HD13 ' B' ' 350' ' ' LEU . 7.7 tt -62.9 -41.43 99.44 Favored 'General case' 0 N--CA 1.488 1.461 0 O-C-N 121.109 -0.995 . . . . 0.46000000000000002 109.86 -179.52 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 351' ' ' LYS . . . . . . . . . . . . . 10.5 tttt -58.04 -46.7 84.91 Favored 'General case' 0 N--CA 1.494 1.751 0 O-C-N 121.0 -1.063 . . . . 1.3999999999999999 109.387 -179.741 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 352' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -55.8 -51.88 65.91 Favored 'General case' 0 N--CA 1.487 1.389 0 O-C-N 121.481 -0.762 . . . . 1.1599999999999999 109.778 -179.951 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 353' ' ' ALA . . . . . . . . . . . . . . . -68.65 -14.76 63.23 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 120.964 -1.085 . . . . 0.63 109.574 -179.829 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 354' ' ' GLN . . . . . . . . . . . . . 2.4 tt0 -82.19 -1.83 50.32 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.279 -0.888 . . . . 1.47 109.611 -179.893 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 355' ' ' ALA . . . . . . . . . . . . . . . -69.82 -89.19 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.18 -0.95 . . . . 1.01 109.802 -179.92 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 356' ' ' GLY . . . . . . . . . . . . . . . -67.43 100.67 0.61 Allowed Glycine 0 N--CA 1.493 2.433 0 N-CA-C 109.656 -1.378 . . . . 1.3 109.656 -179.915 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 357' ' ' LYS . . . . . 0.416 ' O ' ' HD3' ' A' ' 359' ' ' PRO . 0.9 OUTLIER -89.44 128.17 35.92 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.177 -1.19 . . . . 4.0999999999999996 109.564 179.948 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 358' ' ' GLU . . . . . . . . . . . . . 11.2 tt0 -48.27 107.66 0.79 Allowed Pre-proline 0 N--CA 1.488 1.45 0 O-C-N 121.335 -0.853 . . . . 5.75 109.04 179.337 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 359' ' ' PRO . . . . . 0.416 ' HD3' ' O ' ' A' ' 357' ' ' LYS . 1.8 Cg_endo -62.31 125.56 16.57 Favored 'Trans proline' 0 C--N 1.315 -1.204 0 C-N-CA 122.186 1.924 . . . . 5.0 109.888 179.88 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 360' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.281 0 N-CA-C 109.136 -1.586 . . . . 6.9699999999999998 109.136 -179.933 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' B' B ' 319' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 N--CA 1.49 1.534 0 N-CA-C 109.536 -0.542 . . . . 7.5499999999999998 109.536 . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 320' ' ' LYS . . . . . 0.451 ' O ' ' CG ' ' B' ' 321' ' ' LYS . 0.1 OUTLIER 64.13 -144.24 0.29 Allowed 'General case' 0 N--CA 1.487 1.416 0 O-C-N 121.335 -0.853 . . . . 6.4400000000000004 109.456 179.942 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' B' B ' 321' ' ' LYS . . . . . 0.451 ' CG ' ' O ' ' B' ' 320' ' ' LYS . 0.8 OUTLIER -156.83 88.01 2.73 Favored Pre-proline 0 N--CA 1.492 1.657 0 O-C-N 121.234 -0.916 . . . . 6.1299999999999999 109.636 -179.802 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' B' B ' 322' ' ' PRO . . . . . . . . . . . . . 4.2 Cg_endo -69.72 -1.85 9.14 Favored 'Trans proline' 0 C--N 1.31 -1.473 0 C-N-CA 122.25 1.966 . . . . 2.8199999999999998 110.357 -179.888 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 323' ' ' LEU . . . . . . . . . . . . . 40.0 mt -80.17 99.92 8.02 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.109 -0.994 . . . . 2.8399999999999999 109.54 -179.777 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 324' ' ' ASP . . . . . . . . . . . . . 13.1 m-20 -78.74 174.71 11.15 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.207 -0.933 . . . . 1.53 109.779 -179.835 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 325' ' ' GLY . . . . . . . . . . . . . . . -66.88 -174.75 6.58 Favored Glycine 0 N--CA 1.489 2.226 0 N-CA-C 109.533 -1.427 . . . . 0.58999999999999997 109.533 179.865 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 326' ' ' GLU . . . . . . . . . . . . . 3.4 mt-10 -59.19 -174.18 0.02 OUTLIER 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.44 -1.036 . . . . 2.1299999999999999 109.391 -179.902 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 327' ' ' TYR . . . . . 0.455 ' CE1' ' HG2' ' D' ' 333' ' ' ARG . 41.1 m-85 -150.35 109.72 3.98 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.444 -0.785 . . . . 0.47999999999999998 109.556 179.902 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 328' ' ' PHE . . . . . 0.402 ' O ' HG23 ' B' ' 329' ' ' THR . 91.1 m-85 -113.41 -167.05 1.14 Allowed 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.363 -0.835 . . . . 0.32000000000000001 109.399 179.999 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 329' ' ' THR . . . . . 0.446 ' HA ' ' O ' ' D' ' 330' ' ' LEU . 18.0 p -153.53 165.64 35.24 Favored 'General case' 0 N--CA 1.487 1.41 0 O-C-N 121.122 -0.987 . . . . 0.23000000000000001 109.351 179.836 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 330' ' ' LEU . . . . . 0.416 HD11 HD22 ' D' ' 345' ' ' ASN . 14.9 tp -151.19 132.8 14.83 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.206 -0.934 . . . . 0.28000000000000003 110.102 -179.685 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 331' ' ' GLN . . . . . . . . . . . . . 1.4 tt0 -87.06 117.95 26.13 Favored 'General case' 0 C--N 1.301 -1.528 0 O-C-N 121.296 -0.877 . . . . 0.91000000000000003 109.067 179.496 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 332' ' ' ILE . . . . . 0.601 HG21 ' HA ' ' B' ' 338' ' ' PHE . 56.4 mt -103.02 104.89 17.29 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.5 0 O-C-N 121.14 -0.975 . . . . 0.23999999999999999 109.664 179.813 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 333' ' ' ARG . . . . . 0.472 HH11 ' CG ' ' B' ' 333' ' ' ARG . 0.0 OUTLIER -70.76 145.44 50.43 Favored 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.385 -0.822 . . . . 2.9300000000000002 108.927 179.602 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' B' B ' 334' ' ' GLY . . . . . . . . . . . . . . . 81.62 131.18 1.27 Allowed Glycine 0 N--CA 1.491 2.303 0 N-CA-C 109.264 -1.534 . . . . 0.40000000000000002 109.264 -179.685 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 335' ' ' ARG . . . . . 0.47 ' O ' ' HB3' ' B' ' 338' ' ' PHE . 9.9 ttm180 -77.5 -38.14 49.62 Favored 'General case' 0 N--CA 1.489 1.48 0 O-C-N 121.283 -1.128 . . . . 3.0099999999999998 109.472 -179.931 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 336' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -56.38 -54.48 45.11 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.362 -0.837 . . . . 2.2799999999999998 109.382 -179.924 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 337' ' ' ARG . . . . . . . . . . . . . 18.6 mtp180 -62.19 -28.49 69.71 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.189 -0.944 . . . . 2.9300000000000002 109.944 -179.987 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 338' ' ' PHE . . . . . 0.601 ' HA ' HG21 ' B' ' 332' ' ' ILE . 80.2 t80 -55.85 -61.18 2.54 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 120.985 -1.072 . . . . 0.37 109.848 -179.617 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 339' ' ' GLU . . . . . . . . . . . . . 35.8 mt-10 -50.44 -32.84 18.96 Favored 'General case' 0 N--CA 1.494 1.77 0 O-C-N 121.241 -0.912 . . . . 1.98 109.846 -179.6 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 340' ' ' MET . . . . . . . . . . . . . 27.0 ttp -63.08 -54.42 38.33 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.265 -0.897 . . . . 0.32000000000000001 109.921 -179.725 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 341' ' ' PHE . . . . . 0.416 ' O ' ' C ' ' B' ' 342' ' ' ARG . 45.0 m-85 -62.28 -54.06 46.1 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.464 -0.772 . . . . 0.17999999999999999 109.826 -179.721 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 342' ' ' ARG . . . . . 0.416 ' C ' ' O ' ' B' ' 341' ' ' PHE . 4.4 ttp180 -45.0 -39.14 5.31 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 120.926 -1.108 . . . . 2.4199999999999999 109.768 -179.954 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 343' ' ' GLU . . . . . . . . . . . . . 20.1 tt0 -58.68 -47.6 83.94 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.111 -0.993 . . . . 2.3500000000000001 109.568 -179.911 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 344' ' ' LEU . . . . . 0.616 ' CD2' HD22 ' A' ' 344' ' ' LEU . 48.0 mt -63.27 -45.25 92.33 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.047 -1.033 . . . . 0.17999999999999999 110.244 -179.628 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 345' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -52.79 -48.12 67.09 Favored 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.28 -0.887 . . . . 1.0900000000000001 109.666 -179.316 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 346' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -60.48 -35.64 76.39 Favored 'General case' 0 N--CA 1.488 1.447 0 O-C-N 121.021 -1.049 . . . . 1.6599999999999999 109.465 179.882 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 347' ' ' ALA . . . . . 0.837 ' HB1' ' HB1' ' A' ' 347' ' ' ALA . . . -61.72 -48.88 78.75 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.145 -0.972 . . . . 0.17000000000000001 110.406 -179.732 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 348' ' ' LEU . . . . . 0.543 HD22 ' N ' ' B' ' 348' ' ' LEU . 3.8 mm? -63.0 -40.85 99.0 Favored 'General case' 0 N--CA 1.495 1.818 0 O-C-N 121.263 -0.898 . . . . 0.28999999999999998 109.661 -179.647 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 349' ' ' GLU . . . . . . . . . . . . . 64.5 mt-10 -58.32 -41.54 84.79 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.264 -0.898 . . . . 1.95 110.254 -179.863 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 350' ' ' LEU . . . . . 0.621 HD13 HD22 ' A' ' 350' ' ' LEU . 8.6 tt -61.93 -41.65 98.2 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.067 -1.021 . . . . 0.45000000000000001 109.969 -179.428 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 351' ' ' LYS . . . . . . . . . . . . . 10.9 tttt -57.9 -47.02 84.03 Favored 'General case' 0 C--N 1.3 -1.577 0 O-C-N 121.084 -1.01 . . . . 1.3799999999999999 109.425 179.952 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 352' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -55.28 -50.62 69.06 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 120.917 -1.114 . . . . 1.1599999999999999 109.835 -179.9 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 353' ' ' ALA . . . . . . . . . . . . . . . -69.26 -16.0 63.49 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 121.284 -0.885 . . . . 0.60999999999999999 109.667 -179.853 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 354' ' ' GLN . . . . . . . . . . . . . 3.2 tt0 -81.94 -2.71 52.29 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.263 -0.898 . . . . 1.45 109.892 -179.808 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 355' ' ' ALA . . . . . . . . . . . . . . . -69.31 -89.46 0.01 OUTLIER 'General case' 0 N--CA 1.493 1.717 0 O-C-N 121.321 -0.862 . . . . 0.97999999999999998 109.818 -179.568 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 356' ' ' GLY . . . . . . . . . . . . . . . -67.1 100.3 0.57 Allowed Glycine 0 N--CA 1.492 2.39 0 N-CA-C 109.686 -1.366 . . . . 1.29 109.686 -179.79 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 357' ' ' LYS . . . . . 0.441 ' O ' ' HD3' ' B' ' 359' ' ' PRO . 0.5 OUTLIER -88.94 127.34 35.65 Favored 'General case' 0 N--CA 1.494 1.731 0 O-C-N 121.4 -1.059 . . . . 4.0899999999999999 109.685 -179.989 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' B' B ' 358' ' ' GLU . . . . . . . . . . . . . 10.9 tt0 -48.17 106.78 0.64 Allowed Pre-proline 0 N--CA 1.49 1.541 0 O-C-N 121.518 -0.739 . . . . 5.7199999999999998 109.029 179.687 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 359' ' ' PRO . . . . . 0.441 ' HD3' ' O ' ' B' ' 357' ' ' LYS . 2.2 Cg_endo -60.9 124.89 15.84 Favored 'Trans proline' 0 C--N 1.314 -1.276 0 C-N-CA 122.067 1.845 . . . . 4.9800000000000004 110.292 -179.83 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 360' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.17 0 CA-C-O 118.084 -1.398 . . . . 6.9800000000000004 109.643 -179.91 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' C' C ' 319' ' ' LYS . . . . . . . . . . . . . 11.5 mmtp . . . . . 0 N--CA 1.489 1.496 0 N-CA-C 109.437 -0.579 . . . . 6.8200000000000003 109.437 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' C' C ' 320' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 60.12 -88.84 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.174 -0.953 . . . . 6.4900000000000002 109.674 179.934 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' C' C ' 321' ' ' LYS . . . . . . . . . . . . . 1.9 mttp -161.06 86.21 1.75 Allowed Pre-proline 0 N--CA 1.491 1.596 0 O-C-N 121.304 -0.873 . . . . 6.4000000000000004 110.163 -179.665 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 322' ' ' PRO . . . . . . . . . . . . . 3.9 Cg_exo -61.08 -152.69 0.01 OUTLIER 'Trans proline' 0 C--N 1.311 -1.438 0 C-N-CA 122.247 1.965 . . . . 3.4199999999999999 110.135 179.665 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 323' ' ' LEU . . . . . . . . . . . . . 95.1 mt -77.57 107.66 10.19 Favored 'General case' 0 N--CA 1.489 1.492 0 O-C-N 121.295 -0.878 . . . . 3.9500000000000002 109.168 179.898 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 324' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -80.39 128.99 34.21 Favored 'General case' 0 N--CA 1.488 1.439 0 O-C-N 121.33 -0.856 . . . . 1.6299999999999999 109.537 -179.745 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 325' ' ' GLY . . . . . 0.561 ' O ' ' CE2' ' C' ' 327' ' ' TYR . . . -66.72 178.59 14.81 Favored Glycine 0 N--CA 1.491 2.326 0 N-CA-C 108.952 -1.659 . . . . 0.72999999999999998 108.952 179.781 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' C' C ' 326' ' ' GLU . . . . . . . . . . . . . 8.0 mm-40 -56.88 179.05 0.05 OUTLIER 'General case' 0 C--N 1.303 -1.445 0 O-C-N 120.717 -1.46 . . . . 2.1699999999999999 108.938 179.893 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 327' ' ' TYR . . . . . 0.561 ' CE2' ' O ' ' C' ' 325' ' ' GLY . 47.9 m-85 -149.78 109.46 4.04 Favored 'General case' 0 C--N 1.3 -1.561 0 O-C-N 121.014 -1.054 . . . . 0.47999999999999998 110.139 -179.804 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' C' C ' 328' ' ' PHE . . . . . 0.407 ' CZ ' ' HG3' ' A' ' 335' ' ' ARG . 77.4 m-85 -110.72 -167.79 1.23 Allowed 'General case' 0 N--CA 1.491 1.59 0 N-CA-C 108.886 -0.783 . . . . 0.33000000000000002 108.886 179.742 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' C' C ' 329' ' ' THR . . . . . 0.402 HG23 ' O ' ' C' ' 328' ' ' PHE . 6.4 p -151.77 160.12 43.69 Favored 'General case' 0 C--N 1.302 -1.486 0 O-C-N 121.052 -1.03 . . . . 0.23000000000000001 109.312 -179.779 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' C' C ' 330' ' ' LEU . . . . . 0.441 ' O ' ' HA ' ' A' ' 329' ' ' THR . 21.8 tp -149.32 126.87 11.61 Favored 'General case' 0 N--CA 1.494 1.771 0 O-C-N 121.083 -1.01 . . . . 0.28000000000000003 109.833 -179.674 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' C' C ' 331' ' ' GLN . . . . . 0.45 ' OE1' ' O ' ' A' ' 328' ' ' PHE . 0.7 OUTLIER -87.14 120.99 28.99 Favored 'General case' 0 N--CA 1.496 1.851 0 O-C-N 121.437 -0.79 . . . . 1.48 109.578 179.904 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' C' C ' 332' ' ' ILE . . . . . 0.493 HD12 ' CD1' ' C' ' 338' ' ' PHE . 15.2 mt -103.88 111.1 32.25 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.854 0 O-C-N 121.023 -1.048 . . . . 0.23999999999999999 109.843 179.762 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' C' C ' 333' ' ' ARG . . . . . 0.611 ' HG2' ' CE1' ' A' ' 327' ' ' TYR . 4.4 mtp180 -72.06 137.66 47.29 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.351 -0.843 . . . . 2.7400000000000002 109.332 179.709 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' C' C ' 334' ' ' GLY . . . . . . . . . . . . . . . 90.94 137.0 7.01 Favored Glycine 0 N--CA 1.491 2.303 0 N-CA-C 109.82 -1.312 . . . . 0.34999999999999998 109.82 179.709 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 335' ' ' ARG . . . . . 0.409 ' HA ' ' CE1' ' A' ' 328' ' ' PHE . 3.1 ttt180 -80.09 -38.9 30.76 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.272 -1.134 . . . . 2.5299999999999998 109.31 179.929 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' C' C ' 336' ' ' GLU . . . . . 0.418 ' HA ' ' OE1' ' C' ' 339' ' ' GLU . 1.7 tm-20 -58.91 -52.8 64.18 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.569 -0.707 . . . . 2.6200000000000001 109.391 179.992 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' C' C ' 337' ' ' ARG . . . . . . . . . . . . . 34.9 mtp180 -60.91 -34.66 75.02 Favored 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.33 -0.856 . . . . 2.8100000000000001 109.324 179.975 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 338' ' ' PHE . . . . . 0.493 ' CD1' HD12 ' C' ' 332' ' ' ILE . 57.5 t80 -53.57 -65.21 0.6 Allowed 'General case' 0 N--CA 1.487 1.403 0 O-C-N 121.264 -0.898 . . . . 0.40000000000000002 109.745 -179.735 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' C' C ' 339' ' ' GLU . . . . . 0.418 ' OE1' ' HA ' ' C' ' 336' ' ' GLU . 3.2 mp0 -47.13 -34.84 6.46 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.249 -0.907 . . . . 2.0499999999999998 110.375 -179.217 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' C' C ' 340' ' ' MET . . . . . . . . . . . . . 15.2 ttp -63.92 -53.4 50.98 Favored 'General case' 0 C--N 1.301 -1.51 0 O-C-N 120.841 -1.162 . . . . 0.32000000000000001 110.034 -179.208 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 341' ' ' PHE . . . . . 0.441 ' HB2' HD13 ' C' ' 332' ' ' ILE . 40.6 m-85 -61.29 -44.92 96.42 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.032 -1.043 . . . . 0.17999999999999999 109.614 -179.581 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' C' C ' 342' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -50.5 -45.52 56.51 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.213 -0.929 . . . . 2.9100000000000001 110.41 -179.699 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' C' C ' 343' ' ' GLU . . . . . . . . . . . . . 5.1 tt0 -57.34 -43.58 83.52 Favored 'General case' 0 N--CA 1.489 1.497 0 O-C-N 121.331 -0.856 . . . . 2.1400000000000001 109.786 -179.431 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 344' ' ' LEU . . . . . 0.437 HD22 HD22 ' D' ' 344' ' ' LEU . 41.3 mt -62.64 -46.93 85.95 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.192 -0.942 . . . . 0.22 109.779 179.945 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' C' C ' 345' ' ' ASN . . . . . 0.423 HD22 HD11 ' A' ' 330' ' ' LEU . 31.2 t-20 -55.22 -49.48 71.87 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.287 -0.883 . . . . 1.0800000000000001 109.896 -179.499 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' C' C ' 346' ' ' GLU . . . . . . . . . . . . . 13.6 tp10 -58.18 -35.95 72.35 Favored 'General case' 0 N--CA 1.489 1.5 0 O-C-N 121.098 -1.001 . . . . 2.21 109.713 -179.556 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 347' ' ' ALA . . . . . 0.809 ' HB1' ' HB1' ' D' ' 347' ' ' ALA . . . -61.49 -47.0 87.61 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.03 -1.044 . . . . 0.17999999999999999 109.802 -179.931 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' C' C ' 348' ' ' LEU . . . . . 0.496 ' N ' HD22 ' C' ' 348' ' ' LEU . 4.2 mm? -62.83 -48.44 79.08 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.104 -0.998 . . . . 0.32000000000000001 110.401 -179.552 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' C' C ' 349' ' ' GLU . . . . . . . . . . . . . 33.4 mt-10 -57.7 -36.53 72.1 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.151 -0.968 . . . . 2.1899999999999999 109.878 -179.176 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 350' ' ' LEU . . . . . 0.597 ' CD2' HD22 ' D' ' 350' ' ' LEU . 3.9 tt -62.05 -40.07 94.53 Favored 'General case' 0 N--CA 1.489 1.482 0 O-C-N 121.312 -0.867 . . . . 0.46000000000000002 109.424 -179.87 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' C' C ' 351' ' ' LYS . . . . . . . . . . . . . 12.3 tttt -58.72 -37.83 77.0 Favored 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.147 -0.97 . . . . 1.3500000000000001 109.084 -179.929 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 352' ' ' ASP . . . . . . . . . . . . . 49.0 m-20 -55.1 -54.97 36.41 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.29 -0.881 . . . . 1.1899999999999999 109.556 179.519 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 353' ' ' ALA . . . . . . . . . . . . . . . -68.55 -12.71 61.65 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.351 -0.843 . . . . 0.56999999999999995 109.544 -179.85 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 354' ' ' GLN . . . . . . . . . . . . . 1.9 tt0 -81.36 -6.86 59.35 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.222 -0.924 . . . . 1.47 109.611 -179.853 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 355' ' ' ALA . . . . . . . . . . . . . . . -66.74 -86.51 0.02 OUTLIER 'General case' 0 C--N 1.302 -1.461 0 O-C-N 121.243 -0.911 . . . . 0.93000000000000005 109.429 179.886 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 356' ' ' GLY . . . . . . . . . . . . . . . -77.07 104.12 1.88 Allowed Glycine 0 N--CA 1.491 2.355 0 N-CA-C 109.399 -1.48 . . . . 1.3300000000000001 109.399 -179.907 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 357' ' ' LYS . . . . . . . . . . . . . 14.9 mttt -87.7 103.92 16.05 Favored 'General case' 0 N--CA 1.487 1.419 0 O-C-N 121.223 -1.163 . . . . 4.0099999999999998 109.003 179.824 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 358' ' ' GLU . . . . . 0.596 ' CB ' ' HD3' ' C' ' 359' ' ' PRO . 3.7 mt-10 -50.02 -60.11 5.74 Favored Pre-proline 0 N--CA 1.492 1.66 0 O-C-N 121.414 -0.804 . . . . 5.75 109.767 -179.61 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' C' C ' 359' ' ' PRO . . . . . 0.596 ' HD3' ' CB ' ' C' ' 358' ' ' GLU . 5.3 Cg_exo -59.01 -154.06 0.01 OUTLIER 'Trans proline' 0 C--N 1.312 -1.393 0 C-N-CA 121.977 1.785 . . . . 4.9400000000000004 110.377 179.821 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' C' C ' 360' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.364 0 CA-C-O 117.955 -1.47 . . . . 6.5 109.428 179.878 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' D' D ' 319' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 N--CA 1.491 1.587 0 CA-C-O 121.143 0.497 . . . . 7.5300000000000002 109.679 . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' D' D ' 320' ' ' LYS . . . . . 0.52 ' O ' ' CG ' ' D' ' 321' ' ' LYS . 0.1 OUTLIER 62.98 -144.39 0.36 Allowed 'General case' 0 C--N 1.301 -1.513 0 O-C-N 121.094 -1.004 . . . . 6.4100000000000001 109.718 179.524 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' D' D ' 321' ' ' LYS . . . . . 0.52 ' CG ' ' O ' ' D' ' 320' ' ' LYS . 0.3 OUTLIER -158.74 88.77 2.19 Favored Pre-proline 0 N--CA 1.488 1.436 0 O-C-N 121.106 -0.996 . . . . 6.1100000000000003 109.458 -179.657 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' D' D ' 322' ' ' PRO . . . . . . . . . . . . . 2.5 Cg_endo -69.45 -1.54 8.4 Favored 'Trans proline' 0 C--N 1.312 -1.384 0 C-N-CA 122.292 1.995 . . . . 2.8199999999999998 110.546 179.666 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' D' D ' 323' ' ' LEU . . . . . . . . . . . . . 38.4 mt -79.55 100.15 7.62 Favored 'General case' 0 N--CA 1.488 1.474 0 O-C-N 121.033 -1.042 . . . . 2.8300000000000001 109.384 -179.789 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' D' D ' 324' ' ' ASP . . . . . . . . . . . . . 17.9 m-20 -78.81 175.01 10.88 Favored 'General case' 0 N--CA 1.493 1.722 0 O-C-N 121.466 -0.772 . . . . 1.54 109.529 -179.983 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' D' D ' 325' ' ' GLY . . . . . . . . . . . . . . . -67.76 -174.14 7.54 Favored Glycine 0 N--CA 1.491 2.364 0 N-CA-C 109.655 -1.378 . . . . 0.58999999999999997 109.655 -179.893 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' D' D ' 326' ' ' GLU . . . . . . . . . . . . . 3.4 mt-10 -59.59 -175.26 0.03 OUTLIER 'General case' 0 N--CA 1.489 1.491 0 O-C-N 121.276 -1.132 . . . . 2.1299999999999999 109.723 -179.899 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' D' D ' 327' ' ' TYR . . . . . . . . . . . . . 40.5 m-85 -149.39 109.88 4.22 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.277 -0.89 . . . . 0.46999999999999997 109.541 -179.695 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' D' D ' 328' ' ' PHE . . . . . 0.442 ' O ' HG23 ' D' ' 329' ' ' THR . 94.9 m-85 -113.29 -166.83 1.12 Allowed 'General case' 0 N--CA 1.488 1.469 0 O-C-N 121.213 -0.929 . . . . 0.29999999999999999 109.38 179.986 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' D' D ' 329' ' ' THR . . . . . 0.442 HG23 ' O ' ' D' ' 328' ' ' PHE . 19.1 p -154.1 165.05 37.44 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.248 -0.907 . . . . 0.22 109.517 179.875 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' D' D ' 330' ' ' LEU . . . . . 0.446 ' O ' ' HA ' ' B' ' 329' ' ' THR . 14.7 tp -150.69 132.56 15.08 Favored 'General case' 0 N--CA 1.487 1.413 0 O-C-N 121.029 -1.044 . . . . 0.28000000000000003 109.997 -179.463 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' D' D ' 331' ' ' GLN . . . . . . . . . . . . . 1.3 tt0 -86.21 117.14 24.84 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.234 -0.916 . . . . 0.93000000000000005 108.576 179.402 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' D' D ' 332' ' ' ILE . . . . . 0.619 HG21 ' HA ' ' D' ' 338' ' ' PHE . 63.7 mt -102.65 104.2 16.17 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.618 0 O-C-N 121.162 -0.961 . . . . 0.25 109.584 -179.923 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' D' D ' 333' ' ' ARG . . . . . 0.457 HH11 ' CG ' ' D' ' 333' ' ' ARG . 0.0 OUTLIER -70.19 146.49 50.71 Favored 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.422 -0.799 . . . . 2.9300000000000002 109.477 179.869 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' D' D ' 334' ' ' GLY . . . . . . . . . . . . . . . 80.33 130.93 0.94 Allowed Glycine 0 N--CA 1.491 2.363 0 N-CA-C 109.533 -1.427 . . . . 0.40999999999999998 109.533 -179.77 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' D' D ' 335' ' ' ARG . . . . . 0.477 ' O ' ' HB3' ' D' ' 338' ' ' PHE . 9.8 ttm180 -77.66 -36.33 51.47 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.104 -1.233 . . . . 3.0299999999999998 109.572 -179.753 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' D' D ' 336' ' ' GLU . . . . . . . . . . . . . 1.1 tt0 -57.12 -55.31 36.36 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.369 -0.832 . . . . 2.2599999999999998 109.358 -179.759 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' D' D ' 337' ' ' ARG . . . . . . . . . . . . . 18.1 mtp180 -61.48 -28.38 69.25 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.356 -0.84 . . . . 2.9199999999999999 109.695 -179.932 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' D' D ' 338' ' ' PHE . . . . . 0.619 ' HA ' HG21 ' D' ' 332' ' ' ILE . 79.5 t80 -55.74 -61.76 2.14 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.21 -0.931 . . . . 0.37 109.83 -179.482 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' D' D ' 339' ' ' GLU . . . . . . . . . . . . . 45.1 mt-10 -50.66 -31.63 16.81 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.38 -0.825 . . . . 1.99 109.945 -179.655 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' D' D ' 340' ' ' MET . . . . . . . . . . . . . 29.3 ttp -64.64 -53.86 40.96 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.093 -1.004 . . . . 0.31 110.0 -179.482 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' D' D ' 341' ' ' PHE . . . . . . . . . . . . . 46.3 m-85 -62.57 -53.41 55.1 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.216 -0.928 . . . . 0.17999999999999999 109.549 -179.74 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' D' D ' 342' ' ' ARG . . . . . . . . . . . . . 4.0 ttp180 -45.08 -38.67 5.19 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.101 -0.999 . . . . 2.4100000000000001 109.904 -179.924 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' D' D ' 343' ' ' GLU . . . . . . . . . . . . . 20.9 tt0 -59.39 -47.65 84.62 Favored 'General case' 0 N--CA 1.49 1.525 0 O-C-N 121.12 -0.988 . . . . 2.3500000000000001 109.534 -179.978 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' D' D ' 344' ' ' LEU . . . . . 0.453 ' O ' HD23 ' D' ' 348' ' ' LEU . 44.9 mt -63.18 -45.37 92.08 Favored 'General case' 0 C--N 1.301 -1.51 0 O-C-N 121.193 -0.942 . . . . 0.19 110.037 -179.703 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' D' D ' 345' ' ' ASN . . . . . 0.416 HD22 HD11 ' B' ' 330' ' ' LEU . 33.9 t-20 -52.43 -49.03 65.36 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.22 -0.925 . . . . 1.0900000000000001 109.858 -179.349 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' D' D ' 346' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -60.07 -35.63 75.59 Favored 'General case' 0 N--CA 1.488 1.436 0 O-C-N 121.077 -1.014 . . . . 1.6899999999999999 109.453 -179.961 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' D' D ' 347' ' ' ALA . . . . . 0.809 ' HB1' ' HB1' ' C' ' 347' ' ' ALA . . . -61.42 -48.97 78.78 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.259 -0.901 . . . . 0.17999999999999999 110.215 -179.677 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' D' D ' 348' ' ' LEU . . . . . 0.57 HD22 ' N ' ' D' ' 348' ' ' LEU . 4.0 mm? -62.91 -40.66 98.25 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.147 -0.971 . . . . 0.31 109.663 -179.7 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' D' D ' 349' ' ' GLU . . . . . . . . . . . . . 59.6 mt-10 -59.05 -41.64 88.39 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.3 -0.875 . . . . 1.95 110.059 -179.309 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' D' D ' 350' ' ' LEU . . . . . 0.597 HD22 ' CD2' ' C' ' 350' ' ' LEU . 8.3 tt -61.76 -41.45 97.7 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.04 -1.037 . . . . 0.42999999999999999 109.791 -179.282 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' D' D ' 351' ' ' LYS . . . . . . . . . . . . . 13.3 tttt -57.56 -47.34 82.33 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.01 -1.056 . . . . 1.3999999999999999 109.301 -179.96 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' D' D ' 352' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -55.8 -51.45 67.4 Favored 'General case' 0 C--N 1.301 -1.505 0 O-C-N 121.393 -0.817 . . . . 1.1699999999999999 109.503 179.984 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' D' D ' 353' ' ' ALA . . . . . . . . . . . . . . . -68.77 -14.88 63.31 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.153 -0.967 . . . . 0.58999999999999997 109.616 -179.806 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' D' D ' 354' ' ' GLN . . . . . . . . . . . . . 3.1 tt0 -82.81 -3.76 57.13 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.334 -0.854 . . . . 1.4399999999999999 109.955 -179.51 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' D' D ' 355' ' ' ALA . . . . . . . . . . . . . . . -69.51 -91.15 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.208 -0.932 . . . . 0.97999999999999998 109.983 -179.846 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' D' D ' 356' ' ' GLY . . . . . . . . . . . . . . . -64.41 99.25 0.32 Allowed Glycine 0 N--CA 1.497 2.747 0 N-CA-C 109.744 -1.342 . . . . 1.28 109.744 -179.699 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' D' D ' 357' ' ' LYS . . . . . 0.424 ' O ' ' HD3' ' D' ' 359' ' ' PRO . 0.2 OUTLIER -89.55 128.44 36.01 Favored 'General case' 0 N--CA 1.493 1.692 0 O-C-N 121.421 -1.047 . . . . 4.0899999999999999 109.535 -179.741 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' D' D ' 358' ' ' GLU . . . . . . . . . . . . . 12.0 tt0 -48.44 107.01 0.68 Allowed Pre-proline 0 N--CA 1.49 1.528 0 O-C-N 121.185 -0.947 . . . . 5.71 109.217 179.633 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' D' D ' 359' ' ' PRO . . . . . 0.424 ' HD3' ' O ' ' D' ' 357' ' ' LYS . 2.3 Cg_endo -61.97 126.15 18.15 Favored 'Trans proline' 0 C--N 1.313 -1.312 0 C-N-CA 122.003 1.802 . . . . 4.9699999999999998 109.977 -179.943 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' D' D ' 360' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.232 0 N-CA-C 109.361 -1.496 . . . . 6.9699999999999998 109.361 -179.944 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 319' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.49 1.535 0 N-CA-C 109.282 -0.636 . . . . 7.5499999999999998 109.282 . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 320' ' ' LYS . . . . . . . . . . . . . 32.4 tttt 58.43 90.43 0.05 OUTLIER 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.177 -0.952 . . . . 6.4299999999999997 109.167 -179.878 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 321' ' ' LYS . . . . . . . . . . . . . 27.8 mttt -81.4 155.27 71.74 Favored Pre-proline 0 N--CA 1.489 1.475 0 O-C-N 121.328 -0.857 . . . . 6.1299999999999999 109.565 -179.731 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 322' ' ' PRO . . . . . . . . . . . . . 4.0 Cg_exo -59.51 -154.28 0.01 OUTLIER 'Trans proline' 0 C--N 1.308 -1.585 0 C-N-CA 122.179 1.919 . . . . 2.8300000000000001 110.146 -179.993 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 323' ' ' LEU . . . . . . . . . . . . . 87.9 mt -80.67 123.36 28.1 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.154 -0.966 . . . . 2.8300000000000001 109.398 -179.964 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 324' ' ' ASP . . . . . . . . . . . . . 6.1 m-20 -80.26 -157.23 0.14 Allowed 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.241 -0.912 . . . . 1.53 109.613 -179.883 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 325' ' ' GLY . . . . . . . . . . . . . . . -69.09 174.4 33.78 Favored Glycine 0 N--CA 1.49 2.281 0 N-CA-C 109.669 -1.372 . . . . 0.60999999999999999 109.669 -179.944 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 326' ' ' GLU . . . . . . . . . . . . . 6.2 mm-40 -58.85 -169.96 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.316 -1.108 . . . . 2.1299999999999999 109.548 179.957 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 327' ' ' TYR . . . . . 0.607 ' CE1' ' HG2' ' C' ' 333' ' ' ARG . 49.1 m-85 -149.36 108.47 3.91 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.31 -0.869 . . . . 0.47999999999999998 109.315 179.98 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 328' ' ' PHE . . . . . 0.422 ' CZ ' ' HG3' ' C' ' 335' ' ' ARG . 98.0 m-85 -113.97 -167.54 1.22 Allowed 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.261 -0.9 . . . . 0.31 109.693 -179.902 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 329' ' ' THR . . . . . . . . . . . . . 41.5 p -152.83 165.13 36.39 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.398 -0.814 . . . . 0.22 108.967 179.91 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 330' ' ' LEU . . . . . . . . . . . . . 21.4 tp -151.55 129.59 11.83 Favored 'General case' 0 N--CA 1.489 1.497 0 O-C-N 121.067 -1.021 . . . . 0.28000000000000003 110.063 -179.519 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 331' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -88.28 116.32 26.4 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.28 -0.887 . . . . 0.91000000000000003 109.02 179.422 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 332' ' ' ILE . . . . . 0.593 HD12 ' CD1' ' A' ' 338' ' ' PHE . 36.1 mt -103.71 108.64 25.0 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.641 0 O-C-N 121.107 -0.996 . . . . 0.26000000000000001 110.082 -179.588 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 333' ' ' ARG . . . . . 0.452 ' HG2' ' CE1' ' C' ' 327' ' ' TYR . 0.1 OUTLIER -73.41 144.84 46.22 Favored 'General case' 0 N--CA 1.489 1.483 0 O-C-N 121.284 -0.885 . . . . 2.9199999999999999 109.152 179.417 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 334' ' ' GLY . . . . . 0.489 ' CA ' ' HB2' ' C' ' 326' ' ' GLU . . . 82.37 128.01 1.1 Allowed Glycine 0 N--CA 1.492 2.385 0 N-CA-C 109.534 -1.426 . . . . 0.40000000000000002 109.534 -179.853 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 335' ' ' ARG . . . . . . . . . . . . . 40.3 ttp180 -79.92 -30.48 40.04 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.269 -1.136 . . . . 3.0099999999999998 110.019 -179.717 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 336' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -55.41 -68.29 0.21 Allowed 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.199 -0.938 . . . . 2.29 109.967 -179.537 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 337' ' ' ARG . . . . . . . . . . . . . 16.3 mmt180 -60.36 -28.05 67.88 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.182 -0.949 . . . . 2.9300000000000002 109.693 -179.72 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 338' ' ' PHE . . . . . 0.593 ' CD1' HD12 ' A' ' 332' ' ' ILE . 66.2 t80 -55.56 -56.35 21.31 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.141 -0.974 . . . . 0.38 109.749 -179.934 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 339' ' ' GLU . . . . . . . . . . . . . 20.2 mm-40 -51.37 -37.48 48.3 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.276 -0.89 . . . . 1.97 109.948 -179.774 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 340' ' ' MET . . . . . . . . . . . . . 33.6 ttp -64.36 -45.39 87.95 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.138 -0.977 . . . . 0.31 110.252 -179.545 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 341' ' ' PHE . . . . . . . . . . . . . 32.8 m-85 -63.04 -51.07 68.18 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.234 -0.917 . . . . 0.17999999999999999 110.313 -179.341 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 342' ' ' ARG . . . . . 0.549 ' HG2' ' NH1' ' A' ' 342' ' ' ARG . 4.5 ttt-85 -49.0 -46.2 43.53 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.187 -0.946 . . . . 2.4199999999999999 110.158 -179.295 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 343' ' ' GLU . . . . . . . . . . . . . 2.1 tt0 -58.44 -43.05 88.6 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.27 -0.894 . . . . 2.3500000000000001 110.046 -179.408 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 344' ' ' LEU . . . . . . . . . . . . . 40.3 mt -62.54 -38.41 89.9 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.111 -0.993 . . . . 0.17999999999999999 109.828 -179.745 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 345' ' ' ASN . . . . . . . . . . . . . 46.7 t-20 -56.88 -48.43 78.18 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.152 -0.967 . . . . 1.0900000000000001 109.648 -179.778 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 346' ' ' GLU . . . . . . . . . . . . . 2.9 tt0 -61.7 -33.65 74.39 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.274 -0.891 . . . . 1.6499999999999999 109.835 -179.776 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 347' ' ' ALA . . . . . 0.945 ' HB1' ' HB1' ' B' ' 347' ' ' ALA . . . -60.53 -53.76 53.59 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.204 -0.935 . . . . 0.17999999999999999 110.27 -179.601 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 348' ' ' LEU . . . . . 0.599 HD22 ' N ' ' A' ' 348' ' ' LEU . 4.1 mm? -61.51 -48.46 80.93 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.201 -0.937 . . . . 0.29999999999999999 110.166 -179.319 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 349' ' ' GLU . . . . . . . . . . . . . 64.9 mm-40 -57.86 -32.89 68.1 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.182 -0.949 . . . . 1.9399999999999999 110.126 -179.426 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 350' ' ' LEU . . . . . 0.562 HD23 ' C ' ' A' ' 350' ' ' LEU . 7.7 tt -64.39 -49.11 72.88 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.136 -0.978 . . . . 0.46000000000000002 109.821 -179.647 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 351' ' ' LYS . . . . . . . . . . . . . 68.0 tttt -59.01 -43.25 91.52 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.193 -0.942 . . . . 1.3999999999999999 109.781 -179.547 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 352' ' ' ASP . . . . . . . . . . . . . 66.7 m-20 -56.52 -50.91 70.45 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.11 -0.994 . . . . 1.1599999999999999 109.66 -179.79 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 353' ' ' ALA . . . . . . . . . . . . . . . -68.23 -14.11 62.74 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.308 -0.87 . . . . 0.63 109.803 -179.676 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 354' ' ' GLN . . . . . . . . . . . . . 61.3 tt0 -83.85 -12.71 55.16 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.181 -0.949 . . . . 1.47 109.798 -179.857 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 355' ' ' ALA . . . . . . . . . . . . . . . -72.08 -46.28 57.44 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.276 -0.89 . . . . 1.01 109.797 -179.911 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 356' ' ' GLY . . . . . . . . . . . . . . . -80.27 11.03 39.4 Favored Glycine 0 N--CA 1.492 2.377 0 N-CA-C 110.333 -1.107 . . . . 1.3 110.333 -179.673 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 357' ' ' LYS . . . . . . . . . . . . . 2.8 tttt -85.76 14.76 5.45 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.013 -1.287 . . . . 4.0999999999999996 109.714 -179.831 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 358' ' ' GLU . . . . . . . . . . . . . 18.1 tt0 -49.31 135.11 16.74 Favored Pre-proline 0 N--CA 1.49 1.552 0 O-C-N 121.168 -0.958 . . . . 5.75 109.222 -179.99 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 359' ' ' PRO . . . . . . . . . . . . . 2.3 Cg_endo -62.06 -155.95 0.02 OUTLIER 'Trans proline' 0 C--N 1.312 -1.372 0 C-N-CA 122.034 1.823 . . . . 5.0 110.267 -179.823 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 360' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.204 0 CA-C-O 117.993 -1.448 . . . . 6.9699999999999998 109.612 -179.995 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' B' B ' 319' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.49 1.548 0 N-CA-C 109.437 -0.579 . . . . 7.5499999999999998 109.437 . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 320' ' ' LYS . . . . . . . . . . . . . 31.7 tttt 58.63 90.03 0.05 Allowed 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.225 -0.922 . . . . 6.4400000000000004 109.179 -179.776 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 321' ' ' LYS . . . . . . . . . . . . . 27.0 mttt -81.09 155.47 72.43 Favored Pre-proline 0 N--CA 1.489 1.499 0 O-C-N 121.26 -0.9 . . . . 6.1299999999999999 109.511 -179.714 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 322' ' ' PRO . . . . . . . . . . . . . 4.0 Cg_exo -59.71 -154.48 0.01 OUTLIER 'Trans proline' 0 C--N 1.309 -1.531 0 C-N-CA 122.237 1.958 . . . . 2.8199999999999998 110.038 179.896 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 323' ' ' LEU . . . . . . . . . . . . . 87.8 mt -80.48 123.4 28.04 Favored 'General case' 0 N--CA 1.488 1.465 0 O-C-N 121.201 -0.937 . . . . 2.8399999999999999 109.458 -179.923 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 324' ' ' ASP . . . . . . . . . . . . . 6.1 m-20 -80.19 -156.64 0.13 Allowed 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.272 -0.892 . . . . 1.53 109.584 -179.838 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 325' ' ' GLY . . . . . . . . . . . . . . . -69.71 174.47 35.82 Favored Glycine 0 N--CA 1.489 2.225 0 N-CA-C 109.683 -1.367 . . . . 0.58999999999999997 109.683 -179.895 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 326' ' ' GLU . . . . . . . . . . . . . 6.5 mm-40 -58.75 -170.19 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.318 -1.107 . . . . 2.1299999999999999 109.536 179.956 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 327' ' ' TYR . . . . . 0.477 ' CE1' ' HG2' ' D' ' 333' ' ' ARG . 49.0 m-85 -149.33 108.69 3.96 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.264 -0.898 . . . . 0.47999999999999998 109.373 179.881 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 328' ' ' PHE . . . . . . . . . . . . . 98.0 m-85 -114.09 -167.32 1.2 Allowed 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.242 -0.911 . . . . 0.32000000000000001 109.73 -179.847 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 329' ' ' THR . . . . . . . . . . . . . 40.9 p -152.81 165.2 36.13 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.423 -0.798 . . . . 0.23000000000000001 109.041 179.876 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 330' ' ' LEU . . . . . . . . . . . . . 21.4 tp -151.81 129.66 11.68 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.038 -1.039 . . . . 0.28000000000000003 110.038 -179.647 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 331' ' ' GLN . . . . . . . . . . . . . 1.7 tp60 -88.42 116.32 26.56 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.397 -0.814 . . . . 0.91000000000000003 109.001 179.528 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 332' ' ' ILE . . . . . 0.607 HD12 ' CD1' ' B' ' 338' ' ' PHE . 35.4 mt -103.74 108.94 25.7 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.614 0 O-C-N 121.18 -0.95 . . . . 0.23999999999999999 109.988 -179.555 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 333' ' ' ARG . . . . . 0.551 ' HG2' ' CE1' ' D' ' 327' ' ' TYR . 0.1 OUTLIER -73.83 144.57 45.45 Favored 'General case' 0 N--CA 1.489 1.481 0 O-C-N 121.267 -0.896 . . . . 2.9300000000000002 109.043 179.359 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 334' ' ' GLY . . . . . . . . . . . . . . . 82.65 127.54 1.11 Allowed Glycine 0 N--CA 1.492 2.418 0 N-CA-C 109.491 -1.444 . . . . 0.40000000000000002 109.491 -179.821 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 335' ' ' ARG . . . . . . . . . . . . . 40.3 ttp180 -79.71 -30.32 40.94 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.333 -1.098 . . . . 3.0099999999999998 109.944 -179.654 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 336' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -55.6 -68.43 0.2 Allowed 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.128 -0.982 . . . . 2.2799999999999998 109.824 -179.533 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 337' ' ' ARG . . . . . . . . . . . . . 16.5 mmt180 -60.21 -27.88 67.54 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.192 -0.942 . . . . 2.9300000000000002 109.67 -179.614 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 338' ' ' PHE . . . . . 0.607 ' CD1' HD12 ' B' ' 332' ' ' ILE . 65.4 t80 -55.73 -56.39 21.06 Favored 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.298 -0.876 . . . . 0.37 109.672 -179.867 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 339' ' ' GLU . . . . . . . . . . . . . 21.2 mm-40 -51.42 -37.56 49.14 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.229 -0.919 . . . . 1.98 109.886 -179.77 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 340' ' ' MET . . . . . . . . . . . . . 33.6 ttp -64.25 -45.54 87.68 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.202 -0.936 . . . . 0.32000000000000001 110.171 -179.48 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 341' ' ' PHE . . . . . . . . . . . . . 32.6 m-85 -62.88 -50.85 69.26 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.202 -0.936 . . . . 0.17999999999999999 110.433 -179.331 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 342' ' ' ARG . . . . . 0.542 ' NH1' ' HG2' ' B' ' 342' ' ' ARG . 4.5 ttt-85 -49.25 -46.21 45.78 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.165 -0.959 . . . . 2.4199999999999999 110.164 -179.337 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 343' ' ' GLU . . . . . . . . . . . . . 2.0 tt0 -58.28 -43.03 87.83 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.061 -1.024 . . . . 2.3500000000000001 110.016 -179.475 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 344' ' ' LEU . . . . . . . . . . . . . 40.2 mt -62.71 -38.19 89.47 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.107 -0.995 . . . . 0.17999999999999999 109.922 -179.718 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 345' ' ' ASN . . . . . . . . . . . . . 47.0 t-20 -57.13 -48.3 79.0 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.211 -0.931 . . . . 1.0900000000000001 109.658 -179.825 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 346' ' ' GLU . . . . . . . . . . . . . 2.9 tt0 -61.66 -33.7 74.42 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.206 -0.934 . . . . 1.6599999999999999 109.812 -179.825 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 347' ' ' ALA . . . . . 0.945 ' HB1' ' HB1' ' A' ' 347' ' ' ALA . . . -60.56 -53.74 53.81 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.197 -0.939 . . . . 0.17000000000000001 110.188 -179.526 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 348' ' ' LEU . . . . . 0.594 HD22 ' N ' ' B' ' 348' ' ' LEU . 4.1 mm? -61.42 -48.59 80.49 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.221 -0.924 . . . . 0.28999999999999998 110.178 -179.287 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 349' ' ' GLU . . . . . . . . . . . . . 64.3 mm-40 -57.76 -32.91 67.94 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.188 -0.945 . . . . 1.95 110.105 -179.348 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 350' ' ' LEU . . . . . 0.566 HD23 ' C ' ' B' ' 350' ' ' LEU . 7.6 tt -64.44 -49.06 72.94 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.133 -0.979 . . . . 0.45000000000000001 109.853 -179.631 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 351' ' ' LYS . . . . . . . . . . . . . 67.3 tttt -59.06 -43.41 91.73 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.299 -0.876 . . . . 1.3799999999999999 109.77 -179.569 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 352' ' ' ASP . . . . . . . . . . . . . 66.7 m-20 -56.25 -50.99 69.75 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.147 -0.971 . . . . 1.1599999999999999 109.729 -179.902 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 353' ' ' ALA . . . . . . . . . . . . . . . -68.29 -13.98 62.66 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.217 -0.927 . . . . 0.60999999999999999 109.777 -179.621 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 354' ' ' GLN . . . . . . . . . . . . . 61.5 tt0 -83.97 -12.53 55.18 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.17 -0.956 . . . . 1.45 109.775 -179.871 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 355' ' ' ALA . . . . . . . . . . . . . . . -72.46 -45.92 57.28 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.28 -0.887 . . . . 0.97999999999999998 109.638 -179.878 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 356' ' ' GLY . . . . . . . . . . . . . . . -80.5 11.06 40.77 Favored Glycine 0 N--CA 1.492 2.392 0 N-CA-C 110.358 -1.097 . . . . 1.29 110.358 -179.665 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 357' ' ' LYS . . . . . . . . . . . . . 2.8 tttt -85.91 15.08 5.21 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 120.969 -1.313 . . . . 4.0899999999999999 109.749 -179.806 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 358' ' ' GLU . . . . . . . . . . . . . 18.1 tt0 -49.47 135.27 17.87 Favored Pre-proline 0 N--CA 1.491 1.586 0 O-C-N 121.143 -0.973 . . . . 5.7199999999999998 109.246 179.967 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 359' ' ' PRO . . . . . . . . . . . . . 2.4 Cg_endo -62.05 -155.71 0.02 OUTLIER 'Trans proline' 0 C--N 1.312 -1.353 0 C-N-CA 121.983 1.788 . . . . 4.9800000000000004 110.247 -179.88 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 360' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.311 0 N-CA-C 109.522 -1.431 . . . . 6.9800000000000004 109.522 179.985 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' C' C ' 319' ' ' LYS . . . . . 0.452 ' O ' ' HD2' ' C' ' 322' ' ' PRO . 1.7 tttp . . . . . 0 N--CA 1.49 1.535 0 CA-C-O 121.4 0.619 . . . . 6.8200000000000003 109.48 . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 320' ' ' LYS . . . . . 0.443 ' HB2' ' O ' ' C' ' 319' ' ' LYS . 2.5 mptt 66.55 -91.94 0.03 OUTLIER 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.24 -0.912 . . . . 6.4900000000000002 109.788 179.871 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' C' C ' 321' ' ' LYS . . . . . 0.631 ' CB ' ' HD3' ' C' ' 322' ' ' PRO . 0.2 OUTLIER -84.51 -64.97 0.22 Allowed Pre-proline 0 N--CA 1.49 1.558 0 O-C-N 121.045 -1.035 . . . . 6.4000000000000004 110.617 -179.394 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' C' C ' 322' ' ' PRO . . . . . 0.631 ' HD3' ' CB ' ' C' ' 321' ' ' LYS . 3.0 Cg_exo -58.37 83.68 0.05 OUTLIER 'Trans proline' 0 C--N 1.315 -1.211 0 C-N-CA 121.874 1.716 . . . . 3.4199999999999999 110.994 -179.697 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' C' C ' 323' ' ' LEU . . . . . 0.46 ' HG ' ' O ' ' C' ' 321' ' ' LYS . 76.1 mt -85.62 42.85 0.99 Allowed 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.225 -0.922 . . . . 3.9500000000000002 109.326 179.398 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' C' C ' 324' ' ' ASP . . . . . 0.404 ' N ' ' OD1' ' C' ' 324' ' ' ASP . 6.9 m-20 -83.41 5.6 23.04 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.19 -0.944 . . . . 1.6299999999999999 110.572 -179.344 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' C' C ' 325' ' ' GLY . . . . . 0.603 ' O ' ' CD2' ' C' ' 327' ' ' TYR . . . -65.85 159.47 46.12 Favored Glycine 0 N--CA 1.491 2.341 0 N-CA-C 108.91 -1.676 . . . . 0.72999999999999998 108.91 179.846 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' C' C ' 326' ' ' GLU . . . . . 0.489 ' HB2' ' CA ' ' A' ' 334' ' ' GLY . 6.5 mm-40 -58.18 157.89 7.72 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 120.993 -1.298 . . . . 2.1699999999999999 108.836 -179.947 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' C' C ' 327' ' ' TYR . . . . . 0.603 ' CD2' ' O ' ' C' ' 325' ' ' GLY . 37.5 m-85 -149.09 102.94 3.29 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.042 -1.036 . . . . 0.47999999999999998 110.215 -179.583 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' C' C ' 328' ' ' PHE . . . . . 0.442 ' CE2' ' HB3' ' C' ' 326' ' ' GLU . 90.6 m-85 -112.98 -165.23 0.97 Allowed 'General case' 0 N--CA 1.489 1.478 0 O-C-N 121.48 -0.762 . . . . 0.33000000000000002 108.966 179.337 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' C' C ' 329' ' ' THR . . . . . 0.436 HG23 ' C ' ' C' ' 328' ' ' PHE . 54.6 p -155.48 156.45 35.27 Favored 'General case' 0 N--CA 1.489 1.492 0 O-C-N 121.085 -1.01 . . . . 0.23000000000000001 109.437 179.961 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' C' C ' 330' ' ' LEU . . . . . . . . . . . . . 18.1 tp -148.71 120.06 7.87 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.331 -0.856 . . . . 0.28000000000000003 109.596 -179.671 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 331' ' ' GLN . . . . . 0.45 ' OE1' ' HB3' ' A' ' 327' ' ' TYR . 0.1 OUTLIER -86.98 117.69 25.87 Favored 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.32 -0.863 . . . . 1.48 109.089 179.743 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' C' C ' 332' ' ' ILE . . . . . 0.417 HD12 ' CD1' ' C' ' 338' ' ' PHE . 18.8 mt -103.8 118.68 51.31 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.557 0 O-C-N 121.116 -0.99 . . . . 0.23999999999999999 109.972 -179.639 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' C' C ' 333' ' ' ARG . . . . . 0.607 ' HG2' ' CE1' ' A' ' 327' ' ' TYR . 4.1 mtp180 -73.25 143.38 47.1 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.384 -0.823 . . . . 2.7400000000000002 109.309 179.526 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' C' C ' 334' ' ' GLY . . . . . . . . . . . . . . . 86.22 130.78 2.73 Favored Glycine 0 N--CA 1.491 2.365 0 N-CA-C 109.694 -1.363 . . . . 0.34999999999999998 109.694 179.867 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 335' ' ' ARG . . . . . 0.448 ' O ' ' HB3' ' C' ' 338' ' ' PHE . 0.0 OUTLIER -80.25 -37.91 31.99 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.367 -1.078 . . . . 2.5299999999999998 109.81 -179.994 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' C' C ' 336' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -56.33 -59.0 5.59 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.222 -0.923 . . . . 2.6200000000000001 109.521 -179.83 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' C' C ' 337' ' ' ARG . . . . . 0.518 ' HD2' ' N ' ' C' ' 337' ' ' ARG . 18.6 mmm180 -60.95 -30.82 70.46 Favored 'General case' 0 N--CA 1.489 1.482 0 O-C-N 121.247 -0.908 . . . . 2.8100000000000001 109.241 179.836 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' C' C ' 338' ' ' PHE . . . . . 0.448 ' HB3' ' O ' ' C' ' 335' ' ' ARG . 91.7 t80 -55.03 -54.99 36.0 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.326 -0.859 . . . . 0.40000000000000002 109.554 179.991 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' C' C ' 339' ' ' GLU . . . . . . . . . . . . . 27.4 mt-10 -51.82 -32.81 33.14 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.313 -0.867 . . . . 2.0499999999999998 110.055 -179.787 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 340' ' ' MET . . . . . . . . . . . . . 3.3 ttt -63.66 -51.7 63.96 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.073 -1.017 . . . . 0.32000000000000001 110.067 -179.539 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 341' ' ' PHE . . . . . . . . . . . . . 65.1 m-85 -62.68 -46.48 87.96 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.161 -0.962 . . . . 0.17999999999999999 110.057 -179.506 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 342' ' ' ARG . . . . . 0.483 ' O ' ' HB3' ' C' ' 345' ' ' ASN . 14.6 ttm180 -49.81 -43.53 48.61 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.2 -0.937 . . . . 2.9100000000000001 109.965 -179.558 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' C' C ' 343' ' ' GLU . . . . . . . . . . . . . 1.3 tt0 -58.19 -48.53 80.02 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.04 -1.037 . . . . 2.1400000000000001 109.568 -179.685 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 344' ' ' LEU . . . . . . . . . . . . . 36.7 mt -61.82 -26.58 68.2 Favored 'General case' 0 N--CA 1.488 1.469 0 O-C-N 121.229 -0.919 . . . . 0.22 109.549 -179.977 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 345' ' ' ASN . . . . . 0.483 ' HB3' ' O ' ' C' ' 342' ' ' ARG . 24.0 t-20 -57.15 -62.52 1.7 Allowed 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.219 -0.926 . . . . 1.0800000000000001 109.659 -179.866 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' C' C ' 346' ' ' GLU . . . . . 0.454 ' O ' ' HB2' ' C' ' 350' ' ' LEU . 2.5 tt0 -62.04 -23.66 66.6 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.209 -0.932 . . . . 2.21 109.768 -179.692 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' C' C ' 347' ' ' ALA . . . . . 0.728 ' HB1' ' HB1' ' D' ' 347' ' ' ALA . . . -62.33 -57.04 12.81 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.194 -0.941 . . . . 0.17999999999999999 109.865 -179.84 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' C' C ' 348' ' ' LEU . . . . . 0.508 ' N ' ' CD2' ' C' ' 348' ' ' LEU . 3.6 mm? -61.58 -53.46 55.93 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.244 -0.91 . . . . 0.32000000000000001 110.032 -179.658 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' C' C ' 349' ' ' GLU . . . . . . . . . . . . . 1.5 mt-10 -56.38 -28.83 60.39 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.172 -0.955 . . . . 2.1899999999999999 109.692 -179.578 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 350' ' ' LEU . . . . . 0.699 ' CD2' HD13 ' D' ' 350' ' ' LEU . 10.3 tt -65.24 -48.78 72.11 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.341 -0.849 . . . . 0.46000000000000002 109.212 179.821 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' C' C ' 351' ' ' LYS . . . . . . . . . . . . . 31.1 tttm -58.26 -42.83 87.29 Favored 'General case' 0 N--CA 1.488 1.454 0 O-C-N 121.466 -0.771 . . . . 1.3500000000000001 109.579 -179.782 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 352' ' ' ASP . . . . . . . . . . . . . 5.2 m-20 -61.0 -43.05 99.46 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.288 -0.882 . . . . 1.1899999999999999 109.712 179.752 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 353' ' ' ALA . . . . . . . . . . . . . . . -66.73 -9.96 42.01 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.275 -0.891 . . . . 0.56999999999999995 109.855 -179.483 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 354' ' ' GLN . . . . . 0.426 ' CD ' HD11 ' D' ' 350' ' ' LEU . 4.5 mt-30 -81.21 -49.62 10.56 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.24 -0.913 . . . . 1.47 109.37 -179.997 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' C' C ' 355' ' ' ALA . . . . . . . . . . . . . . . -70.19 -19.51 63.17 Favored 'General case' 0 N--CA 1.489 1.5 0 O-C-N 121.226 -0.921 . . . . 0.93000000000000005 108.949 179.713 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 356' ' ' GLY . . . . . . . . . . . . . . . -80.6 -78.36 0.94 Allowed Glycine 0 N--CA 1.489 2.233 0 N-CA-C 108.934 -1.666 . . . . 1.3300000000000001 108.934 179.509 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 357' ' ' LYS . . . . . . . . . . . . . 1.7 ttmm -84.96 101.06 12.06 Favored 'General case' 0 N--CA 1.488 1.464 0 O-C-N 121.412 -1.052 . . . . 4.0099999999999998 109.145 179.699 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 358' ' ' GLU . . . . . 0.565 ' N ' ' HD2' ' C' ' 359' ' ' PRO . 0.9 OUTLIER -48.79 -55.2 21.2 Favored Pre-proline 0 N--CA 1.489 1.51 0 O-C-N 121.222 -0.924 . . . . 5.75 109.715 -179.799 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' C' C ' 359' ' ' PRO . . . . . 0.565 ' HD2' ' N ' ' C' ' 358' ' ' GLU . 1.8 Cg_endo -63.37 103.75 0.39 Allowed 'Trans proline' 0 C--N 1.311 -1.418 0 C-N-CA 121.868 1.712 . . . . 4.9400000000000004 110.182 -179.975 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' C' C ' 360' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.488 2.156 0 CA-C-O 117.983 -1.454 . . . . 6.5 109.506 179.943 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' D' D ' 319' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.489 1.501 0 N-CA-C 109.377 -0.601 . . . . 7.5300000000000002 109.377 . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' D' D ' 320' ' ' LYS . . . . . . . . . . . . . 31.5 tttt 58.63 90.3 0.05 OUTLIER 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.232 -0.917 . . . . 6.4100000000000001 109.182 -179.762 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' D' D ' 321' ' ' LYS . . . . . . . . . . . . . 27.4 mttt -81.11 155.19 72.52 Favored Pre-proline 0 N--CA 1.489 1.498 0 O-C-N 121.316 -0.865 . . . . 6.1100000000000003 109.623 -179.767 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' D' D ' 322' ' ' PRO . . . . . . . . . . . . . 4.0 Cg_exo -59.66 -154.29 0.01 OUTLIER 'Trans proline' 0 C--N 1.309 -1.511 0 C-N-CA 122.053 1.835 . . . . 2.8199999999999998 110.116 179.823 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' D' D ' 323' ' ' LEU . . . . . . . . . . . . . 88.1 mt -80.52 123.27 27.95 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.212 -0.93 . . . . 2.8300000000000001 109.519 -179.947 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' D' D ' 324' ' ' ASP . . . . . . . . . . . . . 6.3 m-20 -80.3 -156.93 0.13 Allowed 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.299 -0.876 . . . . 1.54 109.638 -179.787 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' D' D ' 325' ' ' GLY . . . . . . . . . . . . . . . -69.32 174.35 34.65 Favored Glycine 0 N--CA 1.489 2.217 0 N-CA-C 109.705 -1.358 . . . . 0.58999999999999997 109.705 -179.94 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' D' D ' 326' ' ' GLU . . . . . . . . . . . . . 6.6 mm-40 -58.93 -170.26 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.287 -1.126 . . . . 2.1299999999999999 109.45 179.921 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' D' D ' 327' ' ' TYR . . . . . 0.551 ' CE1' ' HG2' ' B' ' 333' ' ' ARG . 49.4 m-85 -149.25 108.81 3.99 Favored 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.295 -0.878 . . . . 0.46999999999999997 109.371 179.979 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' D' D ' 328' ' ' PHE . . . . . . . . . . . . . 97.9 m-85 -114.09 -167.15 1.17 Allowed 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.352 -0.842 . . . . 0.29999999999999999 109.687 -179.808 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' D' D ' 329' ' ' THR . . . . . . . . . . . . . 40.7 p -152.97 164.96 36.99 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.369 -0.832 . . . . 0.22 109.024 179.934 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' D' D ' 330' ' ' LEU . . . . . . . . . . . . . 21.3 tp -151.66 129.53 11.69 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.113 -0.992 . . . . 0.28000000000000003 110.016 -179.571 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' D' D ' 331' ' ' GLN . . . . . . . . . . . . . 1.7 tp60 -88.27 116.38 26.44 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.266 -0.896 . . . . 0.93000000000000005 108.97 179.506 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' D' D ' 332' ' ' ILE . . . . . 0.601 HD12 ' CD1' ' D' ' 338' ' ' PHE . 36.2 mt -103.81 109.02 25.91 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.57 0 O-C-N 121.023 -1.048 . . . . 0.25 110.071 -179.634 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' D' D ' 333' ' ' ARG . . . . . 0.477 ' HG2' ' CE1' ' B' ' 327' ' ' TYR . 0.1 OUTLIER -73.87 144.54 45.37 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.306 -0.871 . . . . 2.9300000000000002 109.142 179.442 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' D' D ' 334' ' ' GLY . . . . . . . . . . . . . . . 82.58 127.91 1.14 Allowed Glycine 0 N--CA 1.492 2.399 0 N-CA-C 109.417 -1.473 . . . . 0.40999999999999998 109.417 -179.841 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' D' D ' 335' ' ' ARG . . . . . . . . . . . . . 40.4 ttp180 -79.96 -30.29 39.8 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.239 -1.153 . . . . 3.0299999999999998 110.017 -179.722 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' D' D ' 336' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -55.48 -68.47 0.19 Allowed 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.126 -0.984 . . . . 2.2599999999999998 109.889 -179.568 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' D' D ' 337' ' ' ARG . . . . . . . . . . . . . 16.3 mmt180 -60.23 -27.9 67.57 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.24 -0.913 . . . . 2.9199999999999999 109.746 -179.787 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' D' D ' 338' ' ' PHE . . . . . 0.601 ' CD1' HD12 ' D' ' 332' ' ' ILE . 65.6 t80 -55.69 -56.41 20.81 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.174 -0.954 . . . . 0.37 109.638 -179.917 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' D' D ' 339' ' ' GLU . . . . . . . . . . . . . 21.7 mm-40 -51.45 -37.51 49.07 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.245 -0.909 . . . . 1.99 109.865 -179.764 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' D' D ' 340' ' ' MET . . . . . . . . . . . . . 33.6 ttp -64.21 -45.78 86.77 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.164 -0.96 . . . . 0.31 110.162 -179.468 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' D' D ' 341' ' ' PHE . . . . . . . . . . . . . 32.5 m-85 -62.61 -51.18 68.31 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.127 -0.983 . . . . 0.17999999999999999 110.377 -179.357 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' D' D ' 342' ' ' ARG . . . . . 0.534 ' NH1' ' HG2' ' D' ' 342' ' ' ARG . 4.7 ttt-85 -49.06 -46.12 44.0 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.13 -0.981 . . . . 2.4100000000000001 110.212 -179.314 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' D' D ' 343' ' ' GLU . . . . . . . . . . . . . 2.0 tt0 -58.4 -43.04 88.41 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.115 -0.991 . . . . 2.3500000000000001 109.921 -179.481 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' D' D ' 344' ' ' LEU . . . . . . . . . . . . . 39.1 mt -62.59 -38.37 89.87 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.163 -0.961 . . . . 0.19 109.898 -179.675 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' D' D ' 345' ' ' ASN . . . . . . . . . . . . . 46.4 t-20 -57.01 -48.4 78.56 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.231 -0.918 . . . . 1.0900000000000001 109.667 -179.838 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' D' D ' 346' ' ' GLU . . . . . . . . . . . . . 2.8 tt0 -61.53 -33.99 74.78 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.22 -0.925 . . . . 1.6899999999999999 109.753 -179.784 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' D' D ' 347' ' ' ALA . . . . . 0.728 ' HB1' ' HB1' ' C' ' 347' ' ' ALA . . . -60.27 -53.64 55.22 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.238 -0.914 . . . . 0.17999999999999999 110.331 -179.594 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' D' D ' 348' ' ' LEU . . . . . 0.59 HD22 ' N ' ' D' ' 348' ' ' LEU . 4.2 mm? -61.63 -48.63 79.99 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.187 -0.946 . . . . 0.31 110.112 -179.165 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' D' D ' 349' ' ' GLU . . . . . . . . . . . . . 64.5 mm-40 -57.8 -32.78 67.89 Favored 'General case' 0 N--CA 1.492 1.675 0 O-C-N 121.257 -0.902 . . . . 1.95 110.076 -179.296 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' D' D ' 350' ' ' LEU . . . . . 0.699 HD13 ' CD2' ' C' ' 350' ' ' LEU . 7.6 tt -64.48 -49.12 72.64 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.13 -0.981 . . . . 0.42999999999999999 109.855 -179.697 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' D' D ' 351' ' ' LYS . . . . . . . . . . . . . 66.5 tttt -58.97 -43.1 91.3 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.246 -0.909 . . . . 1.3999999999999999 109.785 -179.581 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' D' D ' 352' ' ' ASP . . . . . . . . . . . . . 66.7 m-20 -56.58 -51.05 70.1 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.286 -0.884 . . . . 1.1699999999999999 109.706 -179.848 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' D' D ' 353' ' ' ALA . . . . . . . . . . . . . . . -68.11 -14.01 62.65 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.287 -0.883 . . . . 0.58999999999999997 109.866 -179.824 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' D' D ' 354' ' ' GLN . . . . . . . . . . . . . 61.6 tt0 -83.94 -12.69 54.98 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.092 -1.005 . . . . 1.4399999999999999 109.69 -179.867 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' D' D ' 355' ' ' ALA . . . . . . . . . . . . . . . -72.18 -46.12 57.61 Favored 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.195 -0.941 . . . . 0.97999999999999998 109.799 -179.927 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' D' D ' 356' ' ' GLY . . . . . . . . . . . . . . . -80.47 11.11 40.33 Favored Glycine 0 N--CA 1.492 2.391 0 N-CA-C 110.3 -1.12 . . . . 1.28 110.3 -179.69 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' D' D ' 357' ' ' LYS . . . . . . . . . . . . . 2.7 tttt -85.76 14.92 5.23 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.053 -1.263 . . . . 4.0899999999999999 109.733 -179.862 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' D' D ' 358' ' ' GLU . . . . . . . . . . . . . 18.0 tt0 -49.47 135.42 17.77 Favored Pre-proline 0 N--CA 1.49 1.569 0 O-C-N 121.21 -0.931 . . . . 5.71 109.145 -179.954 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' D' D ' 359' ' ' PRO . . . . . . . . . . . . . 2.3 Cg_endo -62.15 -155.56 0.02 OUTLIER 'Trans proline' 0 C--N 1.312 -1.367 0 C-N-CA 121.972 1.781 . . . . 4.9699999999999998 110.312 -179.918 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' D' D ' 360' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.322 0 CA-C-O 117.998 -1.446 . . . . 6.9699999999999998 109.501 -179.968 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 319' ' ' LYS . . . . . . . . . . . . . 14.9 mttt . . . . . 0 N--CA 1.49 1.561 0 N-CA-C 109.393 -0.595 . . . . 7.5499999999999998 109.393 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 320' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 60.81 16.85 7.15 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.275 -0.891 . . . . 6.4299999999999997 109.452 179.965 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 321' ' ' LYS . . . . . 0.48 ' N ' ' HD3' ' A' ' 322' ' ' PRO . 0.0 OUTLIER -158.1 62.27 2.35 Favored Pre-proline 0 N--CA 1.489 1.496 0 O-C-N 121.335 -0.853 . . . . 6.1299999999999999 109.095 179.839 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 322' ' ' PRO . . . . . 0.48 ' HD3' ' N ' ' A' ' 321' ' ' LYS . 5.2 Cg_exo -58.68 106.43 0.28 Allowed 'Trans proline' 0 C--N 1.309 -1.549 0 C-N-CA 122.158 1.905 . . . . 2.8300000000000001 110.183 -179.893 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 323' ' ' LEU . . . . . . . . . . . . . 90.4 mt -81.55 80.84 7.82 Favored 'General case' 0 N--CA 1.489 1.481 0 O-C-N 121.253 -0.904 . . . . 2.8300000000000001 109.362 179.97 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 324' ' ' ASP . . . . . 0.52 ' CB ' ' OH ' ' A' ' 327' ' ' TYR . 63.3 m-20 -81.38 159.06 24.44 Favored 'General case' 0 N--CA 1.489 1.484 0 O-C-N 121.248 -0.908 . . . . 1.53 109.131 179.816 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 325' ' ' GLY . . . . . . . . . . . . . . . -67.64 -170.52 5.06 Favored Glycine 0 N--CA 1.489 2.22 0 N-CA-C 109.138 -1.585 . . . . 0.60999999999999999 109.138 179.889 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 326' ' ' GLU . . . . . . . . . . . . . 11.0 mm-40 -57.2 -169.8 0.0 OUTLIER 'General case' 0 N--CA 1.488 1.462 0 O-C-N 121.178 -1.19 . . . . 2.1299999999999999 109.362 -179.903 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 327' ' ' TYR . . . . . 0.52 ' OH ' ' CB ' ' A' ' 324' ' ' ASP . 39.5 m-85 -148.7 109.51 4.26 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.244 -0.91 . . . . 0.47999999999999998 109.732 -179.9 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 328' ' ' PHE . . . . . 0.486 ' CD1' ' N ' ' A' ' 328' ' ' PHE . 5.2 m-85 -113.7 -169.18 1.46 Allowed 'General case' 0 N--CA 1.488 1.473 0 O-C-N 121.401 -0.812 . . . . 0.31 108.969 179.75 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 329' ' ' THR . . . . . 0.426 HG23 ' O ' ' A' ' 328' ' ' PHE . 23.9 p -154.4 171.67 18.95 Favored 'General case' 0 N--CA 1.489 1.476 0 O-C-N 121.041 -1.037 . . . . 0.22 109.605 -179.763 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 330' ' ' LEU . . . . . . . . . . . . . 29.7 tp -150.49 129.88 12.93 Favored 'General case' 0 N--CA 1.488 1.456 0 O-C-N 121.307 -0.87 . . . . 0.28000000000000003 109.378 -179.913 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 331' ' ' GLN . . . . . . . . . . . . . 1.6 tp60 -87.27 113.89 23.4 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.19 -0.944 . . . . 0.91000000000000003 109.511 -179.982 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 332' ' ' ILE . . . . . 1.013 HG21 ' HA ' ' A' ' 338' ' ' PHE . 96.1 mt -103.44 99.97 9.48 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.552 0 O-C-N 121.162 -0.961 . . . . 0.26000000000000001 109.417 179.902 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 333' ' ' ARG . . . . . . . . . . . . . 25.7 mtt180 -71.85 145.29 48.69 Favored 'General case' 0 N--CA 1.489 1.49 0 O-C-N 121.2 -0.937 . . . . 2.9199999999999999 109.27 179.756 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 334' ' ' GLY . . . . . . . . . . . . . . . 82.71 121.3 0.68 Allowed Glycine 0 N--CA 1.489 2.181 0 N-CA-C 109.452 -1.459 . . . . 0.40000000000000002 109.452 -179.854 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 335' ' ' ARG . . . . . 0.544 ' HG3' ' NH1' ' A' ' 335' ' ' ARG . 1.3 ttm-85 -69.18 -29.36 67.33 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.327 -1.102 . . . . 3.0099999999999998 109.684 -179.844 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 336' ' ' GLU . . . . . . . . . . . . . 21.6 tt0 -59.31 -65.63 0.64 Allowed 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.267 -0.896 . . . . 2.29 109.906 -179.763 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 337' ' ' ARG . . . . . 0.61 ' CZ ' ' CB ' ' A' ' 337' ' ' ARG . 0.4 OUTLIER -59.0 -31.05 68.45 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.223 -0.923 . . . . 2.9300000000000002 109.289 -179.906 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 338' ' ' PHE . . . . . 1.013 ' HA ' HG21 ' A' ' 332' ' ' ILE . 54.3 t80 -54.47 -58.09 8.8 Favored 'General case' 0 N--CA 1.488 1.469 0 O-C-N 121.409 -0.807 . . . . 0.38 109.695 -179.856 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 339' ' ' GLU . . . . . . . . . . . . . 12.5 mt-10 -51.19 -34.18 30.58 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.204 -0.935 . . . . 1.97 110.146 -179.709 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 340' ' ' MET . . . . . . . . . . . . . 32.3 ttp -63.9 -51.58 63.87 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.14 -0.975 . . . . 0.31 110.27 -179.388 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 341' ' ' PHE . . . . . 0.435 ' CZ ' ' HA ' ' C' ' 345' ' ' ASN . 39.7 m-85 -62.12 -47.67 83.56 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.11 -0.994 . . . . 0.17999999999999999 110.029 -179.513 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 342' ' ' ARG . . . . . . . . . . . . . 31.4 ttt180 -48.05 -41.83 26.9 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.246 -0.909 . . . . 2.4199999999999999 109.95 -179.563 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 343' ' ' GLU . . . . . . . . . . . . . 3.2 tt0 -58.72 -48.27 81.74 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.08 -1.013 . . . . 2.3500000000000001 109.738 -179.643 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 344' ' ' LEU . . . . . . . . . . . . . 80.9 mt -62.29 -31.2 71.75 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.142 -0.974 . . . . 0.17999999999999999 109.618 -179.853 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 345' ' ' ASN . . . . . . . . . . . . . 17.5 t-20 -57.16 -60.56 3.43 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.296 -0.878 . . . . 1.0900000000000001 109.802 -179.67 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 346' ' ' GLU . . . . . 0.422 ' O ' ' HB2' ' A' ' 350' ' ' LEU . 24.9 tt0 -62.35 -25.25 67.8 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.316 -0.865 . . . . 1.6499999999999999 110.15 -179.684 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 347' ' ' ALA . . . . . 0.593 ' HB1' ' HB1' ' B' ' 347' ' ' ALA . . . -60.33 -59.91 4.65 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.195 -0.941 . . . . 0.17999999999999999 110.17 -179.568 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 348' ' ' LEU . . . . . 0.594 HD22 ' N ' ' A' ' 348' ' ' LEU . 3.8 mm? -61.34 -49.03 78.6 Favored 'General case' 0 N--CA 1.493 1.711 0 O-C-N 121.274 -0.891 . . . . 0.29999999999999999 109.901 -179.523 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 349' ' ' GLU . . . . . . . . . . . . . 4.5 mm-40 -57.43 -27.62 62.57 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.223 -0.923 . . . . 1.9399999999999999 109.798 -179.565 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 350' ' ' LEU . . . . . 0.836 HD23 ' O ' ' A' ' 350' ' ' LEU . 2.9 tt -64.49 -43.59 93.66 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.244 -0.91 . . . . 0.46000000000000002 109.293 -179.984 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 351' ' ' LYS . . . . . . . . . . . . . 33.3 tttt -59.4 -52.94 63.44 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.41 -0.806 . . . . 1.3999999999999999 109.868 -179.788 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 352' ' ' ASP . . . . . . . . . . . . . 66.9 m-20 -57.17 -38.54 73.74 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.246 -0.909 . . . . 1.1599999999999999 109.966 -179.594 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 353' ' ' ALA . . . . . . . . . . . . . . . -67.08 -24.67 65.98 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.104 -0.997 . . . . 0.63 109.886 -179.539 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 354' ' ' GLN . . . . . . . . . . . . . 14.5 tt0 -84.15 -15.44 47.11 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.091 -1.005 . . . . 1.47 109.586 -179.854 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 355' ' ' ALA . . . . . . . . . . . . . . . -73.3 -4.58 34.1 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.182 -0.949 . . . . 1.01 109.716 179.864 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 356' ' ' GLY . . . . . . . . . . . . . . . -77.61 3.48 59.63 Favored Glycine 0 N--CA 1.492 2.407 0 N-CA-C 109.896 -1.282 . . . . 1.3 109.896 -179.777 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 357' ' ' LYS . . . . . . . . . . . . . 14.0 tttt -85.33 143.19 28.82 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.202 -1.175 . . . . 4.0999999999999996 109.43 -179.968 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 358' ' ' GLU . . . . . . . . . . . . . 38.4 mt-10 -49.71 149.24 4.57 Favored Pre-proline 0 N--CA 1.49 1.556 0 O-C-N 121.265 -0.897 . . . . 5.75 109.525 -179.81 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 359' ' ' PRO . . . . . . . . . . . . . 2.6 Cg_endo -62.08 -160.35 0.03 OUTLIER 'Trans proline' 0 C--N 1.309 -1.514 0 C-N-CA 122.272 1.982 . . . . 5.0 110.36 179.952 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 360' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.302 0 CA-C-O 118.014 -1.437 . . . . 6.9699999999999998 109.543 -179.943 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' B' B ' 319' ' ' LYS . . . . . . . . . . . . . 14.5 mttt . . . . . 0 N--CA 1.49 1.546 0 CA-C-O 121.3 0.571 . . . . 7.5499999999999998 109.462 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' B' B ' 320' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 60.6 16.97 7.0 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.321 -0.862 . . . . 6.4400000000000004 109.516 -179.886 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 321' ' ' LYS . . . . . 0.474 ' N ' ' HD3' ' B' ' 322' ' ' PRO . 0.0 OUTLIER -158.16 62.31 2.34 Favored Pre-proline 0 N--CA 1.489 1.5 0 O-C-N 121.287 -0.883 . . . . 6.1299999999999999 109.126 179.828 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' B' B ' 322' ' ' PRO . . . . . 0.474 ' HD3' ' N ' ' B' ' 321' ' ' LYS . 5.3 Cg_exo -58.58 106.28 0.27 Allowed 'Trans proline' 0 C--N 1.308 -1.566 0 C-N-CA 122.21 1.94 . . . . 2.8199999999999998 110.209 -179.896 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 323' ' ' LEU . . . . . . . . . . . . . 89.7 mt -81.55 81.08 7.76 Favored 'General case' 0 N--CA 1.489 1.495 0 O-C-N 121.234 -0.916 . . . . 2.8399999999999999 109.336 179.938 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 324' ' ' ASP . . . . . 0.52 ' CB ' ' OH ' ' B' ' 327' ' ' TYR . 60.4 m-20 -81.82 157.58 24.39 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.351 -0.843 . . . . 1.53 109.291 179.769 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 325' ' ' GLY . . . . . . . . . . . . . . . -65.93 -170.34 3.28 Favored Glycine 0 N--CA 1.49 2.234 0 N-CA-C 109.298 -1.521 . . . . 0.58999999999999997 109.298 179.91 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 326' ' ' GLU . . . . . . . . . . . . . 10.4 mm-40 -57.65 -169.82 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.162 -1.199 . . . . 2.1299999999999999 109.349 -179.977 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 327' ' ' TYR . . . . . 0.52 ' OH ' ' CB ' ' B' ' 324' ' ' ASP . 39.8 m-85 -148.62 109.82 4.36 Favored 'General case' 0 N--CA 1.488 1.474 0 O-C-N 121.302 -0.874 . . . . 0.47999999999999998 109.767 179.987 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 328' ' ' PHE . . . . . 0.485 ' CD1' ' N ' ' B' ' 328' ' ' PHE . 5.5 m-85 -113.73 -168.89 1.41 Allowed 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.293 -0.879 . . . . 0.32000000000000001 109.057 179.725 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 329' ' ' THR . . . . . 0.484 ' HA ' ' O ' ' D' ' 330' ' ' LEU . 23.5 p -154.46 171.49 19.28 Favored 'General case' 0 N--CA 1.488 1.466 0 O-C-N 121.08 -1.013 . . . . 0.23000000000000001 109.682 -179.947 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 330' ' ' LEU . . . . . 0.446 ' O ' ' HA ' ' D' ' 329' ' ' THR . 30.1 tp -150.41 129.67 12.82 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.34 -0.85 . . . . 0.28000000000000003 109.388 -179.95 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 331' ' ' GLN . . . . . . . . . . . . . 1.7 tp60 -87.06 113.86 23.18 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.192 -0.942 . . . . 0.91000000000000003 109.575 179.917 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 332' ' ' ILE . . . . . 1.018 HG21 ' HA ' ' B' ' 338' ' ' PHE . 96.2 mt -103.31 99.94 9.41 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.581 0 O-C-N 121.142 -0.974 . . . . 0.23999999999999999 109.385 179.889 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 333' ' ' ARG . . . . . . . . . . . . . 25.9 mtt180 -71.94 145.59 48.34 Favored 'General case' 0 N--CA 1.489 1.482 0 O-C-N 121.263 -0.898 . . . . 2.9300000000000002 109.203 179.79 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 334' ' ' GLY . . . . . . . . . . . . . . . 82.58 121.15 0.66 Allowed Glycine 0 N--CA 1.49 2.238 0 N-CA-C 109.424 -1.47 . . . . 0.40000000000000002 109.424 -179.903 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 335' ' ' ARG . . . . . 0.559 ' NH1' ' HG3' ' B' ' 335' ' ' ARG . 1.3 ttm-85 -69.02 -29.57 67.76 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.341 -1.094 . . . . 3.0099999999999998 109.678 -179.879 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 336' ' ' GLU . . . . . . . . . . . . . 21.3 tt0 -59.2 -65.68 0.63 Allowed 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.275 -0.891 . . . . 2.2799999999999998 109.871 -179.786 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 337' ' ' ARG . . . . . 0.609 ' CB ' ' CZ ' ' B' ' 337' ' ' ARG . 0.4 OUTLIER -59.11 -30.84 68.41 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.155 -0.966 . . . . 2.9300000000000002 109.326 -179.884 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' B' B ' 338' ' ' PHE . . . . . 1.018 ' HA ' HG21 ' B' ' 332' ' ' ILE . 53.5 t80 -54.65 -58.06 9.0 Favored 'General case' 0 N--CA 1.488 1.444 0 O-C-N 121.303 -0.873 . . . . 0.37 109.583 -179.797 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 339' ' ' GLU . . . . . . . . . . . . . 12.6 mt-10 -51.27 -34.08 31.22 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.154 -0.966 . . . . 1.98 110.124 -179.691 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 340' ' ' MET . . . . . . . . . . . . . 32.4 ttp -63.88 -51.75 63.11 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.108 -0.995 . . . . 0.32000000000000001 110.234 -179.397 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 341' ' ' PHE . . . . . . . . . . . . . 39.5 m-85 -61.96 -47.55 84.34 Favored 'General case' 0 N--CA 1.493 1.675 0 O-C-N 121.108 -0.995 . . . . 0.17999999999999999 110.089 -179.45 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 342' ' ' ARG . . . . . . . . . . . . . 31.5 ttt180 -48.16 -41.77 27.77 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.28 -0.888 . . . . 2.4199999999999999 110.006 -179.543 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 343' ' ' GLU . . . . . . . . . . . . . 3.2 tt0 -58.73 -48.15 82.17 Favored 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.14 -0.975 . . . . 2.3500000000000001 109.781 -179.649 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 344' ' ' LEU . . . . . . . . . . . . . 80.5 mt -62.46 -31.21 71.9 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.151 -0.968 . . . . 0.17999999999999999 109.624 -179.859 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 345' ' ' ASN . . . . . . . . . . . . . 17.7 t-20 -56.98 -60.73 3.14 Favored 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.163 -0.96 . . . . 1.0900000000000001 109.786 -179.812 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 346' ' ' GLU . . . . . 0.428 ' O ' ' HB2' ' B' ' 350' ' ' LEU . 24.8 tt0 -62.24 -25.27 67.73 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.304 -0.873 . . . . 1.6599999999999999 110.152 -179.646 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 347' ' ' ALA . . . . . 0.593 ' HB1' ' HB1' ' A' ' 347' ' ' ALA . . . -60.29 -59.97 4.57 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.087 -1.008 . . . . 0.17000000000000001 110.17 -179.534 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 348' ' ' LEU . . . . . 0.592 HD22 ' N ' ' B' ' 348' ' ' LEU . 3.7 mm? -61.34 -49.02 78.66 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.262 -0.899 . . . . 0.28999999999999998 109.994 -179.498 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 349' ' ' GLU . . . . . . . . . . . . . 4.5 mm-40 -57.27 -27.94 62.54 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.165 -0.96 . . . . 1.95 109.784 -179.594 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 350' ' ' LEU . . . . . 0.833 HD23 ' O ' ' B' ' 350' ' ' LEU . 2.8 tt -64.28 -43.5 94.61 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.259 -0.901 . . . . 0.45000000000000001 109.311 -179.989 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 351' ' ' LYS . . . . . . . . . . . . . 33.4 tttt -59.52 -53.13 61.66 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.305 -0.872 . . . . 1.3799999999999999 109.833 -179.692 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 352' ' ' ASP . . . . . . . . . . . . . 65.9 m-20 -56.97 -38.63 73.27 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.262 -0.899 . . . . 1.1599999999999999 109.979 -179.733 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 353' ' ' ALA . . . . . . . . . . . . . . . -66.94 -24.86 66.12 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.209 -0.932 . . . . 0.60999999999999999 109.876 -179.54 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 354' ' ' GLN . . . . . . . . . . . . . 13.9 tt0 -83.99 -15.6 47.13 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.168 -0.958 . . . . 1.45 109.549 -179.889 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 355' ' ' ALA . . . . . . . . . . . . . . . -73.17 -4.62 33.98 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.207 -0.933 . . . . 0.97999999999999998 109.718 179.928 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 356' ' ' GLY . . . . . . . . . . . . . . . -77.68 3.6 59.52 Favored Glycine 0 N--CA 1.492 2.378 0 N-CA-C 109.862 -1.295 . . . . 1.29 109.862 -179.695 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 357' ' ' LYS . . . . . . . . . . . . . 14.1 tttt -85.44 143.25 28.69 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.172 -1.193 . . . . 4.0899999999999999 109.484 179.975 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 358' ' ' GLU . . . . . . . . . . . . . 38.6 mt-10 -49.67 149.16 4.56 Favored Pre-proline 0 N--CA 1.49 1.557 0 O-C-N 121.232 -0.917 . . . . 5.7199999999999998 109.595 -179.899 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 359' ' ' PRO . . . . . . . . . . . . . 2.7 Cg_endo -62.16 -160.34 0.03 OUTLIER 'Trans proline' 0 C--N 1.31 -1.476 0 C-N-CA 122.202 1.934 . . . . 4.9800000000000004 110.321 179.947 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 360' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.289 0 CA-C-O 117.958 -1.468 . . . . 6.9800000000000004 109.468 -179.965 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' C' C ' 319' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 N--CA 1.49 1.566 0 CA-C-O 121.268 0.556 . . . . 6.8200000000000003 109.513 . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 320' ' ' LYS . . . . . . . . . . . . . 9.5 mttp 56.24 95.81 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.32 -0.863 . . . . 6.4900000000000002 109.494 -179.965 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 321' ' ' LYS . . . . . 0.549 ' CB ' ' HD3' ' C' ' 322' ' ' PRO . 0.1 OUTLIER -80.07 -53.53 0.94 Allowed Pre-proline 0 N--CA 1.49 1.553 0 O-C-N 121.266 -0.896 . . . . 6.4000000000000004 110.143 -179.701 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' C' C ' 322' ' ' PRO . . . . . 0.549 ' HD3' ' CB ' ' C' ' 321' ' ' LYS . 1.8 Cg_endo -64.94 126.9 17.4 Favored 'Trans proline' 0 C--N 1.311 -1.41 0 C-N-CA 121.982 1.788 . . . . 3.4199999999999999 110.45 -179.451 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' C' C ' 323' ' ' LEU . . . . . 0.434 ' HA ' HD23 ' C' ' 323' ' ' LEU . 83.9 mt -79.62 139.21 37.52 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.22 -0.925 . . . . 3.9500000000000002 108.673 179.46 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' C' C ' 324' ' ' ASP . . . . . 0.468 ' HB3' ' OH ' ' C' ' 327' ' ' TYR . 9.0 m-20 -77.59 144.92 37.14 Favored 'General case' 0 N--CA 1.489 1.48 0 O-C-N 121.115 -0.99 . . . . 1.6299999999999999 109.49 -179.48 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' C' C ' 325' ' ' GLY . . . . . . . . . . . . . . . -67.22 -167.9 3.39 Favored Glycine 0 N--CA 1.487 2.05 0 N-CA-C 109.168 -1.573 . . . . 0.72999999999999998 109.168 179.982 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 326' ' ' GLU . . . . . . . . . . . . . 66.3 mm-40 -57.55 -172.9 0.01 OUTLIER 'General case' 0 C--N 1.302 -1.496 0 O-C-N 121.214 -1.168 . . . . 2.1699999999999999 109.48 -179.943 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 327' ' ' TYR . . . . . 0.468 ' OH ' ' HB3' ' C' ' 324' ' ' ASP . 36.2 m-85 -147.47 105.93 3.79 Favored 'General case' 0 C--N 1.302 -1.484 0 O-C-N 121.441 -0.787 . . . . 0.47999999999999998 109.226 179.661 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' C' C ' 328' ' ' PHE . . . . . 0.408 ' C ' HG23 ' C' ' 329' ' ' THR . 43.3 m-85 -113.35 -171.81 1.95 Allowed 'General case' 0 C--N 1.302 -1.461 0 O-C-N 121.297 -0.877 . . . . 0.33000000000000002 108.91 179.902 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' C' C ' 329' ' ' THR . . . . . 0.408 HG23 ' C ' ' C' ' 328' ' ' PHE . 19.0 p -152.5 -175.66 5.38 Favored 'General case' 0 C--N 1.302 -1.461 0 O-C-N 121.091 -1.006 . . . . 0.23000000000000001 109.645 -179.973 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' C' C ' 330' ' ' LEU . . . . . . . . . . . . . 28.1 tp -153.37 128.99 10.03 Favored 'General case' 0 N--CA 1.489 1.492 0 O-C-N 121.331 -0.855 . . . . 0.28000000000000003 109.557 -179.65 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 331' ' ' GLN . . . . . . . . . . . . . 8.2 tp-100 -89.08 106.49 18.47 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.253 -0.904 . . . . 1.48 109.418 179.759 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 332' ' ' ILE . . . . . . . . . . . . . 68.3 mt -103.55 108.53 24.69 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.557 0 O-C-N 121.193 -0.942 . . . . 0.23999999999999999 109.813 -179.96 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 333' ' ' ARG . . . . . 0.464 ' HG2' ' CE2' ' A' ' 327' ' ' TYR . 2.1 mpt_? -74.13 156.54 37.27 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.267 -0.895 . . . . 2.7400000000000002 109.685 179.935 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' C' C ' 334' ' ' GLY . . . . . . . . . . . . . . . 76.93 132.73 0.52 Allowed Glycine 0 N--CA 1.492 2.4 0 N-CA-C 109.9 -1.28 . . . . 0.34999999999999998 109.9 179.709 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 335' ' ' ARG . . . . . . . . . . . . . 26.4 ttp180 -77.9 -32.83 52.0 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.3 -1.118 . . . . 2.5299999999999998 109.595 179.947 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 336' ' ' GLU . . . . . . . . . . . . . 1.6 mt-10 -57.05 -59.72 4.65 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.291 -0.88 . . . . 2.6200000000000001 109.67 -179.707 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 337' ' ' ARG . . . . . 0.549 ' HG2' ' NH1' ' C' ' 337' ' ' ARG . 0.1 OUTLIER -61.23 -35.22 76.63 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.217 -0.927 . . . . 2.8100000000000001 109.667 -179.742 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' C' C ' 338' ' ' PHE . . . . . . . . . . . . . 51.5 t80 -54.32 -54.86 34.6 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.185 -0.947 . . . . 0.40000000000000002 109.598 -179.714 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 339' ' ' GLU . . . . . . . . . . . . . 6.9 mt-10 -53.12 -33.39 52.07 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.165 -0.959 . . . . 2.0499999999999998 109.942 -179.922 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 340' ' ' MET . . . . . . . . . . . . . 25.7 ttp -65.01 -55.35 19.52 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.239 -0.913 . . . . 0.32000000000000001 110.366 -179.402 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 341' ' ' PHE . . . . . . . . . . . . . 49.7 m-85 -61.39 -35.23 76.93 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.111 -0.993 . . . . 0.17999999999999999 110.082 -179.231 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 342' ' ' ARG . . . . . . . . . . . . . 10.7 ttt180 -53.33 -49.44 67.06 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.227 -0.92 . . . . 2.9100000000000001 110.13 -179.807 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 343' ' ' GLU . . . . . . . . . . . . . 2.3 tt0 -59.28 -47.11 86.59 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.214 -0.929 . . . . 2.1400000000000001 110.289 -179.33 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 344' ' ' LEU . . . . . . . . . . . . . 85.2 mt -60.33 -30.97 69.86 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.065 -1.022 . . . . 0.22 109.641 -179.457 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 345' ' ' ASN . . . . . 0.435 ' HA ' ' CZ ' ' A' ' 341' ' ' PHE . 1.9 t30 -59.15 -58.84 6.85 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.266 -0.896 . . . . 1.0800000000000001 109.928 -179.873 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' C' C ' 346' ' ' GLU . . . . . . . . . . . . . 8.8 tp10 -61.85 -25.5 67.57 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.356 -0.84 . . . . 2.21 110.321 -179.351 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 347' ' ' ALA . . . . . 0.5 ' HB1' ' HB1' ' D' ' 347' ' ' ALA . . . -58.52 -62.46 1.84 Allowed 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.045 -1.035 . . . . 0.17999999999999999 110.26 -179.355 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' C' C ' 348' ' ' LEU . . . . . 0.632 ' N ' HD22 ' C' ' 348' ' ' LEU . 3.4 mm? -61.34 -42.44 98.69 Favored 'General case' 0 N--CA 1.494 1.761 0 O-C-N 121.181 -0.949 . . . . 0.32000000000000001 110.014 -179.274 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' C' C ' 349' ' ' GLU . . . . . . . . . . . . . 34.7 mt-10 -57.25 -31.29 65.41 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.109 -0.994 . . . . 2.1899999999999999 109.709 -179.697 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 350' ' ' LEU . . . . . 0.831 ' O ' HD23 ' C' ' 350' ' ' LEU . 5.8 tt -62.87 -43.59 98.38 Favored 'General case' 0 N--CA 1.488 1.453 0 O-C-N 121.106 -0.996 . . . . 0.46000000000000002 109.604 179.993 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' C' C ' 351' ' ' LYS . . . . . . . . . . . . . 6.0 tttp -58.79 -44.77 90.79 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.288 -0.883 . . . . 1.3500000000000001 109.831 -179.808 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 352' ' ' ASP . . . . . . . . . . . . . 81.6 m-20 -54.99 -44.64 74.64 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.083 -1.011 . . . . 1.1899999999999999 109.945 -179.753 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 353' ' ' ALA . . . . . . . . . . . . . . . -67.03 -30.5 70.61 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.1 -1.0 . . . . 0.56999999999999995 109.84 -179.607 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 354' ' ' GLN . . . . . . . . . . . . . 33.8 tt0 -81.77 8.32 10.39 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.152 -0.968 . . . . 1.47 109.851 -179.879 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 355' ' ' ALA . . . . . . . . . . . . . . . -70.3 -67.95 0.46 Allowed 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.203 -0.935 . . . . 0.93000000000000005 110.368 -179.572 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 356' ' ' GLY . . . . . . . . . . . . . . . -81.3 48.77 3.88 Favored Glycine 0 N--CA 1.494 2.527 0 C-N-CA 120.386 -0.911 . . . . 1.3300000000000001 111.272 -178.825 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 357' ' ' LYS . . . . . 0.478 ' HB3' ' HD2' ' C' ' 359' ' ' PRO . 0.0 OUTLIER -87.95 -152.86 0.22 Allowed 'General case' 0 N--CA 1.493 1.701 0 O-C-N 120.778 -1.424 . . . . 4.0099999999999998 109.055 179.326 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' C' C ' 358' ' ' GLU . . . . . 0.595 ' CB ' ' HD3' ' C' ' 359' ' ' PRO . 0.2 OUTLIER -50.99 -59.21 8.02 Favored Pre-proline 0 N--CA 1.492 1.644 0 O-C-N 121.028 -1.045 . . . . 5.75 109.308 -179.97 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' C' C ' 359' ' ' PRO . . . . . 0.595 ' HD3' ' CB ' ' C' ' 358' ' ' GLU . 1.9 Cg_endo -61.25 111.66 1.18 Allowed 'Trans proline' 0 C--N 1.312 -1.353 0 C-N-CA 121.923 1.749 . . . . 4.9400000000000004 109.923 179.722 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' C' C ' 360' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.18 0 CA-C-O 117.965 -1.464 . . . . 6.5 109.58 -179.98 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' D' D ' 319' ' ' LYS . . . . . . . . . . . . . 14.6 mttt . . . . . 0 N--CA 1.491 1.589 0 N-CA-C 109.344 -0.613 . . . . 7.5300000000000002 109.344 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' D' D ' 320' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 60.74 17.04 7.22 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.268 -0.895 . . . . 6.4100000000000001 109.488 -179.953 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' D' D ' 321' ' ' LYS . . . . . 0.463 ' N ' ' HD3' ' D' ' 322' ' ' PRO . 0.0 OUTLIER -158.17 62.22 2.32 Favored Pre-proline 0 N--CA 1.49 1.557 0 O-C-N 121.287 -0.883 . . . . 6.1100000000000003 109.094 179.861 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' D' D ' 322' ' ' PRO . . . . . 0.463 ' HD3' ' N ' ' D' ' 321' ' ' LYS . 5.2 Cg_exo -58.73 106.64 0.29 Allowed 'Trans proline' 0 C--N 1.309 -1.553 0 C-N-CA 122.102 1.868 . . . . 2.8199999999999998 110.166 -179.769 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' D' D ' 323' ' ' LEU . . . . . . . . . . . . . 90.1 mt -81.73 80.89 7.95 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.341 -0.849 . . . . 2.8300000000000001 109.272 179.979 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' D' D ' 324' ' ' ASP . . . . . 0.516 ' CB ' ' OH ' ' D' ' 327' ' ' TYR . 60.0 m-20 -81.51 158.34 24.52 Favored 'General case' 0 N--CA 1.489 1.489 0 O-C-N 121.282 -0.887 . . . . 1.54 109.241 179.688 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' D' D ' 325' ' ' GLY . . . . . . . . . . . . . . . -66.89 -170.2 4.08 Favored Glycine 0 N--CA 1.49 2.263 0 N-CA-C 109.073 -1.611 . . . . 0.58999999999999997 109.073 179.897 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' D' D ' 326' ' ' GLU . . . . . . . . . . . . . 11.1 mm-40 -57.61 -169.96 0.01 OUTLIER 'General case' 0 N--CA 1.488 1.445 0 O-C-N 121.243 -1.151 . . . . 2.1299999999999999 109.37 -179.969 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' D' D ' 327' ' ' TYR . . . . . 0.516 ' OH ' ' CB ' ' D' ' 324' ' ' ASP . 40.1 m-85 -148.55 110.02 4.43 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.225 -0.922 . . . . 0.46999999999999997 109.721 -179.985 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' D' D ' 328' ' ' PHE . . . . . 0.478 ' N ' ' CD1' ' D' ' 328' ' ' PHE . 5.4 m-85 -113.96 -168.9 1.42 Allowed 'General case' 0 N--CA 1.489 1.483 0 O-C-N 121.345 -0.847 . . . . 0.29999999999999999 109.064 179.679 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' D' D ' 329' ' ' THR . . . . . 0.446 ' HA ' ' O ' ' B' ' 330' ' ' LEU . 23.8 p -154.45 171.75 18.86 Favored 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.216 -0.928 . . . . 0.22 109.613 -179.88 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' D' D ' 330' ' ' LEU . . . . . 0.484 ' O ' ' HA ' ' B' ' 329' ' ' THR . 29.8 tp -150.65 129.53 12.48 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.299 -0.876 . . . . 0.28000000000000003 109.369 -179.943 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' D' D ' 331' ' ' GLN . . . . . . . . . . . . . 1.6 tp60 -87.0 113.92 23.17 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.259 -0.901 . . . . 0.93000000000000005 109.578 179.958 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' D' D ' 332' ' ' ILE . . . . . 1.0 HG21 ' HA ' ' D' ' 338' ' ' PHE . 96.2 mt -103.29 100.03 9.6 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.522 0 O-C-N 121.223 -0.923 . . . . 0.25 109.421 179.882 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' D' D ' 333' ' ' ARG . . . . . 0.44 ' HG2' ' CE2' ' B' ' 327' ' ' TYR . 26.2 mtt180 -71.88 145.61 48.43 Favored 'General case' 0 N--CA 1.488 1.427 0 O-C-N 121.253 -0.905 . . . . 2.9300000000000002 109.225 179.761 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' D' D ' 334' ' ' GLY . . . . . . . . . . . . . . . 82.75 121.21 0.68 Allowed Glycine 0 N--CA 1.49 2.253 0 N-CA-C 109.518 -1.433 . . . . 0.40999999999999998 109.518 -179.93 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' D' D ' 335' ' ' ARG . . . . . 0.546 ' HG3' ' NH1' ' D' ' 335' ' ' ARG . 1.3 ttm-85 -69.02 -29.98 68.27 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.324 -1.103 . . . . 3.0299999999999998 109.613 -179.94 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' D' D ' 336' ' ' GLU . . . . . . . . . . . . . 21.3 tt0 -58.93 -65.57 0.64 Allowed 'General case' 0 N--CA 1.491 1.625 0 O-C-N 121.239 -0.913 . . . . 2.2599999999999998 109.95 -179.728 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' D' D ' 337' ' ' ARG . . . . . 0.588 ' CB ' ' CZ ' ' D' ' 337' ' ' ARG . 0.4 OUTLIER -59.22 -30.77 68.48 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.172 -0.955 . . . . 2.9199999999999999 109.355 -179.877 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' D' D ' 338' ' ' PHE . . . . . 1.0 ' HA ' HG21 ' D' ' 332' ' ' ILE . 54.0 t80 -54.61 -58.01 9.19 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.389 -0.819 . . . . 0.37 109.635 -179.951 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' D' D ' 339' ' ' GLU . . . . . . . . . . . . . 12.6 mt-10 -51.37 -34.2 33.17 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.207 -0.933 . . . . 1.99 110.093 -179.636 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' D' D ' 340' ' ' MET . . . . . . . . . . . . . 32.3 ttp -63.79 -51.53 64.38 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.077 -1.015 . . . . 0.31 110.327 -179.5 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' D' D ' 341' ' ' PHE . . . . . . . . . . . . . 39.2 m-85 -62.17 -47.67 83.48 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.128 -0.982 . . . . 0.17999999999999999 110.043 -179.438 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' D' D ' 342' ' ' ARG . . . . . . . . . . . . . 31.1 ttt180 -47.89 -41.98 25.73 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.286 -0.883 . . . . 2.4100000000000001 110.042 -179.606 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' D' D ' 343' ' ' GLU . . . . . . . . . . . . . 3.2 tt0 -58.72 -48.07 82.42 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.156 -0.965 . . . . 2.3500000000000001 109.729 -179.556 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' D' D ' 344' ' ' LEU . . . . . . . . . . . . . 80.2 mt -62.49 -31.29 72.01 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.244 -0.91 . . . . 0.19 109.624 -179.772 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' D' D ' 345' ' ' ASN . . . . . . . . . . . . . 17.4 t-20 -56.91 -60.42 3.6 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.279 -0.888 . . . . 1.0900000000000001 109.798 -179.775 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' D' D ' 346' ' ' GLU . . . . . 0.43 ' O ' ' HB2' ' D' ' 350' ' ' LEU . 24.8 tt0 -62.69 -25.4 68.13 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.179 -0.95 . . . . 1.6899999999999999 110.077 -179.55 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' D' D ' 347' ' ' ALA . . . . . 0.5 ' HB1' ' HB1' ' C' ' 347' ' ' ALA . . . -60.18 -59.87 4.72 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.173 -0.954 . . . . 0.17999999999999999 110.06 -179.518 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' D' D ' 348' ' ' LEU . . . . . 0.603 HD22 ' N ' ' D' ' 348' ' ' LEU . 3.8 mm? -61.44 -49.11 78.16 Favored 'General case' 0 N--CA 1.493 1.722 0 O-C-N 121.248 -0.907 . . . . 0.31 110.02 -179.48 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' D' D ' 349' ' ' GLU . . . . . . . . . . . . . 4.5 mm-40 -57.21 -27.77 62.27 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.186 -0.946 . . . . 1.95 109.77 -179.602 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' D' D ' 350' ' ' LEU . . . . . 0.818 HD23 ' O ' ' D' ' 350' ' ' LEU . 2.7 tt -64.59 -43.52 93.57 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.142 -0.974 . . . . 0.42999999999999999 109.268 -179.979 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' D' D ' 351' ' ' LYS . . . . . . . . . . . . . 32.9 tttt -59.28 -53.14 61.59 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.3 -0.875 . . . . 1.3999999999999999 109.913 -179.84 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' D' D ' 352' ' ' ASP . . . . . . . . . . . . . 66.6 m-20 -56.96 -38.65 73.27 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.146 -0.971 . . . . 1.1699999999999999 110.006 -179.745 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' D' D ' 353' ' ' ALA . . . . . . . . . . . . . . . -66.89 -24.73 66.14 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.144 -0.972 . . . . 0.58999999999999997 109.917 -179.555 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' D' D ' 354' ' ' GLN . . . . . . . . . . . . . 14.4 tt0 -84.01 -15.69 46.72 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.205 -0.934 . . . . 1.4399999999999999 109.621 -179.885 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' D' D ' 355' ' ' ALA . . . . . . . . . . . . . . . -73.13 -4.59 33.66 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.17 -0.956 . . . . 0.97999999999999998 109.711 179.918 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' D' D ' 356' ' ' GLY . . . . . . . . . . . . . . . -77.52 3.35 59.72 Favored Glycine 0 N--CA 1.491 2.357 0 N-CA-C 109.879 -1.288 . . . . 1.28 109.879 -179.779 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' D' D ' 357' ' ' LYS . . . . . . . . . . . . . 14.0 tttt -85.24 143.23 28.87 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.208 -1.172 . . . . 4.0899999999999999 109.5 -179.998 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' D' D ' 358' ' ' GLU . . . . . 0.401 ' HA ' ' HD3' ' D' ' 359' ' ' PRO . 38.5 mt-10 -49.87 148.98 5.02 Favored Pre-proline 0 N--CA 1.49 1.557 0 O-C-N 121.222 -0.924 . . . . 5.71 109.547 -179.898 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' D' D ' 359' ' ' PRO . . . . . 0.401 ' HD3' ' HA ' ' D' ' 358' ' ' GLU . 2.5 Cg_endo -62.18 -160.35 0.03 OUTLIER 'Trans proline' 0 C--N 1.31 -1.48 0 C-N-CA 122.201 1.934 . . . . 4.9699999999999998 110.278 -179.881 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' D' D ' 360' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.274 0 N-CA-C 109.516 -1.434 . . . . 6.9699999999999998 109.516 179.983 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 319' ' ' LYS . . . . . . . . . . . . . 30.9 mttt . . . . . 0 N--CA 1.49 1.547 0 N-CA-C 109.329 -0.619 . . . . 7.5499999999999998 109.329 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 320' ' ' LYS . . . . . . . . . . . . . 11.0 mttt 60.85 164.08 0.07 Allowed 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.194 -0.941 . . . . 6.4299999999999997 109.392 -179.847 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 321' ' ' LYS . . . . . 0.483 ' HG2' ' HD2' ' A' ' 322' ' ' PRO . 0.0 OUTLIER -157.34 138.95 9.91 Favored Pre-proline 0 C--N 1.303 -1.445 0 O-C-N 121.362 -0.836 . . . . 6.1299999999999999 109.075 179.571 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 322' ' ' PRO . . . . . 0.483 ' HD2' ' HG2' ' A' ' 321' ' ' LYS . 1.9 Cg_endo -63.19 -80.85 0.01 OUTLIER 'Trans proline' 0 C--N 1.311 -1.444 0 C-N-CA 122.159 1.906 . . . . 2.8300000000000001 110.119 179.85 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 323' ' ' LEU . . . . . . . . . . . . . 38.8 mt -79.63 96.28 6.14 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.198 -0.939 . . . . 2.8300000000000001 109.888 -179.722 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 324' ' ' ASP . . . . . . . . . . . . . 3.3 m-20 -80.17 156.07 27.13 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.378 -0.827 . . . . 1.53 109.563 179.741 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 325' ' ' GLY . . . . . 0.565 ' O ' ' CD2' ' A' ' 327' ' ' TYR . . . -68.99 176.41 29.89 Favored Glycine 0 N--CA 1.491 2.334 0 N-CA-C 109.6 -1.4 . . . . 0.60999999999999999 109.6 179.866 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 326' ' ' GLU . . . . . . . . . . . . . 35.5 mm-40 -58.51 168.93 1.0 Allowed 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.156 -1.202 . . . . 2.1299999999999999 109.241 179.747 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 327' ' ' TYR . . . . . 0.565 ' CD2' ' O ' ' A' ' 325' ' ' GLY . 49.7 m-85 -150.17 111.75 4.48 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.235 -0.916 . . . . 0.47999999999999998 109.617 -179.892 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 328' ' ' PHE . . . . . 0.439 ' O ' HG23 ' A' ' 329' ' ' THR . 46.2 m-85 -112.56 -170.07 1.6 Allowed 'General case' 0 N--CA 1.488 1.465 0 O-C-N 121.358 -0.839 . . . . 0.31 109.425 179.934 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 329' ' ' THR . . . . . 0.485 ' HA ' ' O ' ' C' ' 330' ' ' LEU . 9.1 p -153.38 175.62 12.93 Favored 'General case' 0 N--CA 1.487 1.416 0 O-C-N 121.203 -0.936 . . . . 0.22 109.404 -179.899 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 330' ' ' LEU . . . . . 0.488 ' O ' ' HA ' ' C' ' 329' ' ' THR . 29.2 tp -151.49 133.46 15.06 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.192 -0.942 . . . . 0.28000000000000003 109.665 -179.698 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 331' ' ' GLN . . . . . . . . . . . . . 1.9 tp60 -85.64 110.42 19.26 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.365 -0.834 . . . . 0.91000000000000003 109.222 179.784 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 332' ' ' ILE . . . . . 0.859 HG21 ' HA ' ' A' ' 338' ' ' PHE . 83.0 mt -103.11 103.99 15.94 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.659 0 O-C-N 121.251 -0.906 . . . . 0.26000000000000001 109.404 -179.772 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 333' ' ' ARG . . . . . 0.468 ' HG2' ' CE1' ' C' ' 327' ' ' TYR . 85.4 mtt180 -73.34 143.88 46.73 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.178 -0.951 . . . . 2.9199999999999999 109.424 179.891 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 334' ' ' GLY . . . . . . . . . . . . . . . 88.99 131.94 4.24 Favored Glycine 0 N--CA 1.49 2.279 0 N-CA-C 109.636 -1.386 . . . . 0.40000000000000002 109.636 179.932 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 335' ' ' ARG . . . . . . . . . . . . . 58.7 ttt180 -80.23 -41.19 25.58 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.304 -1.115 . . . . 3.0099999999999998 109.76 -179.92 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 336' ' ' GLU . . . . . . . . . . . . . 2.4 tt0 -58.49 -59.25 5.66 Favored 'General case' 0 N--CA 1.489 1.492 0 O-C-N 121.179 -0.951 . . . . 2.29 109.685 -179.754 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 337' ' ' ARG . . . . . 0.492 ' NH2' HD12 ' C' ' 348' ' ' LEU . 1.0 OUTLIER -59.43 -33.29 71.06 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.235 -0.916 . . . . 2.9300000000000002 109.422 179.993 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 338' ' ' PHE . . . . . 0.859 ' HA ' HG21 ' A' ' 332' ' ' ILE . 43.6 t80 -55.51 -56.74 16.8 Favored 'General case' 0 N--CA 1.488 1.425 0 O-C-N 121.219 -0.926 . . . . 0.38 109.456 179.95 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 339' ' ' GLU . . . . . . . . . . . . . 43.4 mt-10 -51.29 -30.9 19.51 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.23 -0.919 . . . . 1.97 109.925 179.979 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 340' ' ' MET . . . . . . . . . . . . . 6.1 ttp -63.34 -53.15 57.05 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.128 -0.983 . . . . 0.31 109.919 -179.505 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 341' ' ' PHE . . . . . . . . . . . . . 40.6 m-85 -62.03 -43.65 98.39 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.208 -0.933 . . . . 0.17999999999999999 109.719 -179.918 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 342' ' ' ARG . . . . . 0.456 ' CG ' ' NH1' ' A' ' 342' ' ' ARG . 0.0 OUTLIER -49.58 -41.06 40.79 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.178 -0.951 . . . . 2.4199999999999999 109.562 -179.924 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 343' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -59.68 -47.54 85.21 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.28 -0.887 . . . . 2.3500000000000001 109.638 -179.816 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 344' ' ' LEU . . . . . . . . . . . . . 53.2 mt -62.24 -31.68 72.27 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.237 -0.914 . . . . 0.17999999999999999 109.566 -179.81 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 345' ' ' ASN . . . . . . . . . . . . . 10.4 t-20 -57.11 -57.26 13.35 Favored 'General case' 0 N--CA 1.488 1.467 0 O-C-N 121.257 -0.902 . . . . 1.0900000000000001 109.772 -179.95 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 346' ' ' GLU . . . . . . . . . . . . . 64.9 tt0 -61.74 -26.47 68.08 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.311 -0.868 . . . . 1.6499999999999999 109.68 -179.851 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 347' ' ' ALA . . . . . 0.572 ' HB1' ' HB1' ' B' ' 347' ' ' ALA . . . -61.82 -61.18 2.69 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.229 -0.919 . . . . 0.17999999999999999 110.064 -179.59 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 348' ' ' LEU . . . . . 0.564 HD22 ' N ' ' A' ' 348' ' ' LEU . 4.1 mm? -59.79 -44.84 93.75 Favored 'General case' 0 N--CA 1.493 1.725 0 O-C-N 121.137 -0.977 . . . . 0.29999999999999999 109.825 -179.519 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 349' ' ' GLU . . . . . . . . . . . . . 92.8 mt-10 -57.95 -32.47 67.85 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.196 -0.94 . . . . 1.9399999999999999 109.901 -179.571 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 350' ' ' LEU . . . . . 0.625 HD22 HD13 ' B' ' 350' ' ' LEU . 5.9 tt -64.03 -45.55 88.38 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.24 -0.913 . . . . 0.46000000000000002 109.274 -179.894 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 351' ' ' LYS . . . . . . . . . . . . . 85.9 tttt -60.26 -41.57 93.52 Favored 'General case' 0 C--N 1.303 -1.454 0 O-C-N 121.436 -0.79 . . . . 1.3999999999999999 109.319 179.991 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 352' ' ' ASP . . . . . . . . . . . . . 21.1 m-20 -57.83 -40.91 81.14 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.406 -0.809 . . . . 1.1599999999999999 109.841 179.922 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 353' ' ' ALA . . . . . . . . . . . . . . . -66.99 -21.2 65.97 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.293 -0.879 . . . . 0.63 109.798 -179.602 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 354' ' ' GLN . . . . . . . . . . . . . 5.6 tt0 -82.76 -15.47 51.65 Favored 'General case' 0 C--N 1.302 -1.459 0 O-C-N 121.04 -1.038 . . . . 1.47 109.0 179.729 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 355' ' ' ALA . . . . . . . . . . . . . . . -72.62 -2.67 20.89 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.262 -0.898 . . . . 1.01 109.6 179.683 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 356' ' ' GLY . . . . . . . . . . . . . . . -77.69 -79.09 0.74 Allowed Glycine 0 N--CA 1.491 2.328 0 N-CA-C 110.0 -1.24 . . . . 1.3 110.0 -179.741 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 357' ' ' LYS . . . . . . . . . . . . . 3.7 mttp -85.37 105.47 16.04 Favored 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.235 -1.156 . . . . 4.0999999999999996 109.858 -179.544 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 358' ' ' GLU . . . . . 0.493 ' HB2' ' HD2' ' A' ' 359' ' ' PRO . 17.0 pt-20 -53.34 159.71 2.09 Favored Pre-proline 0 N--CA 1.49 1.552 0 O-C-N 121.251 -0.906 . . . . 5.75 109.23 179.582 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 359' ' ' PRO . . . . . 0.493 ' HD2' ' HB2' ' A' ' 358' ' ' GLU . 2.6 Cg_endo -61.71 -164.43 0.04 OUTLIER 'Trans proline' 0 C--N 1.309 -1.513 0 C-N-CA 122.035 1.823 . . . . 5.0 110.261 179.665 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 360' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.357 0 CA-C-O 117.961 -1.466 . . . . 6.9699999999999998 109.669 -179.707 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' B' B ' 319' ' ' LYS . . . . . . . . . . . . . 33.0 mttt . . . . . 0 N--CA 1.491 1.581 0 CA-C-O 121.326 0.584 . . . . 7.5499999999999998 109.542 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' B' B ' 320' ' ' LYS . . . . . . . . . . . . . 11.7 mttt 61.43 165.04 0.09 Allowed 'General case' 0 N--CA 1.489 1.485 0 O-C-N 121.266 -0.896 . . . . 6.4400000000000004 109.527 179.955 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 321' ' ' LYS . . . . . 0.485 ' HG2' ' HD2' ' B' ' 322' ' ' PRO . 0.0 OUTLIER -158.21 137.92 8.58 Favored Pre-proline 0 C--N 1.302 -1.472 0 O-C-N 121.308 -0.87 . . . . 6.1299999999999999 109.121 179.717 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 322' ' ' PRO . . . . . 0.485 ' HD2' ' HG2' ' B' ' 321' ' ' LYS . 2.2 Cg_endo -62.37 -81.1 0.01 OUTLIER 'Trans proline' 0 C--N 1.308 -1.566 0 C-N-CA 121.997 1.798 . . . . 2.8199999999999998 110.105 179.938 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 323' ' ' LEU . . . . . . . . . . . . . 37.6 mt -79.2 96.62 5.94 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.245 -0.91 . . . . 2.8399999999999999 109.745 -179.686 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 324' ' ' ASP . . . . . . . . . . . . . 3.6 m-20 -80.77 156.4 26.23 Favored 'General case' 0 N--CA 1.489 1.477 0 O-C-N 121.341 -0.85 . . . . 1.53 109.483 179.668 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 325' ' ' GLY . . . . . 0.541 ' O ' ' CD2' ' B' ' 327' ' ' TYR . . . -69.16 177.49 28.46 Favored Glycine 0 N--CA 1.491 2.321 0 N-CA-C 109.557 -1.417 . . . . 0.58999999999999997 109.557 179.9 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 326' ' ' GLU . . . . . . . . . . . . . 37.5 mm-40 -59.26 168.97 1.26 Allowed 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.145 -1.209 . . . . 2.1299999999999999 109.224 179.806 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 327' ' ' TYR . . . . . 0.541 ' CD2' ' O ' ' B' ' 325' ' ' GLY . 50.4 m-85 -149.85 112.12 4.67 Favored 'General case' 0 N--CA 1.488 1.469 0 O-C-N 121.205 -0.934 . . . . 0.47999999999999998 109.489 179.91 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 328' ' ' PHE . . . . . 0.431 ' O ' HG23 ' B' ' 329' ' ' THR . 47.6 m-85 -112.73 -170.21 1.62 Allowed 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.401 -0.812 . . . . 0.32000000000000001 109.216 179.879 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 329' ' ' THR . . . . . 0.431 HG23 ' O ' ' B' ' 328' ' ' PHE . 9.3 p -153.41 175.51 13.06 Favored 'General case' 0 N--CA 1.489 1.485 0 O-C-N 121.282 -0.886 . . . . 0.23000000000000001 109.315 -179.89 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 330' ' ' LEU . . . . . 0.46 ' O ' ' HA ' ' D' ' 329' ' ' THR . 27.1 tp -151.21 133.92 15.65 Favored 'General case' 0 N--CA 1.488 1.442 0 O-C-N 121.167 -0.958 . . . . 0.28000000000000003 109.644 -179.761 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 331' ' ' GLN . . . . . . . . . . . . . 1.9 tp60 -85.79 110.18 19.18 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.416 -0.803 . . . . 0.91000000000000003 109.158 179.839 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 332' ' ' ILE . . . . . 0.852 HG21 ' HA ' ' B' ' 338' ' ' PHE . 83.5 mt -103.07 103.29 14.87 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.668 0 O-C-N 121.249 -0.907 . . . . 0.23999999999999999 109.72 -179.737 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 333' ' ' ARG . . . . . 0.425 ' HG2' ' CD1' ' D' ' 327' ' ' TYR . 85.0 mtt180 -72.72 143.95 47.84 Favored 'General case' 0 N--CA 1.489 1.481 0 O-C-N 121.252 -0.905 . . . . 2.9300000000000002 109.492 179.834 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 334' ' ' GLY . . . . . . . . . . . . . . . 89.11 132.13 4.36 Favored Glycine 0 N--CA 1.492 2.377 0 N-CA-C 109.561 -1.415 . . . . 0.40000000000000002 109.561 -179.95 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 335' ' ' ARG . . . . . . . . . . . . . 58.4 ttt180 -80.31 -41.7 24.39 Favored 'General case' 0 N--CA 1.489 1.481 0 O-C-N 121.221 -1.164 . . . . 3.0099999999999998 109.53 -179.99 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 336' ' ' GLU . . . . . . . . . . . . . 2.5 tt0 -58.0 -59.68 4.9 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.27 -0.894 . . . . 2.2799999999999998 109.685 -179.823 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 337' ' ' ARG . . . . . 0.609 ' CZ ' HD12 ' D' ' 348' ' ' LEU . 1.0 OUTLIER -58.86 -33.59 70.63 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.148 -0.97 . . . . 2.9300000000000002 109.395 -179.872 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 338' ' ' PHE . . . . . 0.852 ' HA ' HG21 ' B' ' 332' ' ' ILE . 45.8 t80 -55.14 -56.72 16.75 Favored 'General case' 0 N--CA 1.487 1.397 0 O-C-N 121.324 -0.86 . . . . 0.37 109.623 179.963 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 339' ' ' GLU . . . . . . . . . . . . . 44.7 mt-10 -51.58 -30.46 20.98 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.205 -0.934 . . . . 1.98 109.984 -179.98 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 340' ' ' MET . . . . . . . . . . . . . 5.8 ttp -63.55 -53.71 47.51 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.177 -0.952 . . . . 0.32000000000000001 109.784 -179.461 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 341' ' ' PHE . . . . . . . . . . . . . 39.8 m-85 -61.76 -43.84 98.06 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.282 -0.886 . . . . 0.17999999999999999 109.637 -179.812 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 342' ' ' ARG . . . . . 0.449 ' CG ' HH11 ' B' ' 342' ' ' ARG . 0.1 OUTLIER -49.02 -41.7 35.62 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.258 -0.901 . . . . 2.4199999999999999 109.711 -179.948 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 343' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -58.98 -48.69 80.66 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.266 -0.896 . . . . 2.3500000000000001 109.599 -179.987 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 344' ' ' LEU . . . . . . . . . . . . . 59.6 mt -61.12 -31.18 70.89 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.253 -0.904 . . . . 0.17999999999999999 109.807 -179.753 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 345' ' ' ASN . . . . . . . . . . . . . 10.5 t-20 -57.95 -56.91 15.92 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.192 -0.943 . . . . 1.0900000000000001 109.681 -179.833 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 346' ' ' GLU . . . . . . . . . . . . . 62.4 tt0 -62.02 -26.38 68.2 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.226 -0.921 . . . . 1.6599999999999999 109.572 -179.768 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 347' ' ' ALA . . . . . 0.572 ' HB1' ' HB1' ' A' ' 347' ' ' ALA . . . -61.86 -60.62 3.38 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.192 -0.943 . . . . 0.17000000000000001 110.202 -179.687 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 348' ' ' LEU . . . . . 0.954 HD12 ' NH2' ' D' ' 337' ' ' ARG . 4.2 mm? -60.27 -45.16 94.27 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.045 -1.034 . . . . 0.28999999999999998 109.683 -179.441 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 349' ' ' GLU . . . . . . . . . . . . . 93.2 mt-10 -57.34 -33.36 67.67 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.386 -0.821 . . . . 1.95 109.863 -179.649 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 350' ' ' LEU . . . . . 0.625 HD13 HD22 ' A' ' 350' ' ' LEU . 5.9 tt -63.13 -46.63 86.36 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.122 -0.986 . . . . 0.45000000000000001 109.167 179.988 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 351' ' ' LYS . . . . . . . . . . . . . 87.5 tttt -59.23 -41.41 88.64 Favored 'General case' 0 N--CA 1.488 1.462 0 O-C-N 121.244 -0.91 . . . . 1.3799999999999999 109.455 179.856 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 352' ' ' ASP . . . . . . . . . . . . . 21.1 m-20 -58.11 -40.99 82.59 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.095 -1.003 . . . . 1.1599999999999999 110.06 -179.874 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 353' ' ' ALA . . . . . . . . . . . . . . . -66.48 -21.98 66.19 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.251 -0.905 . . . . 0.60999999999999999 109.66 -179.64 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 354' ' ' GLN . . . . . . . . . . . . . 5.5 tt0 -82.14 -14.82 55.12 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.205 -0.934 . . . . 1.45 109.241 179.853 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 355' ' ' ALA . . . . . . . . . . . . . . . -73.09 -2.81 22.86 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.239 -0.913 . . . . 0.97999999999999998 109.539 179.682 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 356' ' ' GLY . . . . . . . . . . . . . . . -77.51 -79.25 0.72 Allowed Glycine 0 N--CA 1.491 2.328 0 N-CA-C 109.989 -1.244 . . . . 1.29 109.989 -179.538 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 357' ' ' LYS . . . . . . . . . . . . . 3.4 mttp -85.74 104.47 15.48 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.282 -1.128 . . . . 4.0899999999999999 110.213 -179.28 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 358' ' ' GLU . . . . . 0.475 ' HB2' ' HD2' ' B' ' 359' ' ' PRO . 17.0 pt-20 -52.04 159.02 1.56 Allowed Pre-proline 0 N--CA 1.491 1.599 0 O-C-N 121.276 -0.89 . . . . 5.7199999999999998 109.484 179.6 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 359' ' ' PRO . . . . . 0.475 ' HD2' ' HB2' ' B' ' 358' ' ' GLU . 2.9 Cg_endo -61.61 -164.2 0.04 OUTLIER 'Trans proline' 0 C--N 1.309 -1.516 0 C-N-CA 122.094 1.863 . . . . 4.9800000000000004 110.018 179.756 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 360' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 2.405 0 CA-C-O 117.878 -1.512 . . . . 6.9800000000000004 109.597 -179.884 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' C' C ' 319' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.491 1.583 0 N-CA-C 109.279 -0.637 . . . . 6.8200000000000003 109.279 . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 320' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 60.54 94.29 0.04 OUTLIER 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.271 -0.893 . . . . 6.4900000000000002 109.81 179.572 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' C' C ' 321' ' ' LYS . . . . . 0.626 ' CB ' ' HD3' ' C' ' 322' ' ' PRO . 0.0 OUTLIER -160.13 -65.38 0.02 OUTLIER Pre-proline 0 N--CA 1.493 1.676 0 O-C-N 121.085 -1.009 . . . . 6.4000000000000004 109.844 179.473 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' C' C ' 322' ' ' PRO . . . . . 0.626 ' HD3' ' CB ' ' C' ' 321' ' ' LYS . 3.4 Cg_exo -57.93 -151.0 0.01 OUTLIER 'Trans proline' 0 C--N 1.315 -1.219 0 C-N-CA 121.708 1.605 . . . . 3.4199999999999999 110.079 179.648 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' C' C ' 323' ' ' LEU . . . . . . . . . . . . . 96.4 mt -77.34 141.66 39.76 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.199 -0.938 . . . . 3.9500000000000002 109.114 179.697 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 324' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 -77.69 -172.81 2.74 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.2 -0.938 . . . . 1.6299999999999999 109.711 -179.698 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 325' ' ' GLY . . . . . 0.47 ' O ' ' CE2' ' C' ' 327' ' ' TYR . . . -69.83 176.96 31.92 Favored Glycine 0 N--CA 1.491 2.318 0 N-CA-C 110.223 -1.151 . . . . 0.72999999999999998 110.223 -179.591 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' C' C ' 326' ' ' GLU . . . . . . . . . . . . . 45.0 mt-10 -59.68 -178.53 0.07 Allowed 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.278 -1.131 . . . . 2.1699999999999999 109.763 179.921 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 327' ' ' TYR . . . . . 0.47 ' CE2' ' O ' ' C' ' 325' ' ' GLY . 59.1 m-85 -150.77 108.04 3.61 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.39 -0.819 . . . . 0.47999999999999998 109.507 -179.905 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' C' C ' 328' ' ' PHE . . . . . 0.411 ' C ' HG23 ' C' ' 329' ' ' THR . 67.3 m-85 -104.12 -164.02 1.02 Allowed 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.201 -0.937 . . . . 0.33000000000000002 109.825 -179.885 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' C' C ' 329' ' ' THR . . . . . 0.488 ' HA ' ' O ' ' A' ' 330' ' ' LEU . 56.1 p -156.28 177.8 11.03 Favored 'General case' 0 N--CA 1.491 1.589 0 N-CA-C 108.997 -0.742 . . . . 0.23000000000000001 108.997 179.748 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' C' C ' 330' ' ' LEU . . . . . 0.485 ' O ' ' HA ' ' A' ' 329' ' ' THR . 39.3 tp -153.48 132.09 12.23 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 120.949 -1.095 . . . . 0.28000000000000003 109.492 179.823 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' C' C ' 331' ' ' GLN . . . . . . . . . . . . . 1.1 tp60 -87.56 114.04 23.81 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.133 -0.979 . . . . 1.48 109.547 179.791 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 332' ' ' ILE . . . . . 0.762 HG21 ' HA ' ' C' ' 338' ' ' PHE . 48.5 mt -103.91 108.28 24.23 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.526 0 O-C-N 121.197 -0.939 . . . . 0.23999999999999999 109.728 -179.933 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' C' C ' 333' ' ' ARG . . . . . 0.462 ' HG2' ' CE1' ' A' ' 327' ' ' TYR . 5.1 mtp180 -72.89 144.98 47.18 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.006 -1.058 . . . . 2.7400000000000002 109.488 179.848 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' C' C ' 334' ' ' GLY . . . . . . . . . . . . . . . 73.05 130.92 0.15 Allowed Glycine 0 N--CA 1.491 2.322 0 N-CA-C 109.93 -1.268 . . . . 0.34999999999999998 109.93 179.794 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 335' ' ' ARG . . . . . 0.49 ' O ' ' HB3' ' C' ' 338' ' ' PHE . 2.4 ttp180 -73.45 -27.77 61.6 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.238 -1.154 . . . . 2.5299999999999998 109.667 179.922 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' C' C ' 336' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -57.08 -58.82 6.52 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 120.961 -1.087 . . . . 2.6200000000000001 109.158 -179.987 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' C' C ' 337' ' ' ARG . . . . . 0.555 ' NH1' ' HG3' ' C' ' 337' ' ' ARG . 0.5 OUTLIER -60.95 -30.83 70.47 Favored 'General case' 0 N--CA 1.488 1.474 0 O-C-N 121.296 -0.877 . . . . 2.8100000000000001 108.776 179.618 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' C' C ' 338' ' ' PHE . . . . . 0.762 ' HA ' HG21 ' C' ' 332' ' ' ILE . 82.6 t80 -54.89 -58.66 6.68 Favored 'General case' 0 C--N 1.304 -1.378 0 O-C-N 121.345 -0.847 . . . . 0.40000000000000002 109.646 -179.835 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' C' C ' 339' ' ' GLU . . . . . . . . . . . . . 41.2 mt-10 -50.97 -32.63 21.62 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.07 -1.018 . . . . 2.0499999999999998 109.989 -179.657 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 340' ' ' MET . . . . . . . . . . . . . 29.8 ttp -65.37 -56.24 13.71 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.242 -0.911 . . . . 0.32000000000000001 110.208 -179.472 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 341' ' ' PHE . . . . . . . . . . . . . 63.9 m-85 -61.44 -53.51 55.53 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.091 -1.006 . . . . 0.17999999999999999 110.155 -179.416 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 342' ' ' ARG . . . . . 0.438 ' NH1' ' CG ' ' C' ' 342' ' ' ARG . 0.0 OUTLIER -44.8 -41.15 6.73 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.255 -0.903 . . . . 2.9100000000000001 110.051 -179.265 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' C' C ' 343' ' ' GLU . . . . . . . . . . . . . 36.6 tt0 -57.89 -51.42 69.67 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.162 -0.961 . . . . 2.1400000000000001 109.77 -179.91 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 344' ' ' LEU . . . . . . . . . . . . . 55.8 mt -62.73 -26.87 68.9 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.329 -0.857 . . . . 0.22 109.7 179.983 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 345' ' ' ASN . . . . . . . . . . . . . 13.2 t-20 -58.0 -58.54 7.96 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.281 -0.887 . . . . 1.0800000000000001 109.501 -179.957 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 346' ' ' GLU . . . . . . . . . . . . . 10.0 tp10 -62.2 -28.88 69.99 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.456 -0.778 . . . . 2.21 109.722 -179.667 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 347' ' ' ALA . . . . . 0.675 ' HB1' ' HB1' ' D' ' 347' ' ' ALA . . . -60.7 -57.79 11.21 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.103 -0.998 . . . . 0.17999999999999999 109.984 -179.72 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' C' C ' 348' ' ' LEU . . . . . 0.526 ' N ' HD22 ' C' ' 348' ' ' LEU . 3.5 mm? -62.5 -45.8 91.35 Favored 'General case' 0 N--CA 1.494 1.761 0 O-C-N 121.096 -1.002 . . . . 0.32000000000000001 110.044 -179.494 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' C' C ' 349' ' ' GLU . . . . . . . . . . . . . 1.3 mm-40 -55.02 -36.02 65.04 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.276 -0.89 . . . . 2.1899999999999999 109.886 -179.223 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 350' ' ' LEU . . . . . 0.598 HD22 HD13 ' D' ' 350' ' ' LEU . 7.0 tt -63.46 -46.88 84.22 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.355 -0.841 . . . . 0.46000000000000002 109.894 -179.632 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' C' C ' 351' ' ' LYS . . . . . . . . . . . . . 22.8 tttt -58.32 -40.24 81.55 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.355 -0.841 . . . . 1.3500000000000001 109.672 -179.66 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 352' ' ' ASP . . . . . . . . . . . . . 52.0 m-20 -57.12 -51.69 68.29 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.361 -0.837 . . . . 1.1899999999999999 109.925 179.993 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 353' ' ' ALA . . . . . . . . . . . . . . . -66.07 -12.44 55.44 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.154 -0.966 . . . . 0.56999999999999995 109.923 -179.233 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 354' ' ' GLN . . . . . . . . . . . . . 39.5 tt0 -85.68 -27.46 25.33 Favored 'General case' 0 N--CA 1.488 1.47 0 O-C-N 121.183 -0.948 . . . . 1.47 109.577 179.872 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 355' ' ' ALA . . . . . . . . . . . . . . . -73.16 -4.26 31.7 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.313 -0.867 . . . . 0.93000000000000005 109.55 179.849 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 356' ' ' GLY . . . . . . . . . . . . . . . -58.72 -59.01 11.58 Favored Glycine 0 N--CA 1.492 2.402 0 N-CA-C 109.697 -1.361 . . . . 1.3300000000000001 109.697 -179.628 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 357' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -86.12 63.89 8.27 Favored 'General case' 0 N--CA 1.488 1.447 0 O-C-N 121.295 -1.121 . . . . 4.0099999999999998 109.302 -179.924 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' C' C ' 358' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -51.16 141.19 21.01 Favored Pre-proline 0 N--CA 1.49 1.538 0 O-C-N 121.32 -0.863 . . . . 5.75 109.61 -179.842 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' C' C ' 359' ' ' PRO . . . . . . . . . . . . . 1.7 Cg_endo -63.81 105.01 0.5 Allowed 'Trans proline' 0 C--N 1.312 -1.36 0 C-N-CA 122.156 1.904 . . . . 4.9400000000000004 110.047 179.915 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 360' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.336 0 N-CA-C 109.639 -1.385 . . . . 6.5 109.639 -179.916 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' D' D ' 319' ' ' LYS . . . . . . . . . . . . . 33.6 mttt . . . . . 0 N--CA 1.49 1.569 0 N-CA-C 109.431 -0.581 . . . . 7.5300000000000002 109.431 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' D' D ' 320' ' ' LYS . . . . . . . . . . . . . 11.6 mttt 62.36 164.64 0.1 Allowed 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.258 -0.901 . . . . 6.4100000000000001 109.345 -179.981 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' D' D ' 321' ' ' LYS . . . . . 0.46 ' HG2' ' HD2' ' D' ' 322' ' ' PRO . 0.0 OUTLIER -158.02 137.85 8.66 Favored Pre-proline 0 N--CA 1.489 1.52 0 O-C-N 121.344 -0.847 . . . . 6.1100000000000003 109.175 179.945 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' D' D ' 322' ' ' PRO . . . . . 0.46 ' HD2' ' HG2' ' D' ' 321' ' ' LYS . 2.2 Cg_endo -62.31 -80.98 0.01 OUTLIER 'Trans proline' 0 C--N 1.311 -1.439 0 C-N-CA 121.934 1.756 . . . . 2.8199999999999998 110.003 179.908 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' D' D ' 323' ' ' LEU . . . . . . . . . . . . . 34.3 mt -78.92 96.68 5.77 Favored 'General case' 0 N--CA 1.488 1.454 0 O-C-N 121.188 -0.945 . . . . 2.8300000000000001 109.96 -179.708 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' D' D ' 324' ' ' ASP . . . . . . . . . . . . . 3.5 m-20 -81.01 156.45 25.9 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.283 -0.886 . . . . 1.54 109.41 179.731 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' D' D ' 325' ' ' GLY . . . . . 0.554 ' O ' ' CD2' ' D' ' 327' ' ' TYR . . . -69.5 176.71 31.18 Favored Glycine 0 N--CA 1.491 2.355 0 N-CA-C 109.458 -1.457 . . . . 0.58999999999999997 109.458 -179.955 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' D' D ' 326' ' ' GLU . . . . . . . . . . . . . 38.1 mm-40 -58.6 168.78 1.08 Allowed 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.26 -1.141 . . . . 2.1299999999999999 109.237 179.939 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' D' D ' 327' ' ' TYR . . . . . 0.554 ' CD2' ' O ' ' D' ' 325' ' ' GLY . 49.0 m-85 -149.67 111.92 4.67 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.22 -0.925 . . . . 0.46999999999999997 109.553 179.977 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' D' D ' 328' ' ' PHE . . . . . 0.422 ' O ' HG23 ' D' ' 329' ' ' THR . 50.6 m-85 -112.12 -170.12 1.6 Allowed 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.265 -0.897 . . . . 0.29999999999999999 109.206 179.856 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' D' D ' 329' ' ' THR . . . . . 0.46 ' HA ' ' O ' ' B' ' 330' ' ' LEU . 9.8 p -153.2 175.7 12.76 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.231 -0.918 . . . . 0.22 109.147 -179.85 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' D' D ' 330' ' ' LEU . . . . . . . . . . . . . 26.0 tp -151.63 134.03 15.35 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.116 -0.99 . . . . 0.28000000000000003 109.631 -179.762 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' D' D ' 331' ' ' GLN . . . . . . . . . . . . . 1.9 tp60 -85.81 110.28 19.26 Favored 'General case' 0 N--CA 1.488 1.454 0 O-C-N 121.248 -0.907 . . . . 0.93000000000000005 109.31 179.88 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' D' D ' 332' ' ' ILE . . . . . 0.853 HG21 ' HA ' ' D' ' 338' ' ' PHE . 86.1 mt -102.85 103.37 14.97 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.573 0 O-C-N 121.226 -0.921 . . . . 0.25 109.541 -179.819 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' D' D ' 333' ' ' ARG . . . . . . . . . . . . . 84.9 mtt180 -73.09 143.31 47.44 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.25 -0.906 . . . . 2.9300000000000002 109.498 179.81 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' D' D ' 334' ' ' GLY . . . . . . . . . . . . . . . 89.16 131.65 4.22 Favored Glycine 0 N--CA 1.49 2.278 0 N-CA-C 109.49 -1.444 . . . . 0.40999999999999998 109.49 -179.907 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' D' D ' 335' ' ' ARG . . . . . . . . . . . . . 55.9 ttt180 -79.77 -41.71 26.01 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.352 -1.087 . . . . 3.0299999999999998 109.835 -179.672 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' D' D ' 336' ' ' GLU . . . . . . . . . . . . . 2.8 tt0 -58.26 -58.73 7.19 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.25 -0.906 . . . . 2.2599999999999998 109.736 -179.724 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' D' D ' 337' ' ' ARG . . . . . 0.954 ' NH2' HD12 ' B' ' 348' ' ' LEU . 0.9 OUTLIER -59.75 -33.25 71.42 Favored 'General case' 0 N--CA 1.489 1.478 0 O-C-N 121.28 -0.887 . . . . 2.9199999999999999 109.354 -179.965 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' D' D ' 338' ' ' PHE . . . . . 0.853 ' HA ' HG21 ' D' ' 332' ' ' ILE . 45.7 t80 -55.5 -57.03 13.57 Favored 'General case' 0 N--CA 1.489 1.478 0 O-C-N 121.22 -0.925 . . . . 0.37 109.435 179.978 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' D' D ' 339' ' ' GLU . . . . . . . . . . . . . 45.3 mt-10 -51.25 -31.37 20.69 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.229 -0.919 . . . . 1.99 109.726 -179.856 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' D' D ' 340' ' ' MET . . . . . . . . . . . . . 5.3 ttp -62.59 -53.96 46.8 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.223 -0.923 . . . . 0.31 109.859 -179.576 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' D' D ' 341' ' ' PHE . . . . . . . . . . . . . 40.2 m-85 -61.74 -43.38 98.97 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.145 -0.972 . . . . 0.17999999999999999 109.692 -179.727 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' D' D ' 342' ' ' ARG . . . . . 0.441 ' CG ' HH11 ' D' ' 342' ' ' ARG . 0.1 OUTLIER -49.51 -41.13 40.14 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.268 -0.895 . . . . 2.4100000000000001 109.608 -179.789 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' D' D ' 343' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -59.36 -48.0 83.3 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.293 -0.88 . . . . 2.3500000000000001 109.647 -179.862 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' D' D ' 344' ' ' LEU . . . . . . . . . . . . . 57.4 mt -61.99 -30.94 71.28 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.171 -0.956 . . . . 0.19 109.815 -179.777 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' D' D ' 345' ' ' ASN . . . . . . . . . . . . . 10.6 t-20 -57.91 -57.4 12.98 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.157 -0.964 . . . . 1.0900000000000001 109.559 -179.913 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' D' D ' 346' ' ' GLU . . . . . . . . . . . . . 60.3 tt0 -61.55 -26.63 68.07 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.104 -0.997 . . . . 1.6899999999999999 109.543 -179.854 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' D' D ' 347' ' ' ALA . . . . . 0.675 ' HB1' ' HB1' ' C' ' 347' ' ' ALA . . . -60.94 -61.58 2.48 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.137 -0.977 . . . . 0.17999999999999999 110.136 -179.784 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' D' D ' 348' ' ' LEU . . . . . 0.609 HD12 ' CZ ' ' B' ' 337' ' ' ARG . 4.2 mm? -60.03 -44.13 94.83 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.164 -0.96 . . . . 0.31 109.946 -179.495 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' D' D ' 349' ' ' GLU . . . . . . . . . . . . . 92.8 mt-10 -58.08 -33.1 68.7 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.067 -1.02 . . . . 1.95 109.851 -179.542 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' D' D ' 350' ' ' LEU . . . . . 0.598 HD13 HD22 ' C' ' 350' ' ' LEU . 5.9 tt -63.52 -45.99 88.08 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.201 -0.937 . . . . 0.42999999999999999 109.352 -179.975 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' D' D ' 351' ' ' LYS . . . . . . . . . . . . . 88.1 tttt -59.68 -41.61 91.08 Favored 'General case' 0 N--CA 1.488 1.456 0 O-C-N 121.298 -0.876 . . . . 1.3999999999999999 109.383 179.957 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' D' D ' 352' ' ' ASP . . . . . . . . . . . . . 20.9 m-20 -58.17 -40.42 81.41 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.399 -0.813 . . . . 1.1699999999999999 109.881 179.955 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' D' D ' 353' ' ' ALA . . . . . . . . . . . . . . . -67.56 -20.86 65.45 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.203 -0.936 . . . . 0.58999999999999997 109.602 -179.39 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' D' D ' 354' ' ' GLN . . . . . . . . . . . . . 5.6 tt0 -83.35 -14.27 53.23 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.1 -1.0 . . . . 1.4399999999999999 109.169 179.708 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' D' D ' 355' ' ' ALA . . . . . . . . . . . . . . . -73.52 -1.82 20.13 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.453 -0.78 . . . . 0.97999999999999998 109.502 179.47 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' D' D ' 356' ' ' GLY . . . . . . . . . . . . . . . -78.84 -78.98 0.81 Allowed Glycine 0 N--CA 1.49 2.288 0 N-CA-C 110.085 -1.206 . . . . 1.28 110.085 -179.532 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' D' D ' 357' ' ' LYS . . . . . . . . . . . . . 3.0 mttp -86.05 106.12 16.97 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.346 -1.091 . . . . 4.0899999999999999 109.718 -179.507 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' D' D ' 358' ' ' GLU . . . . . 0.479 ' HB2' ' HD2' ' D' ' 359' ' ' PRO . 17.0 pt-20 -53.44 159.21 2.41 Favored Pre-proline 0 N--CA 1.491 1.58 0 O-C-N 121.414 -0.804 . . . . 5.71 109.433 179.636 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' D' D ' 359' ' ' PRO . . . . . 0.479 ' HD2' ' HB2' ' D' ' 358' ' ' GLU . 2.9 Cg_endo -61.73 -164.31 0.04 OUTLIER 'Trans proline' 0 C--N 1.309 -1.501 0 C-N-CA 121.934 1.756 . . . . 4.9699999999999998 109.857 179.776 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' D' D ' 360' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.226 0 N-CA-C 109.484 -1.446 . . . . 6.9699999999999998 109.484 179.745 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 319' ' ' LYS . . . . . . . . . . . . . 31.1 mttm . . . . . 0 N--CA 1.49 1.555 0 N-CA-C 109.528 -0.545 . . . . 7.5499999999999998 109.528 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 320' ' ' LYS . . . . . 0.462 ' O ' ' HG3' ' A' ' 321' ' ' LYS . 0.4 OUTLIER 53.97 66.41 1.24 Allowed 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.304 -0.872 . . . . 6.4299999999999997 109.889 179.984 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 321' ' ' LYS . . . . . 0.622 ' CB ' ' HD3' ' A' ' 322' ' ' PRO . 15.9 mttt -162.06 -64.09 0.02 OUTLIER Pre-proline 0 C--N 1.301 -1.53 0 O-C-N 121.133 -0.98 . . . . 6.1299999999999999 109.739 179.582 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 322' ' ' PRO . . . . . 0.622 ' HD3' ' CB ' ' A' ' 321' ' ' LYS . 3.3 Cg_exo -57.0 -81.18 0.01 OUTLIER 'Trans proline' 0 C--N 1.311 -1.414 0 C-N-CA 121.79 1.66 . . . . 2.8300000000000001 110.555 179.783 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 323' ' ' LEU . . . . . . . . . . . . . 62.9 mt -78.27 92.73 4.53 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 120.882 -1.136 . . . . 2.8300000000000001 109.775 -179.592 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 324' ' ' ASP . . . . . . . . . . . . . 70.1 m-20 -80.38 165.75 21.94 Favored 'General case' 0 C--N 1.303 -1.427 0 O-C-N 121.23 -0.919 . . . . 1.53 109.277 179.788 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 325' ' ' GLY . . . . . 0.45 ' O ' ' CE2' ' A' ' 327' ' ' TYR . . . -68.33 174.0 31.69 Favored Glycine 0 N--CA 1.489 2.214 0 N-CA-C 109.232 -1.547 . . . . 0.60999999999999999 109.232 -179.793 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 326' ' ' GLU . . . . . . . . . . . . . 2.9 mm-40 -57.5 173.64 0.26 Allowed 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.152 -1.205 . . . . 2.1299999999999999 109.343 -179.773 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 327' ' ' TYR . . . . . 0.45 ' CE2' ' O ' ' A' ' 325' ' ' GLY . 44.0 m-85 -149.61 112.21 4.76 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.24 -0.912 . . . . 0.47999999999999998 109.643 179.994 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 328' ' ' PHE . . . . . 0.496 ' CE2' ' HB2' ' C' ' 335' ' ' ARG . 95.9 m-85 -114.26 -168.07 1.31 Allowed 'General case' 0 N--CA 1.488 1.465 0 O-C-N 121.236 -0.915 . . . . 0.31 109.316 179.957 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 329' ' ' THR . . . . . . . . . . . . . 40.2 p -152.77 162.14 41.65 Favored 'General case' 0 N--CA 1.489 1.482 0 O-C-N 121.284 -0.885 . . . . 0.22 109.575 179.927 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 330' ' ' LEU . . . . . 0.54 HD21 ' HB2' ' C' ' 345' ' ' ASN . 18.4 tp -150.58 130.52 13.38 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.375 -0.828 . . . . 0.28000000000000003 109.433 -179.958 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 331' ' ' GLN . . . . . 0.418 ' HG3' ' O ' ' C' ' 328' ' ' PHE . 1.5 tt0 -86.81 118.38 26.17 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.265 -0.897 . . . . 0.91000000000000003 109.439 179.903 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 332' ' ' ILE . . . . . 0.584 HD12 ' CD1' ' A' ' 338' ' ' PHE . 9.9 mt -103.46 110.6 30.39 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.527 0 O-C-N 121.286 -0.884 . . . . 0.26000000000000001 109.673 179.988 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 333' ' ' ARG . . . . . 0.572 ' HG2' ' CE2' ' C' ' 327' ' ' TYR . 44.7 mtt180 -72.92 149.31 43.52 Favored 'General case' 0 C--N 1.303 -1.448 0 O-C-N 121.373 -0.83 . . . . 2.9199999999999999 109.238 179.728 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 334' ' ' GLY . . . . . . . . . . . . . . . 85.65 129.65 2.29 Favored Glycine 0 N--CA 1.49 2.251 0 N-CA-C 109.619 -1.392 . . . . 0.40000000000000002 109.619 -179.982 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 335' ' ' ARG . . . . . 0.44 ' O ' ' HB3' ' A' ' 338' ' ' PHE . 31.5 ttp180 -78.92 -44.52 22.45 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.361 -1.082 . . . . 3.0099999999999998 109.758 -179.92 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 336' ' ' GLU . . . . . . . . . . . . . 1.3 tt0 -58.7 -57.34 13.45 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.231 -0.918 . . . . 2.29 109.717 -179.743 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 337' ' ' ARG . . . . . 0.455 ' NH1' ' CG ' ' A' ' 337' ' ' ARG . 0.0 OUTLIER -59.21 -31.3 68.91 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.278 -0.889 . . . . 2.9300000000000002 109.523 -179.83 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 338' ' ' PHE . . . . . 0.584 ' CD1' HD12 ' A' ' 332' ' ' ILE . 60.2 t80 -54.74 -55.86 25.42 Favored 'General case' 0 N--CA 1.489 1.48 0 O-C-N 121.114 -0.991 . . . . 0.38 109.442 179.993 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 339' ' ' GLU . . . . . . . . . . . . . 13.7 mt-10 -51.41 -35.31 38.58 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.196 -0.94 . . . . 1.97 109.903 -179.798 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 340' ' ' MET . . . . . . . . . . . . . 26.2 ttp -63.11 -50.04 72.06 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.222 -0.923 . . . . 0.31 110.068 -179.474 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 341' ' ' PHE . . . . . 0.482 ' HZ ' HD23 ' C' ' 348' ' ' LEU . 41.1 m-85 -61.21 -46.16 91.6 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.12 -0.988 . . . . 0.17999999999999999 109.561 -179.806 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 342' ' ' ARG . . . . . 0.47 ' CG ' ' NH1' ' A' ' 342' ' ' ARG . 0.0 OUTLIER -51.03 -37.55 45.95 Favored 'General case' 0 C--N 1.301 -1.506 0 O-C-N 121.278 -0.889 . . . . 2.4199999999999999 109.627 -179.933 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 343' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -59.49 -51.7 68.74 Favored 'General case' 0 N--CA 1.489 1.483 0 O-C-N 121.257 -0.902 . . . . 2.3500000000000001 109.694 -179.488 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 344' ' ' LEU . . . . . 0.941 HD22 HD22 ' B' ' 344' ' ' LEU . 53.6 mt -60.9 -33.78 73.65 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.308 -0.87 . . . . 0.17999999999999999 109.375 179.984 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 345' ' ' ASN . . . . . 0.666 ' HB2' HD21 ' C' ' 330' ' ' LEU . 28.5 t-20 -57.95 -56.31 23.6 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.233 -0.917 . . . . 1.0900000000000001 109.802 -179.984 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 346' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -61.39 -32.79 72.73 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.278 -0.889 . . . . 1.6499999999999999 110.034 -179.56 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 347' ' ' ALA . . . . . 0.627 ' HB1' ' HB1' ' B' ' 347' ' ' ALA . . . -58.75 -55.1 39.41 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.061 -1.024 . . . . 0.17999999999999999 109.948 -179.773 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 348' ' ' LEU . . . . . 0.536 HD22 ' N ' ' A' ' 348' ' ' LEU . 4.1 mm? -60.61 -46.45 90.21 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.125 -0.985 . . . . 0.29999999999999999 109.594 -179.717 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 349' ' ' GLU . . . . . 0.491 ' HG2' ' NH1' ' C' ' 333' ' ' ARG . 1.7 mt-10 -58.11 -29.87 65.83 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.128 -0.982 . . . . 1.9399999999999999 110.02 -179.648 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 350' ' ' LEU . . . . . 0.629 HD23 ' C ' ' A' ' 350' ' ' LEU . 6.4 tt -64.09 -48.98 74.06 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.028 -1.045 . . . . 0.46000000000000002 109.173 179.774 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 351' ' ' LYS . . . . . . . . . . . . . 19.3 tttt -58.98 -41.79 88.45 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.421 -0.799 . . . . 1.3999999999999999 109.447 179.833 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 352' ' ' ASP . . . . . . . . . . . . . 15.1 m-20 -56.7 -39.23 73.48 Favored 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.399 -0.813 . . . . 1.1599999999999999 109.537 -179.947 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 353' ' ' ALA . . . . . . . . . . . . . . . -66.73 -32.63 74.05 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.294 -0.879 . . . . 0.63 109.611 -179.875 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 354' ' ' GLN . . . . . . . . . . . . . 7.2 tt0 -81.09 -1.15 43.1 Favored 'General case' 0 C--N 1.303 -1.451 0 O-C-N 121.23 -0.919 . . . . 1.47 109.629 -179.989 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 355' ' ' ALA . . . . . . . . . . . . . . . -70.88 -39.06 73.06 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.162 -0.961 . . . . 1.01 110.126 -179.725 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 356' ' ' GLY . . . . . . . . . . . . . . . -80.06 -8.36 87.71 Favored Glycine 0 N--CA 1.491 2.317 0 N-CA-C 109.956 -1.258 . . . . 1.3 109.956 -179.757 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 357' ' ' LYS . . . . . . . . . . . . . 24.4 mttt -89.32 105.35 17.73 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.164 -1.197 . . . . 4.0999999999999996 109.315 179.641 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 358' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -49.29 143.72 9.26 Favored Pre-proline 0 N--CA 1.488 1.436 0 O-C-N 121.221 -0.924 . . . . 5.75 109.394 -179.991 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 359' ' ' PRO . . . . . . . . . . . . . 1.1 Cg_endo -65.09 -81.81 0.01 OUTLIER 'Trans proline' 0 C--N 1.309 -1.534 0 C-N-CA 122.264 1.976 . . . . 5.0 110.052 -179.969 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 360' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.229 0 CA-C-O 117.94 -1.478 . . . . 6.9699999999999998 109.478 179.957 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' B' B ' 319' ' ' LYS . . . . . . . . . . . . . 30.4 mttm . . . . . 0 N--CA 1.49 1.544 0 N-CA-C 109.727 -0.471 . . . . 7.5499999999999998 109.727 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' B' B ' 320' ' ' LYS . . . . . 0.456 ' O ' ' HG3' ' B' ' 321' ' ' LYS . 0.4 OUTLIER 53.16 66.67 1.16 Allowed 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.023 -1.048 . . . . 6.4400000000000004 110.071 179.768 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' B' B ' 321' ' ' LYS . . . . . 0.624 ' CB ' ' HD3' ' B' ' 322' ' ' PRO . 16.3 mttt -162.6 -63.95 0.01 OUTLIER Pre-proline 0 N--CA 1.492 1.627 0 O-C-N 120.988 -1.07 . . . . 6.1299999999999999 109.629 179.289 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 322' ' ' PRO . . . . . 0.624 ' HD3' ' CB ' ' B' ' 321' ' ' LYS . 4.0 Cg_exo -56.69 -80.98 0.01 OUTLIER 'Trans proline' 0 C--N 1.315 -1.224 0 C-N-CA 121.811 1.674 . . . . 2.8199999999999998 110.763 179.537 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 323' ' ' LEU . . . . . . . . . . . . . 63.5 mt -79.29 92.8 5.18 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 120.971 -1.081 . . . . 2.8399999999999999 109.655 -179.59 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 324' ' ' ASP . . . . . . . . . . . . . 74.9 m-20 -80.32 164.12 23.39 Favored 'General case' 0 N--CA 1.49 1.525 0 O-C-N 121.272 -0.893 . . . . 1.53 109.416 179.613 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 325' ' ' GLY . . . . . 0.458 ' O ' ' CE2' ' B' ' 327' ' ' TYR . . . -66.19 173.13 24.72 Favored Glycine 0 N--CA 1.493 2.446 0 N-CA-C 109.464 -1.454 . . . . 0.58999999999999997 109.464 179.841 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 326' ' ' GLU . . . . . . . . . . . . . 3.0 mm-40 -57.14 173.15 0.24 Allowed 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.171 -1.193 . . . . 2.1299999999999999 109.372 -179.931 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 327' ' ' TYR . . . . . 0.562 ' CE1' ' HG2' ' D' ' 333' ' ' ARG . 42.7 m-85 -149.1 111.57 4.73 Favored 'General case' 0 N--CA 1.488 1.458 0 O-C-N 121.254 -0.904 . . . . 0.47999999999999998 109.62 -179.834 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 328' ' ' PHE . . . . . 0.542 ' CE2' ' HA ' ' D' ' 335' ' ' ARG . 95.3 m-85 -113.72 -167.65 1.23 Allowed 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.245 -0.909 . . . . 0.32000000000000001 109.415 179.904 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 329' ' ' THR . . . . . . . . . . . . . 38.9 p -153.5 161.35 42.33 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.174 -0.954 . . . . 0.23000000000000001 109.601 -179.642 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 330' ' ' LEU . . . . . 0.625 HD21 ' HB2' ' D' ' 345' ' ' ASN . 16.3 tp -150.41 131.46 14.36 Favored 'General case' 0 N--CA 1.488 1.432 0 O-C-N 121.235 -0.916 . . . . 0.28000000000000003 109.249 179.932 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 331' ' ' GLN . . . . . . . . . . . . . 1.5 tt0 -87.25 118.58 26.77 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.368 -0.832 . . . . 0.91000000000000003 109.495 -179.917 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 332' ' ' ILE . . . . . 0.576 HD12 ' CD1' ' B' ' 338' ' ' PHE . 10.8 mt -103.59 110.14 29.13 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.496 0 O-C-N 121.166 -0.959 . . . . 0.23999999999999999 109.7 -179.798 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 333' ' ' ARG . . . . . 0.499 ' HG2' ' CE1' ' D' ' 327' ' ' TYR . 46.6 mtt180 -72.65 148.81 44.42 Favored 'General case' 0 N--CA 1.487 1.381 0 O-C-N 121.19 -0.944 . . . . 2.9300000000000002 109.323 179.585 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 334' ' ' GLY . . . . . . . . . . . . . . . 86.17 129.4 2.43 Favored Glycine 0 N--CA 1.49 2.277 0 N-CA-C 109.553 -1.419 . . . . 0.40000000000000002 109.553 179.848 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 335' ' ' ARG . . . . . 0.463 ' O ' ' HB3' ' B' ' 338' ' ' PHE . 31.8 ttp180 -78.5 -45.11 22.78 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.242 -1.152 . . . . 3.0099999999999998 110.016 -179.844 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 336' ' ' GLU . . . . . . . . . . . . . 1.3 tt0 -58.45 -56.86 16.66 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.153 -0.967 . . . . 2.2799999999999998 109.651 -179.706 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 337' ' ' ARG . . . . . 0.434 ' CG ' HH11 ' B' ' 337' ' ' ARG . 0.0 OUTLIER -59.09 -31.4 68.87 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.294 -0.879 . . . . 2.9300000000000002 109.544 -179.793 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' B' B ' 338' ' ' PHE . . . . . 0.576 ' CD1' HD12 ' B' ' 332' ' ' ILE . 60.9 t80 -55.02 -55.82 26.62 Favored 'General case' 0 N--CA 1.488 1.441 0 O-C-N 121.33 -0.856 . . . . 0.37 109.417 179.971 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 339' ' ' GLU . . . . . . . . . . . . . 15.4 mt-10 -51.74 -34.96 41.53 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.333 -0.855 . . . . 1.98 109.789 -179.882 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 340' ' ' MET . . . . . . . . . . . . . 28.8 ttp -63.2 -50.57 69.78 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.105 -0.997 . . . . 0.32000000000000001 109.909 -179.641 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 341' ' ' PHE . . . . . 0.458 ' HB2' HD13 ' B' ' 332' ' ' ILE . 42.7 m-85 -60.62 -46.32 90.72 Favored 'General case' 0 N--CA 1.494 1.725 0 O-C-N 121.079 -1.013 . . . . 0.17999999999999999 109.842 -179.906 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 342' ' ' ARG . . . . . 0.465 ' CG ' ' NH1' ' B' ' 342' ' ' ARG . 0.0 OUTLIER -50.86 -38.07 47.13 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.219 -0.926 . . . . 2.4199999999999999 109.651 -179.862 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' B' B ' 343' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -58.8 -51.83 68.32 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.239 -0.913 . . . . 2.3500000000000001 109.76 -179.823 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 344' ' ' LEU . . . . . 0.941 HD22 HD22 ' A' ' 344' ' ' LEU . 52.6 mt -61.39 -32.94 72.88 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.182 -0.949 . . . . 0.17999999999999999 109.53 -179.839 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 345' ' ' ASN . . . . . 0.517 ' HB2' HD21 ' D' ' 330' ' ' LEU . 28.8 t-20 -58.48 -56.58 20.23 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.301 -0.874 . . . . 1.0900000000000001 109.573 -179.996 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 346' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -61.31 -32.12 71.97 Favored 'General case' 0 C--N 1.301 -1.54 0 O-C-N 121.417 -0.802 . . . . 1.6599999999999999 110.086 -179.52 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 347' ' ' ALA . . . . . 0.627 ' HB1' ' HB1' ' A' ' 347' ' ' ALA . . . -59.15 -55.18 38.32 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.246 -0.909 . . . . 0.17000000000000001 109.914 -179.577 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 348' ' ' LEU . . . . . 0.528 HD22 ' N ' ' B' ' 348' ' ' LEU . 4.1 mm? -60.61 -45.71 93.0 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.252 -0.905 . . . . 0.28999999999999998 109.856 -179.717 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 349' ' ' GLU . . . . . . . . . . . . . 1.8 mt-10 -58.74 -29.84 67.04 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.137 -0.977 . . . . 1.95 109.762 -179.482 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 350' ' ' LEU . . . . . 0.602 HD23 ' C ' ' B' ' 350' ' ' LEU . 6.4 tt -64.11 -48.87 74.42 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.26 -0.9 . . . . 0.45000000000000001 109.159 179.651 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 351' ' ' LYS . . . . . . . . . . . . . 19.4 tttt -59.54 -41.67 90.59 Favored 'General case' 0 C--N 1.302 -1.462 0 O-C-N 121.348 -0.845 . . . . 1.3799999999999999 109.437 179.966 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 352' ' ' ASP . . . . . . . . . . . . . 16.7 m-20 -56.55 -39.13 72.91 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.217 -0.927 . . . . 1.1599999999999999 109.515 179.8 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 353' ' ' ALA . . . . . . . . . . . . . . . -66.76 -33.31 75.35 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.253 -0.904 . . . . 0.60999999999999999 109.759 -179.91 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 354' ' ' GLN . . . . . . . . . . . . . 7.4 tt0 -80.55 -1.29 41.36 Favored 'General case' 0 N--CA 1.489 1.484 0 O-C-N 121.239 -0.913 . . . . 1.45 109.491 179.927 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 355' ' ' ALA . . . . . . . . . . . . . . . -70.51 -38.52 74.31 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.187 -0.946 . . . . 0.97999999999999998 110.114 -179.761 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 356' ' ' GLY . . . . . . . . . . . . . . . -80.37 -8.91 87.12 Favored Glycine 0 N--CA 1.491 2.354 0 N-CA-C 109.762 -1.335 . . . . 1.29 109.762 -179.434 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 357' ' ' LYS . . . . . . . . . . . . . 23.5 mttt -89.12 106.15 18.25 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.116 -1.226 . . . . 4.0899999999999999 109.492 179.854 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 358' ' ' GLU . . . . . 0.404 ' HA ' ' HD3' ' B' ' 359' ' ' PRO . 0.0 OUTLIER -49.49 143.61 10.1 Favored Pre-proline 0 N--CA 1.491 1.611 0 O-C-N 121.314 -0.867 . . . . 5.7199999999999998 109.569 -179.877 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' B' B ' 359' ' ' PRO . . . . . 0.404 ' HD3' ' HA ' ' B' ' 358' ' ' GLU . 1.3 Cg_endo -65.13 -82.69 0.01 OUTLIER 'Trans proline' 0 C--N 1.311 -1.439 0 C-N-CA 121.895 1.73 . . . . 4.9800000000000004 109.967 179.935 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 360' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.362 0 CA-C-O 117.984 -1.453 . . . . 6.9800000000000004 109.481 179.788 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' C' C ' 319' ' ' LYS . . . . . 0.422 ' O ' ' HB2' ' C' ' 320' ' ' LYS . 0.0 OUTLIER . . . . . 0 N--CA 1.493 1.71 0 CA-C-O 121.297 0.57 . . . . 6.8200000000000003 109.484 . . . . . . . . . 2 2 . 1 . 008 nuclear build full ' C' C ' 320' ' ' LYS . . . . . 0.422 ' HB2' ' O ' ' C' ' 319' ' ' LYS . 4.5 mtmp? 62.33 -97.64 0.07 Allowed 'General case' 0 N--CA 1.488 1.459 0 O-C-N 121.443 -0.786 . . . . 6.4900000000000002 109.516 -179.99 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' C' C ' 321' ' ' LYS . . . . . 0.48 ' O ' ' O ' ' C' ' 322' ' ' PRO . 3.2 mtmm -159.32 82.98 2.42 Favored Pre-proline 0 N--CA 1.489 1.513 0 O-C-N 120.967 -1.083 . . . . 6.4000000000000004 109.744 179.938 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' C' C ' 322' ' ' PRO . . . . . 0.48 ' O ' ' O ' ' C' ' 321' ' ' LYS . 3.5 Cg_exo -56.43 -144.0 0.0 OUTLIER 'Trans proline' 0 C--N 1.309 -1.521 0 C-N-CA 122.311 2.007 . . . . 3.4199999999999999 109.836 179.537 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' C' C ' 323' ' ' LEU . . . . . . . . . . . . . 78.8 mt -74.94 139.39 42.99 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 120.667 -1.271 . . . . 3.9500000000000002 108.909 -179.969 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 324' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -77.78 166.15 23.29 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.322 -0.861 . . . . 1.6299999999999999 109.391 -179.666 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 325' ' ' GLY . . . . . . . . . . . . . . . -66.85 -174.59 6.45 Favored Glycine 0 N--CA 1.49 2.246 0 N-CA-C 109.374 -1.491 . . . . 0.72999999999999998 109.374 179.97 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 326' ' ' GLU . . . . . . . . . . . . . 16.1 mm-40 -58.82 -169.41 0.01 OUTLIER 'General case' 0 N--CA 1.488 1.458 0 O-C-N 121.343 -1.092 . . . . 2.1699999999999999 109.56 179.976 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 327' ' ' TYR . . . . . 0.572 ' CE2' ' HG2' ' A' ' 333' ' ' ARG . 46.4 m-85 -148.89 111.85 4.87 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.269 -0.895 . . . . 0.47999999999999998 109.799 -179.978 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' C' C ' 328' ' ' PHE . . . . . 0.449 ' O ' HG23 ' C' ' 329' ' ' THR . 93.5 m-85 -111.12 -167.03 1.13 Allowed 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.236 -0.915 . . . . 0.33000000000000002 109.538 -179.924 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' C' C ' 329' ' ' THR . . . . . 0.449 HG23 ' O ' ' C' ' 328' ' ' PHE . 10.8 p -154.11 167.53 29.53 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.283 -0.886 . . . . 0.23000000000000001 109.705 -179.434 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' C' C ' 330' ' ' LEU . . . . . 0.666 HD21 ' HB2' ' A' ' 345' ' ' ASN . 20.2 tp -152.5 132.06 13.04 Favored 'General case' 0 N--CA 1.489 1.525 0 O-C-N 121.15 -0.969 . . . . 0.28000000000000003 109.89 179.886 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' C' C ' 331' ' ' GLN . . . . . . . . . . . . . 1.2 tt0 -89.23 116.96 27.85 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.337 -0.852 . . . . 1.48 109.428 179.79 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 332' ' ' ILE . . . . . 0.565 HG21 ' HA ' ' C' ' 338' ' ' PHE . 59.9 mt -103.85 115.96 46.74 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.783 0 O-C-N 121.151 -0.968 . . . . 0.23999999999999999 109.805 -179.892 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' C' C ' 333' ' ' ARG . . . . . 0.491 ' NH1' ' HG2' ' A' ' 349' ' ' GLU . 0.1 OUTLIER -75.06 144.87 42.77 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.258 -0.901 . . . . 2.7400000000000002 109.727 179.684 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' C' C ' 334' ' ' GLY . . . . . . . . . . . . . . . 82.53 123.7 0.79 Allowed Glycine 0 N--CA 1.491 2.36 0 C-N-CA 120.005 -1.093 . . . . 0.34999999999999998 110.472 179.307 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 335' ' ' ARG . . . . . 0.504 ' NH1' ' HG2' ' C' ' 335' ' ' ARG . 0.4 OUTLIER -73.4 -31.19 63.73 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.372 -1.075 . . . . 2.5299999999999998 109.034 179.438 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' C' C ' 336' ' ' GLU . . . . . 0.459 ' OE1' ' HG3' ' C' ' 337' ' ' ARG . 14.1 tm-20 -59.29 -63.57 1.26 Allowed 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.277 -0.889 . . . . 2.6200000000000001 109.052 179.747 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' C' C ' 337' ' ' ARG . . . . . 0.459 ' HG3' ' OE1' ' C' ' 336' ' ' GLU . 4.0 mtt180 -60.75 -26.21 67.05 Favored 'General case' 0 N--CA 1.487 1.422 0 O-C-N 121.308 -0.87 . . . . 2.8100000000000001 109.358 179.65 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' C' C ' 338' ' ' PHE . . . . . 0.565 ' HA ' HG21 ' C' ' 332' ' ' ILE . 86.4 t80 -54.86 -62.2 1.81 Allowed 'General case' 0 C--N 1.305 -1.344 0 O-C-N 121.279 -0.888 . . . . 0.40000000000000002 109.379 -179.97 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' C' C ' 339' ' ' GLU . . . . . . . . . . . . . 34.2 mt-10 -51.1 -31.58 19.71 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.227 -0.921 . . . . 2.0499999999999998 110.032 -179.587 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 340' ' ' MET . . . . . 0.434 ' HB3' ' O ' ' C' ' 337' ' ' ARG . 7.1 ttp -63.93 -53.54 48.77 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.213 -0.929 . . . . 0.32000000000000001 109.841 -179.756 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' C' C ' 341' ' ' PHE . . . . . 0.442 ' HB2' HD13 ' C' ' 332' ' ' ILE . 33.5 m-85 -61.19 -42.53 98.75 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.194 -0.941 . . . . 0.17999999999999999 109.815 -179.661 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' C' C ' 342' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -46.6 -43.57 17.45 Favored 'General case' 0 C--N 1.301 -1.519 0 O-C-N 121.187 -0.946 . . . . 2.9100000000000001 109.496 -179.823 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' C' C ' 343' ' ' GLU . . . . . . . . . . . . . 15.8 tp10 -61.45 -40.28 93.9 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 120.988 -1.07 . . . . 2.1400000000000001 109.635 179.884 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 344' ' ' LEU . . . . . 0.553 ' CD2' HD22 ' D' ' 344' ' ' LEU . 43.6 mt -63.31 -52.93 59.89 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.156 -0.965 . . . . 0.22 109.77 -179.756 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' C' C ' 345' ' ' ASN . . . . . 0.54 ' HB2' HD21 ' A' ' 330' ' ' LEU . 0.8 OUTLIER -53.86 -44.91 70.76 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.277 -0.889 . . . . 1.0800000000000001 109.656 -179.759 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' C' C ' 346' ' ' GLU . . . . . . . . . . . . . 3.2 tp10 -62.17 -37.58 85.81 Favored 'General case' 0 N--CA 1.488 1.435 0 O-C-N 121.209 -0.932 . . . . 2.21 109.823 -179.93 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 347' ' ' ALA . . . . . 0.721 ' HB1' ' HB1' ' D' ' 347' ' ' ALA . . . -59.35 -47.59 84.86 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.184 -0.948 . . . . 0.17999999999999999 109.516 -179.662 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' C' C ' 348' ' ' LEU . . . . . 0.541 ' N ' HD22 ' C' ' 348' ' ' LEU . 3.9 mm? -63.66 -42.72 98.05 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.258 -0.901 . . . . 0.32000000000000001 109.706 179.933 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' C' C ' 349' ' ' GLU . . . . . 0.404 ' OE1' ' CZ ' ' A' ' 333' ' ' ARG . 5.4 mm-40 -57.54 -39.14 75.95 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.046 -1.034 . . . . 2.1899999999999999 109.341 179.996 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' C' C ' 350' ' ' LEU . . . . . 0.626 HD22 HD13 ' D' ' 350' ' ' LEU . 6.4 tt -61.31 -43.71 98.42 Favored 'General case' 0 N--CA 1.488 1.458 0 O-C-N 121.539 -0.726 . . . . 0.46000000000000002 109.323 -179.992 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' C' C ' 351' ' ' LYS . . . . . . . . . . . . . 8.9 tttp -60.96 -41.91 97.25 Favored 'General case' 0 C--N 1.304 -1.395 0 O-C-N 121.116 -0.99 . . . . 1.3500000000000001 109.085 179.867 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 352' ' ' ASP . . . . . . . . . . . . . 77.2 m-20 -52.76 -58.15 7.81 Favored 'General case' 0 N--CA 1.488 1.449 0 O-C-N 121.382 -0.824 . . . . 1.1899999999999999 109.239 179.898 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 353' ' ' ALA . . . . . . . . . . . . . . . -69.49 -15.49 63.27 Favored 'General case' 0 N--CA 1.489 1.478 0 O-C-N 121.276 -0.89 . . . . 0.56999999999999995 109.457 -179.956 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 354' ' ' GLN . . . . . 0.47 ' HB2' ' O ' ' C' ' 350' ' ' LEU . 1.2 tt0 -86.21 -15.43 40.92 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.263 -0.898 . . . . 1.47 109.616 179.991 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' C' C ' 355' ' ' ALA . . . . . . . . . . . . . . . -72.25 -18.97 61.78 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.078 -1.014 . . . . 0.93000000000000005 109.186 179.697 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 356' ' ' GLY . . . . . . . . . . . . . . . -81.26 -1.46 90.04 Favored Glycine 0 N--CA 1.491 2.363 0 N-CA-C 109.601 -1.399 . . . . 1.3300000000000001 109.601 179.778 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 357' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -86.91 22.62 1.95 Allowed 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.017 -1.284 . . . . 4.0099999999999998 109.963 -179.617 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' C' C ' 358' ' ' GLU . . . . . 0.581 ' N ' ' HD2' ' C' ' 359' ' ' PRO . 0.1 OUTLIER -49.12 -53.17 41.43 Favored Pre-proline 0 N--CA 1.489 1.486 0 O-C-N 120.896 -1.127 . . . . 5.75 109.629 179.637 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' C' C ' 359' ' ' PRO . . . . . 0.581 ' HD2' ' N ' ' C' ' 358' ' ' GLU . 5.8 Cg_exo -60.74 -169.05 0.05 OUTLIER 'Trans proline' 0 C--N 1.31 -1.476 0 C-N-CA 121.855 1.703 . . . . 4.9400000000000004 110.329 -179.898 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' C' C ' 360' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.227 0 CA-C-O 117.951 -1.471 . . . . 6.5 109.68 -179.843 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' D' D ' 319' ' ' LYS . . . . . . . . . . . . . 30.0 mttm . . . . . 0 N--CA 1.491 1.601 0 CA-C-O 121.102 0.477 . . . . 7.5300000000000002 109.889 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' D' D ' 320' ' ' LYS . . . . . 0.455 ' O ' ' HG3' ' D' ' 321' ' ' LYS . 0.3 OUTLIER 53.4 65.59 1.47 Allowed 'General case' 0 N--CA 1.494 1.742 0 O-C-N 121.138 -0.976 . . . . 6.4100000000000001 110.227 179.868 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' D' D ' 321' ' ' LYS . . . . . 0.62 ' CB ' ' HD3' ' D' ' 322' ' ' PRO . 16.4 mttt -162.03 -63.73 0.02 OUTLIER Pre-proline 0 N--CA 1.491 1.593 0 O-C-N 121.246 -0.909 . . . . 6.1100000000000003 109.968 179.25 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' D' D ' 322' ' ' PRO . . . . . 0.62 ' HD3' ' CB ' ' D' ' 321' ' ' LYS . 4.8 Cg_exo -56.43 -80.77 0.01 OUTLIER 'Trans proline' 0 C--N 1.313 -1.32 0 C-N-CA 121.94 1.76 . . . . 2.8199999999999998 110.716 179.846 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' D' D ' 323' ' ' LEU . . . . . . . . . . . . . 64.6 mt -79.95 93.36 5.69 Favored 'General case' 0 N--CA 1.488 1.456 0 O-C-N 121.096 -1.002 . . . . 2.8300000000000001 109.417 -179.587 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' D' D ' 324' ' ' ASP . . . . . . . . . . . . . 76.2 m-20 -80.75 165.26 22.1 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.499 -0.751 . . . . 1.54 109.396 179.827 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' D' D ' 325' ' ' GLY . . . . . 0.453 ' O ' ' CE2' ' D' ' 327' ' ' TYR . . . -67.36 173.74 28.53 Favored Glycine 0 N--CA 1.491 2.326 0 N-CA-C 109.615 -1.394 . . . . 0.58999999999999997 109.615 -179.932 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' D' D ' 326' ' ' GLU . . . . . . . . . . . . . 3.3 mm-40 -57.43 173.5 0.26 Allowed 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.033 -1.275 . . . . 2.1299999999999999 109.348 -179.769 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' D' D ' 327' ' ' TYR . . . . . 0.499 ' CE1' ' HG2' ' B' ' 333' ' ' ARG . 43.3 m-85 -149.75 111.37 4.51 Favored 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.012 -1.055 . . . . 0.46999999999999997 109.436 179.959 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' D' D ' 328' ' ' PHE . . . . . 0.453 ' CE2' ' HA ' ' B' ' 335' ' ' ARG . 97.1 m-85 -113.4 -167.67 1.23 Allowed 'General case' 0 N--CA 1.488 1.472 0 O-C-N 121.375 -0.828 . . . . 0.29999999999999999 109.184 -179.791 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' D' D ' 329' ' ' THR . . . . . . . . . . . . . 37.9 p -153.55 161.68 41.98 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.209 -0.932 . . . . 0.22 109.464 -179.957 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' D' D ' 330' ' ' LEU . . . . . 0.517 HD21 ' HB2' ' B' ' 345' ' ' ASN . 17.7 tp -150.48 130.89 13.78 Favored 'General case' 0 N--CA 1.488 1.474 0 O-C-N 121.464 -0.773 . . . . 0.28000000000000003 109.473 -179.9 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' D' D ' 331' ' ' GLN . . . . . 0.435 ' HG3' ' O ' ' B' ' 328' ' ' PHE . 1.6 tt0 -86.69 119.87 27.38 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.017 -1.052 . . . . 0.93000000000000005 109.325 179.835 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' D' D ' 332' ' ' ILE . . . . . 0.574 HD12 ' CD1' ' D' ' 338' ' ' PHE . 12.4 mt -104.4 109.58 27.86 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.564 0 O-C-N 121.094 -1.004 . . . . 0.25 109.636 -179.894 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' D' D ' 333' ' ' ARG . . . . . 0.562 ' HG2' ' CE1' ' B' ' 327' ' ' TYR . 46.1 mtt180 -72.28 149.97 44.01 Favored 'General case' 0 C--N 1.302 -1.465 0 O-C-N 121.106 -0.996 . . . . 2.9300000000000002 109.209 179.827 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' D' D ' 334' ' ' GLY . . . . . . . . . . . . . . . 85.53 129.63 2.25 Favored Glycine 0 N--CA 1.493 2.486 0 N-CA-C 109.645 -1.382 . . . . 0.40999999999999998 109.645 -179.911 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' D' D ' 335' ' ' ARG . . . . . 0.542 ' HA ' ' CE2' ' B' ' 328' ' ' PHE . 32.2 ttp180 -78.82 -45.96 19.75 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.007 -1.29 . . . . 3.0299999999999998 109.647 179.898 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' D' D ' 336' ' ' GLU . . . . . . . . . . . . . 1.3 tt0 -57.65 -56.63 19.48 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.101 -0.999 . . . . 2.2599999999999998 109.665 -179.821 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' D' D ' 337' ' ' ARG . . . . . 0.422 ' CG ' ' NH1' ' D' ' 337' ' ' ARG . 0.0 OUTLIER -59.32 -31.2 68.94 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.159 -0.963 . . . . 2.9199999999999999 109.669 -179.769 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' D' D ' 338' ' ' PHE . . . . . 0.574 ' CD1' HD12 ' D' ' 332' ' ' ILE . 61.2 t80 -55.26 -54.98 36.69 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.292 -0.88 . . . . 0.37 109.532 179.923 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' D' D ' 339' ' ' GLU . . . . . . . . . . . . . 17.1 mt-10 -52.36 -34.62 48.47 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.197 -0.94 . . . . 1.99 109.756 -179.687 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' D' D ' 340' ' ' MET . . . . . . . . . . . . . 31.1 ttp -63.52 -49.92 71.61 Favored 'General case' 0 N--CA 1.488 1.466 0 O-C-N 121.23 -0.919 . . . . 0.31 109.966 -179.616 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' D' D ' 341' ' ' PHE . . . . . 0.456 ' HB2' HD13 ' D' ' 332' ' ' ILE . 42.1 m-85 -61.37 -47.05 87.63 Favored 'General case' 0 N--CA 1.488 1.467 0 O-C-N 121.108 -0.995 . . . . 0.17999999999999999 109.551 -179.687 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' D' D ' 342' ' ' ARG . . . . . 0.459 ' CG ' ' NH1' ' D' ' 342' ' ' ARG . 0.0 OUTLIER -50.24 -37.87 37.78 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.175 -0.953 . . . . 2.4100000000000001 109.86 -179.876 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' D' D ' 343' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -59.07 -51.58 69.42 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.303 -0.873 . . . . 2.3500000000000001 109.673 -179.701 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' D' D ' 344' ' ' LEU . . . . . 0.553 HD22 ' CD2' ' C' ' 344' ' ' LEU . 56.1 mt -61.52 -33.03 73.12 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.191 -0.943 . . . . 0.19 109.455 179.959 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' D' D ' 345' ' ' ASN . . . . . 0.625 ' HB2' HD21 ' B' ' 330' ' ' LEU . 29.3 t-20 -58.38 -56.29 24.01 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.258 -0.901 . . . . 1.0900000000000001 109.718 179.932 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' D' D ' 346' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -61.63 -32.61 72.76 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.421 -0.8 . . . . 1.6899999999999999 109.92 -179.634 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' D' D ' 347' ' ' ALA . . . . . 0.721 ' HB1' ' HB1' ' C' ' 347' ' ' ALA . . . -58.4 -55.22 37.86 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.053 -1.029 . . . . 0.17999999999999999 109.827 -179.701 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' D' D ' 348' ' ' LEU . . . . . 0.531 HD22 ' N ' ' D' ' 348' ' ' LEU . 4.2 mm? -61.02 -46.47 90.62 Favored 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.17 -0.956 . . . . 0.31 109.844 -179.46 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' D' D ' 349' ' ' GLU . . . . . 0.42 ' OE2' ' ND2' ' D' ' 345' ' ' ASN . 1.8 mt-10 -57.85 -29.89 65.36 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.184 -0.947 . . . . 1.95 109.736 -179.582 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' D' D ' 350' ' ' LEU . . . . . 0.626 HD13 HD22 ' C' ' 350' ' ' LEU . 6.3 tt -63.88 -49.37 72.97 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.099 -1.001 . . . . 0.42999999999999999 109.292 179.853 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' D' D ' 351' ' ' LYS . . . . . . . . . . . . . 19.8 tttt -59.19 -42.14 90.15 Favored 'General case' 0 C--N 1.303 -1.449 0 O-C-N 121.47 -0.769 . . . . 1.3999999999999999 109.403 179.78 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' D' D ' 352' ' ' ASP . . . . . . . . . . . . . 17.8 m-20 -56.1 -38.85 71.3 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.396 -0.815 . . . . 1.1699999999999999 109.562 179.601 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' D' D ' 353' ' ' ALA . . . . . . . . . . . . . . . -67.19 -33.49 75.5 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.116 -0.99 . . . . 0.58999999999999997 109.608 -179.909 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' D' D ' 354' ' ' GLN . . . . . . . . . . . . . 7.6 tt0 -80.68 -0.51 38.55 Favored 'General case' 0 N--CA 1.488 1.475 0 O-C-N 121.131 -0.98 . . . . 1.4399999999999999 109.497 -179.934 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' D' D ' 355' ' ' ALA . . . . . . . . . . . . . . . -71.29 -37.41 71.84 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.197 -0.94 . . . . 0.97999999999999998 110.116 -179.742 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' D' D ' 356' ' ' GLY . . . . . . . . . . . . . . . -80.86 -8.87 87.0 Favored Glycine 0 N--CA 1.492 2.398 0 N-CA-C 110.02 -1.232 . . . . 1.28 110.02 -179.591 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' D' D ' 357' ' ' LYS . . . . . . . . . . . . . 22.6 mttt -89.34 107.35 19.02 Favored 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.217 -1.167 . . . . 4.0899999999999999 109.455 179.761 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' D' D ' 358' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -50.19 144.05 11.85 Favored Pre-proline 0 N--CA 1.489 1.505 0 O-C-N 121.288 -0.882 . . . . 5.71 109.483 -179.892 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' D' D ' 359' ' ' PRO . . . . . . . . . . . . . 1.1 Cg_endo -64.85 -82.68 0.01 OUTLIER 'Trans proline' 0 C--N 1.31 -1.462 0 C-N-CA 122.008 1.805 . . . . 4.9699999999999998 110.008 179.916 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' D' D ' 360' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.255 0 CA-C-O 117.91 -1.495 . . . . 6.9699999999999998 109.513 179.826 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 319' ' ' LYS . . . . . 0.429 ' O ' ' O ' ' A' ' 320' ' ' LYS . 13.0 mtmt . . . . . 0 N--CA 1.491 1.6 0 N-CA-C 109.365 -0.606 . . . . 7.5499999999999998 109.365 . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 320' ' ' LYS . . . . . 0.429 ' O ' ' O ' ' A' ' 319' ' ' LYS . 6.0 tttp 59.86 114.36 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.232 -0.917 . . . . 6.4299999999999997 109.593 179.983 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 321' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -158.93 92.06 1.95 Allowed Pre-proline 0 N--CA 1.49 1.558 0 O-C-N 121.254 -0.904 . . . . 6.1299999999999999 109.474 179.937 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 322' ' ' PRO . . . . . . . . . . . . . 2.2 Cg_endo -62.07 -47.2 10.9 Favored 'Trans proline' 0 C--N 1.31 -1.476 0 C-N-CA 122.113 1.875 . . . . 2.8300000000000001 109.956 179.982 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 323' ' ' LEU . . . . . . . . . . . . . 19.6 mt -81.33 96.43 7.31 Favored 'General case' 0 N--CA 1.49 1.525 0 O-C-N 121.309 -0.869 . . . . 2.8300000000000001 109.415 179.903 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 324' ' ' ASP . . . . . . . . . . . . . 8.1 m-20 -80.18 148.82 30.73 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.174 -0.953 . . . . 1.53 109.091 179.839 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 325' ' ' GLY . . . . . 0.466 ' O ' ' CE2' ' A' ' 327' ' ' TYR . . . -67.44 171.87 32.41 Favored Glycine 0 N--CA 1.49 2.273 0 N-CA-C 109.052 -1.619 . . . . 0.60999999999999999 109.052 179.959 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 326' ' ' GLU . . . . . . . . . . . . . 3.0 mt-10 -56.7 174.36 0.16 Allowed 'General case' 0 N--CA 1.488 1.454 0 O-C-N 121.109 -1.23 . . . . 2.1299999999999999 109.07 -179.893 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 327' ' ' TYR . . . . . 0.466 ' CE2' ' O ' ' A' ' 325' ' ' GLY . 47.3 m-85 -148.83 111.4 4.75 Favored 'General case' 0 N--CA 1.489 1.476 0 O-C-N 121.256 -0.902 . . . . 0.47999999999999998 109.527 -179.835 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 328' ' ' PHE . . . . . 0.411 ' CE2' ' HA ' ' C' ' 335' ' ' ARG . 86.4 m-85 -113.87 -168.47 1.35 Allowed 'General case' 0 N--CA 1.488 1.451 0 O-C-N 121.347 -0.845 . . . . 0.31 109.532 -179.808 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 329' ' ' THR . . . . . 0.459 ' HA ' ' O ' ' C' ' 330' ' ' LEU . 24.4 p -153.56 165.21 36.61 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.346 -0.846 . . . . 0.22 109.078 179.94 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 330' ' ' LEU . . . . . 0.587 HD21 HD22 ' C' ' 345' ' ' ASN . 14.7 tp -151.47 131.33 13.29 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.045 -1.034 . . . . 0.28000000000000003 109.877 -179.803 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 331' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -87.55 120.77 29.19 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.279 -0.888 . . . . 0.91000000000000003 109.165 179.615 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 332' ' ' ILE . . . . . 0.647 HD12 ' CD1' ' A' ' 338' ' ' PHE . 59.6 mt -103.56 111.1 32.0 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.548 0 O-C-N 121.235 -0.916 . . . . 0.26000000000000001 109.664 -179.794 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 333' ' ' ARG . . . . . 0.443 ' CG ' ' NH1' ' A' ' 333' ' ' ARG . 0.0 OUTLIER -72.59 139.56 47.51 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.403 -0.811 . . . . 2.9199999999999999 109.35 179.83 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 334' ' ' GLY . . . . . . . . . . . . . . . 85.76 136.6 4.09 Favored Glycine 0 N--CA 1.49 2.251 0 N-CA-C 109.697 -1.361 . . . . 0.40000000000000002 109.697 179.878 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 335' ' ' ARG . . . . . 0.492 ' HG3' ' NH1' ' A' ' 335' ' ' ARG . 0.3 OUTLIER -80.11 -36.17 35.74 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.405 -1.056 . . . . 3.0099999999999998 109.582 -179.921 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 336' ' ' GLU . . . . . . . . . . . . . 52.2 tt0 -58.58 -57.24 13.84 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.238 -0.914 . . . . 2.29 110.052 -179.634 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 337' ' ' ARG . . . . . 0.552 ' HG3' ' NH1' ' A' ' 337' ' ' ARG . 0.6 OUTLIER -60.0 -30.36 69.09 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.117 -0.989 . . . . 2.9300000000000002 109.815 -179.625 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 338' ' ' PHE . . . . . 0.647 ' CD1' HD12 ' A' ' 332' ' ' ILE . 88.8 t80 -54.34 -62.99 1.29 Allowed 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.214 -0.929 . . . . 0.38 109.756 -179.73 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 339' ' ' GLU . . . . . . . . . . . . . 80.9 mt-10 -51.88 -31.46 28.22 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.211 -0.93 . . . . 1.97 110.205 -179.667 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 340' ' ' MET . . . . . . . . . . . . . 28.0 ttp -63.8 -53.62 47.94 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.134 -0.979 . . . . 0.31 110.121 -179.432 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 341' ' ' PHE . . . . . . . . . . . . . 39.2 m-85 -62.25 -48.59 79.26 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.171 -0.955 . . . . 0.17999999999999999 110.023 -179.533 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 342' ' ' ARG . . . . . . . . . . . . . 70.3 ttt180 -48.85 -38.38 22.17 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.161 -0.962 . . . . 2.4199999999999999 109.858 -179.71 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 343' ' ' GLU . . . . . . . . . . . . . 42.5 tt0 -59.42 -49.45 77.77 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.157 -0.964 . . . . 2.3500000000000001 109.896 -179.705 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 344' ' ' LEU . . . . . 0.458 HD22 ' CD2' ' B' ' 344' ' ' LEU . 42.2 mt -61.32 -37.96 85.14 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.092 -1.005 . . . . 0.17999999999999999 109.714 -179.597 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 345' ' ' ASN . . . . . 0.446 ' HA ' ' CZ ' ' C' ' 341' ' ' PHE . 60.6 t-20 -57.01 -50.37 72.94 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.165 -0.959 . . . . 1.0900000000000001 109.675 -179.936 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 346' ' ' GLU . . . . . . . . . . . . . 2.7 tt0 -60.71 -34.44 74.38 Favored 'General case' 0 N--CA 1.489 1.49 0 O-C-N 121.263 -0.898 . . . . 1.6499999999999999 109.894 -179.755 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 347' ' ' ALA . . . . . 0.878 ' HB1' ' HB1' ' B' ' 347' ' ' ALA . . . -60.84 -51.65 68.42 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.128 -0.982 . . . . 0.17999999999999999 110.047 -179.771 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 348' ' ' LEU . . . . . 0.541 HD22 ' N ' ' A' ' 348' ' ' LEU . 3.9 mm? -61.41 -44.84 96.44 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.165 -0.96 . . . . 0.29999999999999999 110.003 -179.508 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 349' ' ' GLU . . . . . . . . . . . . . 39.3 mt-10 -58.02 -40.58 81.17 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.27 -0.894 . . . . 1.9399999999999999 110.337 -179.281 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 350' ' ' LEU . . . . . 0.614 HD23 ' C ' ' A' ' 350' ' ' LEU . 8.5 tt -63.59 -48.37 77.67 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.16 -0.963 . . . . 0.46000000000000002 109.977 -179.317 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 351' ' ' LYS . . . . . . . . . . . . . 25.3 tttt -55.43 -41.84 73.35 Favored 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.259 -0.901 . . . . 1.3999999999999999 109.329 -179.548 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 352' ' ' ASP . . . . . . . . . . . . . 23.0 m-20 -59.36 -48.32 82.07 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.38 -0.825 . . . . 1.1599999999999999 109.778 179.902 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 353' ' ' ALA . . . . . . . . . . . . . . . -67.49 -9.5 42.82 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.29 -0.881 . . . . 0.63 110.177 -179.419 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 354' ' ' GLN . . . . . . . . . . . . . 2.3 tt0 -83.91 -28.23 28.05 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.051 -1.03 . . . . 1.47 109.628 -179.945 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 355' ' ' ALA . . . . . . . . . . . . . . . -73.79 -21.36 60.19 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.256 -0.903 . . . . 1.01 109.545 179.8 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 356' ' ' GLY . . . . . . . . . . . . . . . -81.91 31.04 2.84 Favored Glycine 0 N--CA 1.493 2.48 0 N-CA-C 110.544 -1.022 . . . . 1.3 110.544 179.936 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 357' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -87.28 124.92 33.85 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 120.831 -1.393 . . . . 4.0999999999999996 109.43 -179.897 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 358' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -49.9 155.68 1.47 Allowed Pre-proline 0 N--CA 1.489 1.51 0 O-C-N 121.22 -0.925 . . . . 5.75 109.403 -179.983 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 359' ' ' PRO . . . . . . . . . . . . . 3.2 Cg_exo -61.84 138.34 73.45 Favored 'Trans proline' 0 C--N 1.309 -1.519 0 C-N-CA 122.257 1.971 . . . . 5.0 110.189 -179.785 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 360' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.244 0 CA-C-O 117.995 -1.447 . . . . 6.9699999999999998 109.522 179.952 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' B' B ' 319' ' ' LYS . . . . . 0.426 ' O ' ' O ' ' B' ' 320' ' ' LYS . 13.5 mtmt . . . . . 0 N--CA 1.491 1.578 0 N-CA-C 109.518 -0.549 . . . . 7.5499999999999998 109.518 . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 320' ' ' LYS . . . . . 0.426 ' O ' ' O ' ' B' ' 319' ' ' LYS . 6.0 tttp 60.09 114.35 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.318 -0.864 . . . . 6.4400000000000004 109.513 179.963 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 321' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -158.87 91.94 1.98 Allowed Pre-proline 0 N--CA 1.488 1.455 0 O-C-N 121.222 -0.924 . . . . 6.1299999999999999 109.457 179.978 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 322' ' ' PRO . . . . . . . . . . . . . 2.2 Cg_endo -61.87 -47.3 11.11 Favored 'Trans proline' 0 C--N 1.309 -1.523 0 C-N-CA 122.147 1.898 . . . . 2.8199999999999998 110.004 179.927 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 323' ' ' LEU . . . . . . . . . . . . . 19.8 mt -81.22 96.45 7.25 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.289 -0.882 . . . . 2.8399999999999999 109.472 179.868 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 324' ' ' ASP . . . . . . . . . . . . . 7.3 m-20 -80.36 147.39 31.08 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.211 -0.931 . . . . 1.53 109.264 179.811 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 325' ' ' GLY . . . . . 0.455 ' O ' ' CE2' ' B' ' 327' ' ' TYR . . . -65.55 171.86 24.5 Favored Glycine 0 N--CA 1.49 2.244 0 N-CA-C 109.174 -1.571 . . . . 0.58999999999999997 109.174 179.798 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 326' ' ' GLU . . . . . . . . . . . . . 2.9 mt-10 -57.09 174.54 0.17 Allowed 'General case' 0 N--CA 1.488 1.465 0 O-C-N 121.092 -1.24 . . . . 2.1299999999999999 109.093 179.928 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 327' ' ' TYR . . . . . 0.455 ' CE2' ' O ' ' B' ' 325' ' ' GLY . 47.0 m-85 -148.85 111.41 4.75 Favored 'General case' 0 N--CA 1.488 1.44 0 O-C-N 121.203 -0.935 . . . . 0.47999999999999998 109.531 -179.858 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 328' ' ' PHE . . . . . 0.415 ' CE2' ' HA ' ' D' ' 335' ' ' ARG . 86.3 m-85 -114.01 -168.58 1.37 Allowed 'General case' 0 N--CA 1.489 1.48 0 O-C-N 121.336 -0.852 . . . . 0.32000000000000001 109.53 -179.845 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 329' ' ' THR . . . . . 0.415 ' HA ' ' O ' ' D' ' 330' ' ' LEU . 23.9 p -153.48 165.23 36.51 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.32 -0.862 . . . . 0.23000000000000001 109.146 179.989 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 330' ' ' LEU . . . . . 0.537 HD21 HD22 ' D' ' 345' ' ' ASN . 14.8 tp -151.49 131.26 13.2 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.093 -1.004 . . . . 0.28000000000000003 109.927 -179.739 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 331' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -87.48 120.65 28.99 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.225 -0.922 . . . . 0.91000000000000003 109.166 179.63 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 332' ' ' ILE . . . . . 0.643 HD12 ' CD1' ' B' ' 338' ' ' PHE . 59.7 mt -103.52 111.1 31.96 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.526 0 O-C-N 121.15 -0.969 . . . . 0.23999999999999999 109.722 -179.804 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 333' ' ' ARG . . . . . 0.452 HH11 ' CG ' ' B' ' 333' ' ' ARG . 0.0 OUTLIER -72.53 139.56 47.64 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.254 -0.903 . . . . 2.9300000000000002 109.411 179.852 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 334' ' ' GLY . . . . . . . . . . . . . . . 85.87 136.37 4.08 Favored Glycine 0 N--CA 1.49 2.295 0 N-CA-C 109.655 -1.378 . . . . 0.40000000000000002 109.655 179.861 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 335' ' ' ARG . . . . . 0.5 ' NH1' ' HG3' ' B' ' 335' ' ' ARG . 0.3 OUTLIER -80.03 -36.15 36.2 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.253 -1.145 . . . . 3.0099999999999998 109.579 -179.975 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 336' ' ' GLU . . . . . . . . . . . . . 52.5 tt0 -58.56 -57.21 13.97 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.309 -0.87 . . . . 2.2799999999999998 110.05 -179.719 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 337' ' ' ARG . . . . . 0.54 ' NH1' ' HG3' ' B' ' 337' ' ' ARG . 0.6 OUTLIER -60.04 -30.37 69.14 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.11 -0.994 . . . . 2.9300000000000002 109.826 -179.548 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 338' ' ' PHE . . . . . 0.643 ' CD1' HD12 ' B' ' 332' ' ' ILE . 88.9 t80 -54.4 -62.86 1.38 Allowed 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.222 -0.924 . . . . 0.37 109.833 -179.751 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 339' ' ' GLU . . . . . . . . . . . . . 81.6 mt-10 -51.97 -31.38 28.92 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.235 -0.916 . . . . 1.98 110.178 -179.666 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 340' ' ' MET . . . . . . . . . . . . . 28.3 ttp -63.73 -53.73 46.56 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.091 -1.005 . . . . 0.32000000000000001 110.139 -179.491 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 341' ' ' PHE . . . . . . . . . . . . . 39.3 m-85 -62.19 -48.66 79.05 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.167 -0.958 . . . . 0.17999999999999999 109.978 -179.48 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 342' ' ' ARG . . . . . . . . . . . . . 70.4 ttt180 -48.72 -38.28 21.1 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.2 -0.937 . . . . 2.4199999999999999 109.964 -179.734 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 343' ' ' GLU . . . . . . . . . . . . . 43.0 tt0 -59.63 -49.3 78.3 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.194 -0.941 . . . . 2.3500000000000001 109.967 -179.713 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 344' ' ' LEU . . . . . 0.458 ' CD2' HD22 ' A' ' 344' ' ' LEU . 42.6 mt -61.31 -38.03 85.36 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.205 -0.934 . . . . 0.17999999999999999 109.747 -179.717 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 345' ' ' ASN . . . . . 0.522 HD22 HD21 ' D' ' 330' ' ' LEU . 60.6 t-20 -57.07 -50.15 73.65 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.245 -0.909 . . . . 1.0900000000000001 109.621 -179.879 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 346' ' ' GLU . . . . . . . . . . . . . 2.7 tt0 -60.87 -34.41 74.58 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.224 -0.922 . . . . 1.6599999999999999 109.826 -179.709 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 347' ' ' ALA . . . . . 0.878 ' HB1' ' HB1' ' A' ' 347' ' ' ALA . . . -60.9 -51.56 68.77 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.153 -0.967 . . . . 0.17000000000000001 110.087 -179.693 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 348' ' ' LEU . . . . . 0.541 HD22 ' N ' ' B' ' 348' ' ' LEU . 3.9 mm? -61.41 -44.94 96.27 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.211 -0.931 . . . . 0.28999999999999998 110.049 -179.561 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 349' ' ' GLU . . . . . . . . . . . . . 39.5 mt-10 -58.08 -40.28 80.69 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.224 -0.922 . . . . 1.95 110.378 -179.343 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 350' ' ' LEU . . . . . 0.61 HD23 ' C ' ' B' ' 350' ' ' LEU . 8.5 tt -63.79 -48.21 77.81 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.256 -0.902 . . . . 0.45000000000000001 110.067 -179.411 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 351' ' ' LYS . . . . . . . . . . . . . 25.8 tttt -55.61 -41.83 74.02 Favored 'General case' 0 N--CA 1.488 1.441 0 O-C-N 121.198 -0.939 . . . . 1.3799999999999999 109.27 -179.513 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 352' ' ' ASP . . . . . 0.504 ' OD2' ' NH2' ' D' ' 337' ' ' ARG . 23.3 m-20 -59.27 -48.43 81.66 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.282 -0.886 . . . . 1.1599999999999999 109.828 179.797 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 353' ' ' ALA . . . . . . . . . . . . . . . -67.46 -9.7 44.46 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.241 -0.912 . . . . 0.60999999999999999 110.116 -179.469 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 354' ' ' GLN . . . . . . . . . . . . . 2.3 tt0 -83.92 -28.38 27.9 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.046 -1.034 . . . . 1.45 109.536 -179.824 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 355' ' ' ALA . . . . . . . . . . . . . . . -73.68 -21.33 60.29 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.239 -0.913 . . . . 0.97999999999999998 109.431 179.875 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 356' ' ' GLY . . . . . . . . . . . . . . . -81.84 30.93 2.83 Favored Glycine 0 N--CA 1.493 2.496 0 N-CA-C 110.561 -1.015 . . . . 1.29 110.561 -179.96 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 357' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -87.12 124.95 33.81 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 120.911 -1.347 . . . . 4.0899999999999999 109.487 -179.934 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 358' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -49.96 155.62 1.51 Allowed Pre-proline 0 N--CA 1.491 1.584 0 O-C-N 121.251 -0.906 . . . . 5.7199999999999998 109.393 179.877 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 359' ' ' PRO . . . . . . . . . . . . . 3.1 Cg_exo -61.65 138.57 75.95 Favored 'Trans proline' 0 C--N 1.31 -1.487 0 C-N-CA 122.224 1.949 . . . . 4.9800000000000004 110.298 -179.948 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 360' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.258 0 CA-C-O 117.965 -1.464 . . . . 6.9800000000000004 109.446 179.915 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' C' C ' 319' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.491 1.598 0 CA-C-O 121.297 0.57 . . . . 6.8200000000000003 109.516 . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 320' ' ' LYS . . . . . . . . . . . . . 16.2 mttt 64.16 99.44 0.04 OUTLIER 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.328 -0.858 . . . . 6.4900000000000002 109.543 179.989 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 321' ' ' LYS . . . . . 0.416 ' O ' ' O ' ' C' ' 322' ' ' PRO . 22.0 mtmt -81.64 153.35 70.55 Favored Pre-proline 0 N--CA 1.488 1.463 0 O-C-N 121.168 -0.958 . . . . 6.4000000000000004 109.348 179.862 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' C' C ' 322' ' ' PRO . . . . . 0.416 ' O ' ' O ' ' C' ' 321' ' ' LYS . 6.1 Cg_exo -57.89 -150.56 0.01 OUTLIER 'Trans proline' 0 C--N 1.31 -1.48 0 C-N-CA 122.16 1.907 . . . . 3.4199999999999999 110.101 -179.891 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' C' C ' 323' ' ' LEU . . . . . . . . . . . . . 83.9 mt -78.48 113.39 16.45 Favored 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.087 -1.008 . . . . 3.9500000000000002 109.139 179.92 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 324' ' ' ASP . . . . . . . . . . . . . 43.3 m-20 -78.32 179.5 6.92 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.268 -0.895 . . . . 1.6299999999999999 109.481 -179.698 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 325' ' ' GLY . . . . . . . . . . . . . . . -68.41 171.63 36.45 Favored Glycine 0 N--CA 1.488 2.162 0 N-CA-C 109.363 -1.495 . . . . 0.72999999999999998 109.363 -179.958 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 326' ' ' GLU . . . . . 0.452 ' OE1' ' HB2' ' A' ' 335' ' ' ARG . 1.3 mp0 -57.94 -167.98 0.0 OUTLIER 'General case' 0 N--CA 1.489 1.501 0 O-C-N 121.239 -1.153 . . . . 2.1699999999999999 109.48 -179.98 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' C' C ' 327' ' ' TYR . . . . . . . . . . . . . 51.6 m-85 -149.66 115.03 5.5 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.33 -0.856 . . . . 0.47999999999999998 109.394 -179.916 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 328' ' ' PHE . . . . . 0.464 ' CE1' ' HA ' ' A' ' 335' ' ' ARG . 84.4 m-85 -113.36 -169.77 1.56 Allowed 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.319 -0.863 . . . . 0.33000000000000002 109.562 -179.934 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' C' C ' 329' ' ' THR . . . . . 0.454 ' HA ' ' O ' ' A' ' 330' ' ' LEU . 16.3 p -153.54 162.48 41.22 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.265 -0.897 . . . . 0.23000000000000001 109.463 -179.873 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' C' C ' 330' ' ' LEU . . . . . 0.459 ' O ' ' HA ' ' A' ' 329' ' ' THR . 14.3 tp -150.26 129.78 13.04 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.206 -0.934 . . . . 0.28000000000000003 109.782 -179.725 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' C' C ' 331' ' ' GLN . . . . . . . . . . . . . 4.1 tt0 -89.22 119.4 29.68 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.263 -0.898 . . . . 1.48 109.387 179.568 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 332' ' ' ILE . . . . . 0.474 HG21 ' HA ' ' C' ' 338' ' ' PHE . 21.5 mt -103.67 115.58 45.88 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.576 0 O-C-N 121.101 -1.0 . . . . 0.23999999999999999 109.654 179.811 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' C' C ' 333' ' ' ARG . . . . . 0.565 ' CZ ' ' HB2' ' C' ' 333' ' ' ARG . 5.6 mtm-85 -73.45 151.58 41.05 Favored 'General case' 0 N--CA 1.489 1.493 0 O-C-N 121.348 -0.845 . . . . 2.7400000000000002 109.375 179.788 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' C' C ' 334' ' ' GLY . . . . . . . . . . . . . . . 71.83 129.99 0.1 OUTLIER Glycine 0 N--CA 1.491 2.305 0 N-CA-C 109.737 -1.345 . . . . 0.34999999999999998 109.737 179.798 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 335' ' ' ARG . . . . . 0.454 ' CG ' ' NH1' ' C' ' 335' ' ' ARG . 0.2 OUTLIER -73.98 -31.26 62.9 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.273 -1.133 . . . . 2.5299999999999998 109.358 179.847 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' C' C ' 336' ' ' GLU . . . . . . . . . . . . . 1.7 mp0 -59.22 -57.85 11.21 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.293 -0.88 . . . . 2.6200000000000001 110.216 -179.768 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 337' ' ' ARG . . . . . 0.524 ' HG2' ' NH1' ' C' ' 337' ' ' ARG . 0.0 OUTLIER -59.03 -32.97 70.21 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.241 -0.912 . . . . 2.8100000000000001 109.735 -179.471 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' C' C ' 338' ' ' PHE . . . . . 0.474 ' HA ' HG21 ' C' ' 332' ' ' ILE . 80.8 t80 -54.05 -49.53 68.77 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.224 -0.923 . . . . 0.40000000000000002 109.576 -179.884 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' C' C ' 339' ' ' GLU . . . . . . . . . . . . . 14.5 mt-10 -54.99 -36.67 65.64 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.07 -1.019 . . . . 2.0499999999999998 110.307 -179.849 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 340' ' ' MET . . . . . . . . . . . . . 19.0 ttp -64.6 -57.7 8.38 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.131 -0.981 . . . . 0.32000000000000001 110.861 -178.984 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 341' ' ' PHE . . . . . 0.446 ' CZ ' ' HA ' ' A' ' 345' ' ' ASN . 59.1 m-85 -59.74 -51.44 69.75 Favored 'General case' 0 N--CA 1.493 1.713 0 O-C-N 121.091 -1.005 . . . . 0.17999999999999999 110.246 -178.956 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' C' C ' 342' ' ' ARG . . . . . 0.46 HH11 ' CG ' ' C' ' 342' ' ' ARG . 0.2 OUTLIER -47.21 -45.85 23.58 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.25 -0.906 . . . . 2.9100000000000001 110.217 -179.374 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' C' C ' 343' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -58.84 -43.19 90.66 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.213 -0.929 . . . . 2.1400000000000001 109.968 -179.496 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' C' C ' 344' ' ' LEU . . . . . 0.472 ' CD2' HD22 ' D' ' 344' ' ' LEU . 25.6 mt -62.28 -40.66 96.97 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.093 -1.004 . . . . 0.22 109.823 -179.583 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' C' C ' 345' ' ' ASN . . . . . 0.587 HD22 HD21 ' A' ' 330' ' ' LEU . 51.2 t-20 -55.26 -51.79 65.51 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.238 -0.914 . . . . 1.0800000000000001 109.98 -179.596 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' C' C ' 346' ' ' GLU . . . . . . . . . . . . . 63.1 tt0 -60.14 -31.68 70.31 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.108 -0.995 . . . . 2.21 109.742 -179.602 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 347' ' ' ALA . . . . . 0.793 ' HB1' ' HB1' ' D' ' 347' ' ' ALA . . . -62.7 -48.05 80.95 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.112 -0.993 . . . . 0.17999999999999999 109.879 -179.998 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' C' C ' 348' ' ' LEU . . . . . 0.538 ' N ' HD22 ' C' ' 348' ' ' LEU . 4.3 mm? -62.16 -53.84 49.64 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.209 -0.932 . . . . 0.32000000000000001 110.108 -179.637 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' C' C ' 349' ' ' GLU . . . . . . . . . . . . . 6.6 mm-40 -57.65 -34.06 68.96 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.256 -0.902 . . . . 2.1899999999999999 110.231 -179.097 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 350' ' ' LEU . . . . . 0.725 HD21 HD13 ' D' ' 350' ' ' LEU . 4.2 tt -63.49 -44.04 95.51 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.099 -1.001 . . . . 0.46000000000000002 109.282 -179.817 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' C' C ' 351' ' ' LYS . . . . . 0.541 ' N ' HD23 ' C' ' 350' ' ' LEU . 41.6 tttp -59.9 -34.43 73.18 Favored 'General case' 0 N--CA 1.488 1.454 0 O-C-N 121.342 -0.849 . . . . 1.3500000000000001 109.445 -179.923 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' C' C ' 352' ' ' ASP . . . . . . . . . . . . . 3.2 m-20 -56.52 -45.49 81.09 Favored 'General case' 0 N--CA 1.489 1.499 0 O-C-N 121.241 -0.912 . . . . 1.1899999999999999 109.663 179.978 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 353' ' ' ALA . . . . . . . . . . . . . . . -67.46 -21.01 65.56 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.184 -0.947 . . . . 0.56999999999999995 109.333 -179.971 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 354' ' ' GLN . . . . . 0.468 ' CD ' HD11 ' D' ' 350' ' ' LEU . 2.8 mt-30 -83.05 -10.85 58.51 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.331 -0.856 . . . . 1.47 109.488 179.921 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' C' C ' 355' ' ' ALA . . . . . . . . . . . . . . . -71.03 -82.09 0.04 OUTLIER 'General case' 0 N--CA 1.488 1.449 0 O-C-N 121.33 -0.856 . . . . 0.93000000000000005 109.468 179.891 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 356' ' ' GLY . . . . . . . . . . . . . . . -69.92 94.21 0.43 Allowed Glycine 0 N--CA 1.489 2.211 0 N-CA-C 109.625 -1.39 . . . . 1.3300000000000001 109.625 -179.955 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 357' ' ' LYS . . . . . . . . . . . . . 16.3 mtmm -86.56 136.64 32.99 Favored 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.104 -1.233 . . . . 4.0099999999999998 109.293 179.844 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 358' ' ' GLU . . . . . . . . . . . . . 7.2 tt0 -47.36 108.71 0.93 Allowed Pre-proline 0 N--CA 1.489 1.516 0 O-C-N 121.253 -0.904 . . . . 5.75 109.434 -179.962 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 359' ' ' PRO . . . . . . . . . . . . . 5.2 Cg_exo -59.2 170.26 3.13 Favored 'Trans proline' 0 C--N 1.313 -1.315 0 C-N-CA 121.958 1.772 . . . . 4.9400000000000004 110.242 -179.934 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 360' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 2.385 0 N-CA-C 109.429 -1.469 . . . . 6.5 109.429 -179.937 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' D' D ' 319' ' ' LYS . . . . . 0.421 ' O ' ' O ' ' D' ' 320' ' ' LYS . 13.5 mtmt . . . . . 0 N--CA 1.49 1.56 0 N-CA-C 109.449 -0.575 . . . . 7.5300000000000002 109.449 . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' D' D ' 320' ' ' LYS . . . . . 0.421 ' O ' ' O ' ' D' ' 319' ' ' LYS . 5.8 tttp 60.01 114.45 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.24 -0.912 . . . . 6.4100000000000001 109.526 -179.942 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' D' D ' 321' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -158.88 91.99 1.97 Allowed Pre-proline 0 N--CA 1.49 1.528 0 O-C-N 121.208 -0.933 . . . . 6.1100000000000003 109.508 179.869 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' D' D ' 322' ' ' PRO . . . . . . . . . . . . . 2.1 Cg_endo -61.95 -47.29 10.97 Favored 'Trans proline' 0 C--N 1.309 -1.546 0 C-N-CA 122.108 1.872 . . . . 2.8199999999999998 110.016 179.936 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' D' D ' 323' ' ' LEU . . . . . . . . . . . . . 19.5 mt -81.3 96.53 7.32 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.339 -0.851 . . . . 2.8300000000000001 109.497 179.791 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' D' D ' 324' ' ' ASP . . . . . . . . . . . . . 7.1 m-20 -80.16 148.36 30.95 Favored 'General case' 0 N--CA 1.488 1.467 0 O-C-N 121.244 -0.91 . . . . 1.54 109.194 179.751 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' D' D ' 325' ' ' GLY . . . . . 0.46 ' O ' ' CE2' ' D' ' 327' ' ' TYR . . . -66.85 171.87 30.12 Favored Glycine 0 N--CA 1.49 2.264 0 N-CA-C 109.104 -1.598 . . . . 0.58999999999999997 109.104 179.927 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' D' D ' 326' ' ' GLU . . . . . . . . . . . . . 3.0 mt-10 -56.84 174.43 0.16 Allowed 'General case' 0 N--CA 1.488 1.441 0 O-C-N 121.121 -1.223 . . . . 2.1299999999999999 109.07 -179.966 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' D' D ' 327' ' ' TYR . . . . . 0.46 ' CE2' ' O ' ' D' ' 325' ' ' GLY . 47.1 m-85 -148.79 111.53 4.8 Favored 'General case' 0 C--N 1.303 -1.427 0 O-C-N 121.173 -0.954 . . . . 0.46999999999999997 109.469 -179.818 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' D' D ' 328' ' ' PHE . . . . . 0.413 ' CE2' ' HA ' ' B' ' 335' ' ' ARG . 86.2 m-85 -114.08 -168.64 1.38 Allowed 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.292 -0.88 . . . . 0.29999999999999999 109.561 -179.842 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' D' D ' 329' ' ' THR . . . . . 0.425 ' HA ' ' O ' ' B' ' 330' ' ' LEU . 23.8 p -153.46 165.07 36.98 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.294 -0.879 . . . . 0.22 109.174 179.931 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' D' D ' 330' ' ' LEU . . . . . 0.522 HD21 HD22 ' B' ' 345' ' ' ASN . 14.9 tp -151.43 131.23 13.23 Favored 'General case' 0 N--CA 1.489 1.476 0 O-C-N 121.134 -0.978 . . . . 0.28000000000000003 109.869 -179.768 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' D' D ' 331' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -87.39 120.75 29.0 Favored 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.341 -0.849 . . . . 0.93000000000000005 109.234 179.54 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' D' D ' 332' ' ' ILE . . . . . 0.65 HD12 ' CD1' ' D' ' 338' ' ' PHE . 59.5 mt -103.46 111.26 32.51 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.574 0 O-C-N 121.149 -0.97 . . . . 0.25 109.656 -179.778 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' D' D ' 333' ' ' ARG . . . . . 0.433 ' NH1' ' CG ' ' D' ' 333' ' ' ARG . 0.0 OUTLIER -72.77 139.67 47.24 Favored 'General case' 0 N--CA 1.489 1.49 0 O-C-N 121.334 -0.854 . . . . 2.9300000000000002 109.454 179.778 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' D' D ' 334' ' ' GLY . . . . . . . . . . . . . . . 85.76 136.62 4.1 Favored Glycine 0 N--CA 1.49 2.283 0 N-CA-C 109.658 -1.377 . . . . 0.40999999999999998 109.658 179.925 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' D' D ' 335' ' ' ARG . . . . . 0.5 ' HG3' ' NH1' ' D' ' 335' ' ' ARG . 0.3 OUTLIER -80.13 -36.08 35.8 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.31 -1.112 . . . . 3.0299999999999998 109.623 -179.951 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' D' D ' 336' ' ' GLU . . . . . . . . . . . . . 53.1 tt0 -58.72 -57.14 14.32 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.223 -0.923 . . . . 2.2599999999999998 110.057 -179.666 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' D' D ' 337' ' ' ARG . . . . . 0.546 ' HG3' ' NH1' ' D' ' 337' ' ' ARG . 0.6 OUTLIER -60.07 -30.27 69.11 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.188 -0.945 . . . . 2.9199999999999999 109.862 -179.608 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' D' D ' 338' ' ' PHE . . . . . 0.65 ' CD1' HD12 ' D' ' 332' ' ' ILE . 88.7 t80 -54.43 -62.89 1.36 Allowed 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.209 -0.932 . . . . 0.37 109.769 -179.756 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' D' D ' 339' ' ' GLU . . . . . . . . . . . . . 81.7 mt-10 -51.99 -31.32 28.93 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.279 -0.888 . . . . 1.99 110.155 -179.632 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' D' D ' 340' ' ' MET . . . . . . . . . . . . . 28.2 ttp -63.9 -53.6 47.95 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.101 -0.999 . . . . 0.31 110.098 -179.426 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' D' D ' 341' ' ' PHE . . . . . 0.423 ' CZ ' ' HA ' ' B' ' 345' ' ' ASN . 39.8 m-85 -62.17 -48.83 78.3 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.183 -0.948 . . . . 0.17999999999999999 109.977 -179.532 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' D' D ' 342' ' ' ARG . . . . . . . . . . . . . 70.6 ttt180 -48.6 -38.47 20.87 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.185 -0.947 . . . . 2.4100000000000001 109.827 -179.73 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' D' D ' 343' ' ' GLU . . . . . . . . . . . . . 43.7 tt0 -59.51 -49.29 78.37 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.218 -0.926 . . . . 2.3500000000000001 109.927 -179.609 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' D' D ' 344' ' ' LEU . . . . . 0.472 HD22 ' CD2' ' C' ' 344' ' ' LEU . 43.1 mt -61.26 -38.08 85.46 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.256 -0.902 . . . . 0.19 109.738 -179.659 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' D' D ' 345' ' ' ASN . . . . . 0.537 HD22 HD21 ' B' ' 330' ' ' LEU . 60.6 t-20 -57.09 -50.35 73.06 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.178 -0.951 . . . . 1.0900000000000001 109.61 -179.787 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' D' D ' 346' ' ' GLU . . . . . . . . . . . . . 2.6 tt0 -60.56 -34.52 74.28 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.295 -0.878 . . . . 1.6899999999999999 109.892 -179.774 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' D' D ' 347' ' ' ALA . . . . . 0.793 ' HB1' ' HB1' ' C' ' 347' ' ' ALA . . . -60.85 -51.48 69.12 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.243 -0.911 . . . . 0.17999999999999999 110.07 -179.645 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' D' D ' 348' ' ' LEU . . . . . 0.548 HD22 ' N ' ' D' ' 348' ' ' LEU . 3.9 mm? -61.48 -45.05 95.88 Favored 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.158 -0.964 . . . . 0.31 109.948 -179.446 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' D' D ' 349' ' ' GLU . . . . . . . . . . . . . 39.2 mt-10 -57.91 -40.34 80.12 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.275 -0.891 . . . . 1.95 110.351 -179.327 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' D' D ' 350' ' ' LEU . . . . . 0.725 HD13 HD21 ' C' ' 350' ' ' LEU . 8.6 tt -63.73 -48.11 78.35 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.087 -1.008 . . . . 0.42999999999999999 110.144 -179.369 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' D' D ' 351' ' ' LYS . . . . . . . . . . . . . 25.8 tttt -55.73 -41.8 74.41 Favored 'General case' 0 N--CA 1.488 1.451 0 O-C-N 121.244 -0.91 . . . . 1.3999999999999999 109.291 -179.665 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' D' D ' 352' ' ' ASP . . . . . 0.433 ' OD2' ' NH2' ' B' ' 337' ' ' ARG . 23.5 m-20 -59.36 -48.35 81.96 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.294 -0.879 . . . . 1.1699999999999999 109.806 179.802 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' D' D ' 353' ' ' ALA . . . . . . . . . . . . . . . -67.57 -9.56 43.85 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.22 -0.925 . . . . 0.58999999999999997 110.101 -179.43 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' D' D ' 354' ' ' GLN . . . . . . . . . . . . . 2.3 tt0 -83.95 -28.26 27.94 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.063 -1.023 . . . . 1.4399999999999999 109.532 -179.807 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' D' D ' 355' ' ' ALA . . . . . . . . . . . . . . . -73.79 -21.35 60.19 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.168 -0.957 . . . . 0.97999999999999998 109.485 179.912 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' D' D ' 356' ' ' GLY . . . . . . . . . . . . . . . -81.97 30.97 2.86 Favored Glycine 0 N--CA 1.494 2.53 0 N-CA-C 110.505 -1.038 . . . . 1.28 110.505 -179.92 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' D' D ' 357' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -87.21 124.9 33.8 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 120.86 -1.377 . . . . 4.0899999999999999 109.464 -179.964 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' D' D ' 358' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -49.96 155.49 1.55 Allowed Pre-proline 0 N--CA 1.49 1.543 0 O-C-N 121.228 -0.92 . . . . 5.71 109.41 179.911 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' D' D ' 359' ' ' PRO . . . . . . . . . . . . . 3.1 Cg_exo -61.65 138.79 77.34 Favored 'Trans proline' 0 C--N 1.309 -1.534 0 C-N-CA 122.242 1.961 . . . . 4.9699999999999998 110.31 -179.918 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' D' D ' 360' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.251 0 CA-C-O 117.973 -1.459 . . . . 6.9699999999999998 109.462 179.885 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 319' ' ' LYS . . . . . . . . . . . . . 17.6 mttm . . . . . 0 N--CA 1.49 1.528 0 CA-C-O 121.297 0.57 . . . . 7.5499999999999998 109.581 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 320' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 63.21 78.11 0.3 Allowed 'General case' 0 N--CA 1.488 1.453 0 O-C-N 121.167 -0.958 . . . . 6.4299999999999997 109.833 179.52 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 321' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -158.38 77.6 3.37 Favored Pre-proline 0 C--N 1.302 -1.477 0 O-C-N 121.258 -0.901 . . . . 6.1299999999999999 109.027 179.482 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 322' ' ' PRO . . . . . . . . . . . . . 4.5 Cg_endo -71.95 19.44 0.29 Allowed 'Trans proline' 0 C--N 1.31 -1.466 0 C-N-CA 122.597 2.198 . . . . 2.8300000000000001 111.945 -179.634 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 323' ' ' LEU . . . . . . . . . . . . . 24.3 mt -78.45 91.49 4.52 Favored 'General case' 0 N--CA 1.489 1.491 0 O-C-N 120.582 -1.324 . . . . 2.8300000000000001 109.589 -179.839 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 324' ' ' ASP . . . . . 0.509 ' N ' ' OD1' ' A' ' 324' ' ' ASP . 0.6 OUTLIER -82.58 -150.44 0.09 Allowed 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.355 -0.841 . . . . 1.53 109.814 -179.887 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 325' ' ' GLY . . . . . . . . . . . . . . . -70.11 -159.36 2.55 Favored Glycine 0 N--CA 1.49 2.257 0 N-CA-C 109.732 -1.347 . . . . 0.60999999999999999 109.732 -179.867 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 326' ' ' GLU . . . . . . . . . . . . . 4.0 mm-40 -58.66 -169.14 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.257 -1.143 . . . . 2.1299999999999999 109.378 179.768 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 327' ' ' TYR . . . . . 0.54 ' CE2' ' HG2' ' C' ' 333' ' ' ARG . 40.9 m-85 -148.35 111.05 4.76 Favored 'General case' 0 C--N 1.302 -1.464 0 O-C-N 121.412 -0.805 . . . . 0.47999999999999998 109.553 179.725 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 328' ' ' PHE . . . . . 0.437 ' O ' ' OE1' ' C' ' 331' ' ' GLN . 59.5 m-85 -113.08 -172.75 2.12 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.431 -0.793 . . . . 0.31 109.291 -179.936 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 329' ' ' THR . . . . . . . . . . . . . 60.0 p -152.92 171.74 17.85 Favored 'General case' 0 C--N 1.302 -1.461 0 O-C-N 121.196 -0.94 . . . . 0.22 108.895 179.847 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 330' ' ' LEU . . . . . . . . . . . . . 24.1 tp -151.86 130.17 12.05 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.378 -0.826 . . . . 0.28000000000000003 109.71 -179.721 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 331' ' ' GLN . . . . . . . . . . . . . 1.5 tp60 -87.18 111.96 21.5 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.25 -0.906 . . . . 0.91000000000000003 109.679 179.932 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 332' ' ' ILE . . . . . 0.597 HG21 ' HA ' ' A' ' 338' ' ' PHE . 63.6 mt -103.2 103.1 14.59 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.587 0 O-C-N 121.107 -0.996 . . . . 0.26000000000000001 109.291 179.891 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 333' ' ' ARG . . . . . 0.6 ' HG2' ' CE2' ' C' ' 327' ' ' TYR . 0.0 OUTLIER -72.45 147.58 45.98 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.253 -0.904 . . . . 2.9199999999999999 109.41 -179.879 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 334' ' ' GLY . . . . . . . . . . . . . . . 82.0 130.59 1.3 Allowed Glycine 0 N--CA 1.493 2.436 0 N-CA-C 109.452 -1.459 . . . . 0.40000000000000002 109.452 -179.961 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 335' ' ' ARG . . . . . 0.433 ' HA ' ' CE2' ' C' ' 328' ' ' PHE . 0.2 OUTLIER -76.44 -31.42 57.85 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.133 -1.216 . . . . 3.0099999999999998 110.022 -179.938 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 336' ' ' GLU . . . . . . . . . . . . . 4.8 tp10 -57.45 -62.88 1.47 Allowed 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.048 -1.033 . . . . 2.29 109.667 -179.627 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 337' ' ' ARG . . . . . 0.429 HH11 ' HG3' ' A' ' 337' ' ' ARG . 8.3 mtm-85 -59.99 -31.43 69.91 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.249 -0.907 . . . . 2.9300000000000002 109.508 -179.765 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 338' ' ' PHE . . . . . 0.597 ' HA ' HG21 ' A' ' 332' ' ' ILE . 73.1 t80 -56.35 -56.02 26.23 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.304 -0.872 . . . . 0.38 109.851 -179.97 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 339' ' ' GLU . . . . . . . . . . . . . 93.6 mt-10 -52.74 -37.17 58.87 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.151 -0.968 . . . . 1.97 110.446 -179.568 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 340' ' ' MET . . . . . 0.443 ' SD ' ' OE1' ' D' ' 343' ' ' GLU . 28.2 ttp -63.76 -47.99 78.74 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.024 -1.047 . . . . 0.31 110.162 -179.238 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 341' ' ' PHE . . . . . . . . . . . . . 52.4 m-85 -62.43 -40.41 96.48 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.148 -0.97 . . . . 0.17999999999999999 109.684 -179.515 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 342' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -51.12 -43.68 61.19 Favored 'General case' 0 N--CA 1.488 1.47 0 O-C-N 121.399 -0.813 . . . . 2.4199999999999999 109.823 -179.939 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 343' ' ' GLU . . . . . 0.559 ' OE2' HD11 ' B' ' 348' ' ' LEU . 1.8 tt0 -57.94 -46.84 84.43 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.374 -0.829 . . . . 2.3500000000000001 109.706 -179.646 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 344' ' ' LEU . . . . . . . . . . . . . 41.4 mt -61.59 -33.71 74.36 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.176 -0.953 . . . . 0.17999999999999999 109.247 179.906 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 345' ' ' ASN . . . . . 0.421 ' O ' ' HG3' ' A' ' 349' ' ' GLU . 13.3 t-20 -57.96 -55.68 31.77 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.558 -0.714 . . . . 1.0900000000000001 109.517 179.979 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 346' ' ' GLU . . . . . . . . . . . . . 65.2 tt0 -63.63 -29.28 70.54 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.224 -0.922 . . . . 1.6499999999999999 110.205 -179.756 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 347' ' ' ALA . . . . . 0.85 ' HB1' ' HB1' ' B' ' 347' ' ' ALA . . . -60.85 -61.44 2.58 Favored 'General case' 0 N--CA 1.494 1.759 0 O-C-N 120.983 -1.073 . . . . 0.17999999999999999 109.983 -179.613 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 348' ' ' LEU . . . . . 0.587 HD22 ' N ' ' A' ' 348' ' ' LEU . 3.9 mm? -61.74 -40.47 95.2 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.256 -0.903 . . . . 0.29999999999999999 109.546 -179.789 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 349' ' ' GLU . . . . . 0.421 ' HG3' ' O ' ' A' ' 345' ' ' ASN . 93.4 mt-10 -58.56 -34.13 70.69 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.244 -0.91 . . . . 1.9399999999999999 110.15 -179.446 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 350' ' ' LEU . . . . . 0.804 HD23 ' O ' ' A' ' 350' ' ' LEU . 4.1 tt -65.35 -47.08 77.71 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.179 -0.951 . . . . 0.46000000000000002 109.661 -179.833 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 351' ' ' LYS . . . . . . . . . . . . . 14.4 tttm -58.96 -41.77 88.27 Favored 'General case' 0 N--CA 1.489 1.497 0 O-C-N 121.166 -0.959 . . . . 1.3999999999999999 109.845 -179.453 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 352' ' ' ASP . . . . . . . . . . . . . 48.2 m-20 -53.45 -40.29 65.12 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.035 -1.041 . . . . 1.1599999999999999 109.505 -179.837 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 353' ' ' ALA . . . . . . . . . . . . . . . -67.5 -31.45 71.59 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.161 -0.962 . . . . 0.63 109.727 -179.888 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 354' ' ' GLN . . . . . . . . . . . . . 3.7 tt0 -81.72 2.71 28.54 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.255 -0.903 . . . . 1.47 109.818 -179.767 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 355' ' ' ALA . . . . . 0.488 ' O ' ' N ' ' A' ' 357' ' ' LYS . . . -69.62 -87.27 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.06 -1.025 . . . . 1.01 109.501 179.965 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 356' ' ' GLY . . . . . . . . . . . . . . . -53.98 88.53 0.01 OUTLIER Glycine 0 N--CA 1.491 2.358 0 N-CA-C 109.593 -1.403 . . . . 1.3 109.593 179.923 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 357' ' ' LYS . . . . . 0.488 ' N ' ' O ' ' A' ' 355' ' ' ALA . 0.9 OUTLIER -88.81 18.36 4.83 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.11 -1.229 . . . . 4.0999999999999996 109.552 179.997 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 358' ' ' GLU . . . . . . . . . . . . . 2.4 tt0 -49.27 135.49 16.35 Favored Pre-proline 0 N--CA 1.493 1.709 0 O-C-N 121.189 -0.945 . . . . 5.75 109.432 -179.822 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 359' ' ' PRO . . . . . . . . . . . . . 2.4 Cg_endo -61.94 -154.23 0.02 OUTLIER 'Trans proline' 0 C--N 1.313 -1.314 0 C-N-CA 121.933 1.755 . . . . 5.0 110.184 -179.987 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 360' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.296 0 CA-C-O 117.998 -1.446 . . . . 6.9699999999999998 109.524 179.897 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' B' B ' 319' ' ' LYS . . . . . . . . . . . . . 16.5 mttm . . . . . 0 N--CA 1.49 1.527 0 N-CA-C 109.485 -0.561 . . . . 7.5499999999999998 109.485 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' B' B ' 320' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 62.72 77.58 0.32 Allowed 'General case' 0 C--N 1.304 -1.412 0 O-C-N 121.251 -0.906 . . . . 6.4400000000000004 109.811 179.373 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 321' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -158.11 78.01 3.43 Favored Pre-proline 0 N--CA 1.49 1.54 0 O-C-N 121.394 -0.816 . . . . 6.1299999999999999 109.069 179.607 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 322' ' ' PRO . . . . . . . . . . . . . 5.7 Cg_endo -72.03 19.87 0.29 Allowed 'Trans proline' 0 C--N 1.314 -1.262 0 C-N-CA 122.899 2.399 . . . . 2.8199999999999998 111.957 -179.562 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 323' ' ' LEU . . . . . . . . . . . . . 27.1 mt -78.7 92.18 4.75 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 120.499 -1.375 . . . . 2.8399999999999999 109.43 -179.96 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 324' ' ' ASP . . . . . 0.477 ' N ' ' OD1' ' B' ' 324' ' ' ASP . 0.5 OUTLIER -83.08 -149.19 0.09 Allowed 'General case' 0 N--CA 1.488 1.436 0 O-C-N 121.171 -0.956 . . . . 1.53 109.837 -179.874 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 325' ' ' GLY . . . . . . . . . . . . . . . -71.74 -158.99 3.69 Favored Glycine 0 N--CA 1.49 2.272 0 N-CA-C 109.539 -1.424 . . . . 0.58999999999999997 109.539 -179.829 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 326' ' ' GLU . . . . . . . . . . . . . 3.4 mm-40 -58.52 -169.36 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.173 -1.192 . . . . 2.1299999999999999 109.354 179.911 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 327' ' ' TYR . . . . . 0.541 ' CE2' ' HG2' ' D' ' 333' ' ' ARG . 42.0 m-85 -148.13 111.51 4.96 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.373 -0.829 . . . . 0.47999999999999998 109.446 179.637 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 328' ' ' PHE . . . . . . . . . . . . . 62.8 m-85 -113.08 -173.37 2.24 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.362 -0.836 . . . . 0.32000000000000001 109.243 -179.904 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 329' ' ' THR . . . . . 0.498 ' HA ' ' O ' ' D' ' 330' ' ' LEU . 77.2 p -152.12 170.77 19.14 Favored 'General case' 0 C--N 1.302 -1.479 0 O-C-N 121.348 -0.845 . . . . 0.23000000000000001 109.099 179.824 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 330' ' ' LEU . . . . . 0.457 ' O ' ' HA ' ' D' ' 329' ' ' THR . 28.3 tp -151.13 130.31 12.71 Favored 'General case' 0 C--N 1.303 -1.449 0 O-C-N 121.025 -1.047 . . . . 0.28000000000000003 109.71 -179.661 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 331' ' ' GLN . . . . . . . . . . . . . 1.5 tp60 -87.48 112.28 22.04 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.384 -0.823 . . . . 0.91000000000000003 109.641 -179.891 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 332' ' ' ILE . . . . . 0.607 HG21 ' HA ' ' B' ' 338' ' ' PHE . 63.6 mt -103.49 103.23 14.83 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.478 0 O-C-N 121.118 -0.989 . . . . 0.23999999999999999 109.195 179.834 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 333' ' ' ARG . . . . . 0.535 ' NH1' ' HG2' ' B' ' 333' ' ' ARG . 0.0 OUTLIER -72.69 146.56 46.43 Favored 'General case' 0 N--CA 1.488 1.475 0 O-C-N 121.178 -0.951 . . . . 2.9300000000000002 109.472 -179.924 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 334' ' ' GLY . . . . . . . . . . . . . . . 82.88 130.81 1.57 Allowed Glycine 0 N--CA 1.492 2.428 0 N-CA-C 109.583 -1.407 . . . . 0.40000000000000002 109.583 179.995 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 335' ' ' ARG . . . . . 0.423 HH11 ' HG3' ' B' ' 335' ' ' ARG . 0.2 OUTLIER -76.37 -31.54 58.09 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.35 -1.088 . . . . 3.0099999999999998 109.773 -179.657 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 336' ' ' GLU . . . . . . . . . . . . . 4.8 tp10 -57.01 -63.37 1.23 Allowed 'General case' 0 N--CA 1.488 1.454 0 O-C-N 121.092 -1.005 . . . . 2.2799999999999998 109.881 -179.743 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 337' ' ' ARG . . . . . 0.416 HH11 ' HG3' ' B' ' 337' ' ' ARG . 9.1 mtm-85 -60.1 -31.42 70.02 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.233 -0.917 . . . . 2.9300000000000002 109.686 -179.712 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 338' ' ' PHE . . . . . 0.607 ' HA ' HG21 ' B' ' 332' ' ' ILE . 72.4 t80 -56.37 -55.72 30.06 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.218 -0.926 . . . . 0.37 109.826 -179.903 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 339' ' ' GLU . . . . . . . . . . . . . 94.1 mt-10 -52.96 -37.33 61.05 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.256 -0.903 . . . . 1.98 110.426 -179.265 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 340' ' ' MET . . . . . . . . . . . . . 29.3 ttp -63.57 -47.88 79.7 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.133 -0.98 . . . . 0.32000000000000001 110.041 -179.404 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 341' ' ' PHE . . . . . . . . . . . . . 50.9 m-85 -62.03 -40.95 97.47 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 120.963 -1.086 . . . . 0.17999999999999999 109.818 -179.762 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 342' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -50.7 -43.29 57.66 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.287 -0.883 . . . . 2.4199999999999999 109.904 -179.859 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 343' ' ' GLU . . . . . . . . . . . . . 1.7 tt0 -58.42 -46.5 86.36 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.303 -0.873 . . . . 2.3500000000000001 109.665 -179.518 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 344' ' ' LEU . . . . . . . . . . . . . 39.5 mt -61.57 -33.55 74.07 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.324 -0.86 . . . . 0.17999999999999999 109.07 179.966 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 345' ' ' ASN . . . . . . . . . . . . . 13.0 t-20 -57.88 -56.62 19.61 Favored 'General case' 0 N--CA 1.49 1.525 0 O-C-N 121.413 -0.805 . . . . 1.0900000000000001 109.686 179.999 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 346' ' ' GLU . . . . . . . . . . . . . 61.9 tt0 -63.31 -29.06 70.45 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.239 -0.913 . . . . 1.6599999999999999 110.199 -179.783 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 347' ' ' ALA . . . . . 0.85 ' HB1' ' HB1' ' A' ' 347' ' ' ALA . . . -60.76 -62.07 2.13 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 120.86 -1.15 . . . . 0.17000000000000001 109.922 -179.622 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 348' ' ' LEU . . . . . 0.599 HD22 ' N ' ' B' ' 348' ' ' LEU . 3.9 mm? -61.2 -40.25 93.24 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.076 -1.015 . . . . 0.28999999999999998 109.764 -179.651 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 349' ' ' GLU . . . . . . . . . . . . . 96.9 mt-10 -59.01 -33.97 71.33 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.295 -0.878 . . . . 1.95 110.077 -179.453 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 350' ' ' LEU . . . . . 0.8 HD23 ' O ' ' B' ' 350' ' ' LEU . 4.0 tt -65.2 -47.09 78.11 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.278 -0.889 . . . . 0.45000000000000001 109.641 -179.78 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 351' ' ' LYS . . . . . . . . . . . . . 16.2 tttm -58.77 -41.75 87.34 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.303 -0.873 . . . . 1.3799999999999999 109.788 -179.666 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 352' ' ' ASP . . . . . . . . . . . . . 45.5 m-20 -54.22 -40.1 67.35 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.163 -0.961 . . . . 1.1599999999999999 109.513 -179.667 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 353' ' ' ALA . . . . . . . . . . . . . . . -67.02 -31.66 72.35 Favored 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.266 -0.897 . . . . 0.60999999999999999 109.501 179.928 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 354' ' ' GLN . . . . . . . . . . . . . 3.2 tt0 -82.01 3.45 26.59 Favored 'General case' 0 N--CA 1.488 1.455 0 O-C-N 121.159 -0.963 . . . . 1.45 109.891 -179.906 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 355' ' ' ALA . . . . . 0.476 ' O ' ' N ' ' B' ' 357' ' ' LYS . . . -69.8 -85.95 0.02 OUTLIER 'General case' 0 N--CA 1.489 1.486 0 O-C-N 121.09 -1.006 . . . . 0.97999999999999998 109.552 -179.948 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 356' ' ' GLY . . . . . . . . . . . . . . . -55.25 89.02 0.01 OUTLIER Glycine 0 N--CA 1.491 2.329 0 N-CA-C 109.602 -1.399 . . . . 1.29 109.602 -179.887 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 357' ' ' LYS . . . . . 0.476 ' N ' ' O ' ' B' ' 355' ' ' ALA . 0.5 OUTLIER -89.34 18.36 5.27 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.225 -1.162 . . . . 4.0899999999999999 109.694 179.992 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 358' ' ' GLU . . . . . . . . . . . . . 2.5 tt0 -49.46 137.16 16.82 Favored Pre-proline 0 N--CA 1.489 1.49 0 O-C-N 121.162 -0.961 . . . . 5.7199999999999998 109.444 -179.782 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 359' ' ' PRO . . . . . . . . . . . . . 2.0 Cg_endo -62.64 -153.67 0.02 OUTLIER 'Trans proline' 0 C--N 1.311 -1.399 0 C-N-CA 122.014 1.81 . . . . 4.9800000000000004 110.122 -179.792 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 360' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.334 0 N-CA-C 109.411 -1.476 . . . . 6.9800000000000004 109.411 179.944 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' C' C ' 319' ' ' LYS . . . . . . . . . . . . . 3.2 mttm . . . . . 0 N--CA 1.49 1.553 0 CA-C-O 121.368 0.604 . . . . 6.8200000000000003 109.657 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' C' C ' 320' ' ' LYS . . . . . 0.591 ' CB ' ' HD2' ' C' ' 322' ' ' PRO . 2.9 mtpt 55.37 -179.18 0.04 OUTLIER 'General case' 0 N--CA 1.488 1.472 0 O-C-N 121.316 -0.865 . . . . 6.4900000000000002 110.048 179.406 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' C' C ' 321' ' ' LYS . . . . . 0.711 ' N ' ' CD ' ' C' ' 322' ' ' PRO . 1.9 ptmt -89.18 -23.7 0.28 Allowed Pre-proline 0 N--CA 1.5 2.064 0 N-CA-C 113.844 1.053 . . . . 6.4000000000000004 113.844 -178.781 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' C' C ' 322' ' ' PRO . . . . . 0.711 ' CD ' ' N ' ' C' ' 321' ' ' LYS . 5.6 Cg_exo -60.11 -80.95 0.01 OUTLIER 'Trans proline' 0 C--N 1.323 -0.813 0 C-N-CA 121.009 1.14 . . . . 3.4199999999999999 110.96 -178.766 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' C' C ' 323' ' ' LEU . . . . . . . . . . . . . 20.1 mt -80.35 83.52 6.17 Favored 'General case' 0 N--CA 1.488 1.441 0 O-C-N 120.779 -1.2 . . . . 3.9500000000000002 109.287 -179.692 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 324' ' ' ASP . . . . . 0.425 ' OD1' ' O ' ' C' ' 321' ' ' LYS . 15.3 m-20 -82.76 -170.65 3.1 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.241 -0.912 . . . . 1.6299999999999999 109.943 179.944 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' C' C ' 325' ' ' GLY . . . . . . . . . . . . . . . -73.41 -157.27 4.3 Favored Glycine 0 N--CA 1.491 2.361 0 N-CA-C 110.175 -1.17 . . . . 0.72999999999999998 110.175 -179.971 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 326' ' ' GLU . . . . . 0.481 ' O ' ' CD1' ' C' ' 327' ' ' TYR . 1.7 mm-40 -59.91 -165.41 0.01 OUTLIER 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.503 -0.998 . . . . 2.1699999999999999 109.645 179.999 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' C' C ' 327' ' ' TYR . . . . . 0.6 ' CE2' ' HG2' ' A' ' 333' ' ' ARG . 37.4 m-85 -150.41 113.61 4.87 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.341 -0.849 . . . . 0.47999999999999998 109.678 179.745 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' C' C ' 328' ' ' PHE . . . . . 0.433 ' CE2' ' HA ' ' A' ' 335' ' ' ARG . 96.3 m-85 -113.62 -170.39 1.69 Allowed 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.317 -0.864 . . . . 0.33000000000000002 109.356 179.695 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' C' C ' 329' ' ' THR . . . . . 0.415 HG23 ' O ' ' C' ' 328' ' ' PHE . 12.8 p -153.31 167.17 30.28 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.168 -0.957 . . . . 0.23000000000000001 109.71 -179.748 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' C' C ' 330' ' ' LEU . . . . . . . . . . . . . 56.9 tp -148.57 130.35 15.11 Favored 'General case' 0 N--CA 1.488 1.452 0 O-C-N 121.148 -0.97 . . . . 0.28000000000000003 109.518 -179.97 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 331' ' ' GLN . . . . . 0.437 ' OE1' ' O ' ' A' ' 328' ' ' PHE . 7.4 tp-100 -87.32 111.24 20.87 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.383 -0.823 . . . . 1.48 109.538 -179.922 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' C' C ' 332' ' ' ILE . . . . . 0.664 HG21 ' HA ' ' C' ' 338' ' ' PHE . 31.1 mt -103.7 101.43 12.23 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.624 0 O-C-N 121.009 -1.057 . . . . 0.23999999999999999 109.615 179.858 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' C' C ' 333' ' ' ARG . . . . . 0.54 ' HG2' ' CE2' ' A' ' 327' ' ' TYR . 0.0 OUTLIER -73.67 137.23 43.98 Favored 'General case' 0 N--CA 1.489 1.476 0 O-C-N 121.151 -0.968 . . . . 2.7400000000000002 109.113 179.539 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' C' C ' 334' ' ' GLY . . . . . . . . . . . . . . . 96.33 128.62 5.79 Favored Glycine 0 N--CA 1.488 2.131 0 N-CA-C 109.571 -1.412 . . . . 0.34999999999999998 109.571 -179.985 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 335' ' ' ARG . . . . . 0.436 ' HD3' ' CZ ' ' A' ' 328' ' ' PHE . 3.6 ttp180 -75.87 -36.59 59.49 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.363 -1.081 . . . . 2.5299999999999998 109.309 -179.983 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' C' C ' 336' ' ' GLU . . . . . . . . . . . . . 1.3 mt-10 -58.95 -60.28 4.11 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.218 -0.926 . . . . 2.6200000000000001 109.875 -179.748 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 337' ' ' ARG . . . . . 0.478 ' HA ' ' NE ' ' C' ' 337' ' ' ARG . 10.5 mmm180 -60.04 -35.23 74.66 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.187 -0.946 . . . . 2.8100000000000001 109.678 -179.731 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' C' C ' 338' ' ' PHE . . . . . 0.664 ' HA ' HG21 ' C' ' 332' ' ' ILE . 16.8 t80 -56.44 -48.66 76.56 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.242 -0.911 . . . . 0.40000000000000002 109.803 -179.816 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' C' C ' 339' ' ' GLU . . . . . . . . . . . . . 2.2 mt-10 -53.57 -37.52 63.01 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.056 -1.027 . . . . 2.0499999999999998 110.44 -179.237 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 340' ' ' MET . . . . . . . . . . . . . 32.5 ttp -63.75 -47.32 81.49 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.062 -1.024 . . . . 0.32000000000000001 109.84 -179.485 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 341' ' ' PHE . . . . . . . . . . . . . 56.8 m-85 -61.75 -45.05 95.59 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.1 -1.0 . . . . 0.17999999999999999 109.982 -179.523 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 342' ' ' ARG . . . . . 0.436 HH11 ' CG ' ' C' ' 342' ' ' ARG . 0.0 OUTLIER -50.09 -42.34 50.03 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.255 -0.903 . . . . 2.9100000000000001 109.962 -179.842 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' C' C ' 343' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -59.98 -51.71 68.5 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.262 -0.899 . . . . 2.1400000000000001 110.173 -179.522 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' C' C ' 344' ' ' LEU . . . . . . . . . . . . . 42.1 mt -60.18 -30.99 69.71 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.128 -0.983 . . . . 0.22 109.68 -179.559 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 345' ' ' ASN . . . . . . . . . . . . . 14.3 t-20 -57.84 -56.61 19.69 Favored 'General case' 0 N--CA 1.488 1.428 0 O-C-N 121.242 -0.911 . . . . 1.0800000000000001 109.442 179.93 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 346' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -62.05 -29.27 70.18 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.399 -0.813 . . . . 2.21 109.92 -179.898 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' C' C ' 347' ' ' ALA . . . . . 0.717 ' HB1' ' HB1' ' D' ' 347' ' ' ALA . . . -61.1 -60.33 3.94 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.206 -0.934 . . . . 0.17999999999999999 110.104 -179.695 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' C' C ' 348' ' ' LEU . . . . . 0.547 ' N ' HD22 ' C' ' 348' ' ' LEU . 4.1 mm? -59.4 -48.54 81.26 Favored 'General case' 0 N--CA 1.495 1.795 0 O-C-N 121.017 -1.052 . . . . 0.32000000000000001 109.872 -179.561 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' C' C ' 349' ' ' GLU . . . . . . . . . . . . . 5.3 mm-40 -57.85 -28.66 64.32 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.196 -0.94 . . . . 2.1899999999999999 109.354 -179.845 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 350' ' ' LEU . . . . . 1.041 HD22 HD13 ' D' ' 350' ' ' LEU . 5.2 tt -64.1 -46.53 83.82 Favored 'General case' 0 N--CA 1.489 1.501 0 O-C-N 121.207 -0.933 . . . . 0.46000000000000002 108.928 179.689 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' C' C ' 351' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -59.56 -45.55 91.5 Favored 'General case' 0 N--CA 1.487 1.379 0 O-C-N 121.576 -0.703 . . . . 1.3500000000000001 109.132 179.83 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' C' C ' 352' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -56.86 -32.5 65.89 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.477 -0.764 . . . . 1.1899999999999999 109.417 179.729 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 353' ' ' ALA . . . . . . . . . . . . . . . -66.2 -32.36 73.75 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.27 -0.893 . . . . 0.56999999999999995 109.328 -179.992 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 354' ' ' GLN . . . . . . . . . . . . . 85.1 mt-30 -82.21 -11.92 58.41 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.181 -0.95 . . . . 1.47 108.923 179.324 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 355' ' ' ALA . . . . . . . . . . . . . . . -72.65 -8.18 54.04 Favored 'General case' 0 N--CA 1.489 1.479 0 O-C-N 121.319 -0.863 . . . . 0.93000000000000005 109.538 -179.874 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 356' ' ' GLY . . . . . . . . . . . . . . . -70.46 -55.17 9.03 Favored Glycine 0 N--CA 1.49 2.282 0 N-CA-C 109.336 -1.506 . . . . 1.3300000000000001 109.336 -179.84 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 357' ' ' LYS . . . . . . . . . . . . . 2.2 mttt -85.4 98.99 10.89 Favored 'General case' 0 C--N 1.304 -1.397 0 O-C-N 121.335 -1.097 . . . . 4.0099999999999998 109.115 -179.953 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 358' ' ' GLU . . . . . 0.406 ' HA ' ' HD3' ' C' ' 359' ' ' PRO . 0.6 OUTLIER -46.07 132.7 7.2 Favored Pre-proline 0 N--CA 1.49 1.541 0 O-C-N 121.317 -0.864 . . . . 5.75 109.526 -179.705 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' C' C ' 359' ' ' PRO . . . . . 0.406 ' HD3' ' HA ' ' C' ' 358' ' ' GLU . 2.3 Cg_endo -63.79 94.04 0.18 Allowed 'Trans proline' 0 C--N 1.311 -1.442 0 C-N-CA 121.997 1.798 . . . . 4.9400000000000004 110.206 179.999 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' C' C ' 360' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.207 0 CA-C-O 118.094 -1.392 . . . . 6.5 109.65 -179.913 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' D' D ' 319' ' ' LYS . . . . . . . . . . . . . 14.7 mttm . . . . . 0 N--CA 1.491 1.62 0 CA-C-O 121.235 0.54 . . . . 7.5300000000000002 109.735 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' D' D ' 320' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 61.86 79.33 0.26 Allowed 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.242 -0.911 . . . . 6.4100000000000001 109.642 179.648 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' D' D ' 321' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -158.97 78.54 3.01 Favored Pre-proline 0 C--N 1.301 -1.518 0 O-C-N 121.334 -0.854 . . . . 6.1100000000000003 108.769 179.734 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' D' D ' 322' ' ' PRO . . . . . . . . . . . . . 5.7 Cg_endo -72.52 20.97 0.3 Allowed 'Trans proline' 0 C--N 1.309 -1.529 0 C-N-CA 122.838 2.359 . . . . 2.8199999999999998 111.707 -179.454 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' D' D ' 323' ' ' LEU . . . . . . . . . . . . . 30.1 mt -79.41 92.27 5.2 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 120.511 -1.368 . . . . 2.8300000000000001 109.333 -179.876 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' D' D ' 324' ' ' ASP . . . . . 0.474 ' N ' ' OD1' ' D' ' 324' ' ' ASP . 0.5 OUTLIER -83.82 -150.78 0.11 Allowed 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.291 -0.88 . . . . 1.54 109.69 -179.898 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' D' D ' 325' ' ' GLY . . . . . . . . . . . . . . . -69.98 -159.68 2.58 Favored Glycine 0 N--CA 1.489 2.217 0 N-CA-C 109.79 -1.324 . . . . 0.58999999999999997 109.79 -179.896 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' D' D ' 326' ' ' GLU . . . . . . . . . . . . . 3.1 mm-40 -58.33 -169.29 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.306 -1.114 . . . . 2.1299999999999999 109.428 -179.974 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' D' D ' 327' ' ' TYR . . . . . 0.453 ' CE2' ' HG2' ' B' ' 333' ' ' ARG . 42.6 m-85 -148.54 112.09 5.03 Favored 'General case' 0 N--CA 1.488 1.453 0 O-C-N 121.409 -0.807 . . . . 0.46999999999999997 109.267 179.675 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' D' D ' 328' ' ' PHE . . . . . . . . . . . . . 58.0 m-85 -113.6 -173.25 2.23 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.533 -0.73 . . . . 0.29999999999999999 109.281 -179.901 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' D' D ' 329' ' ' THR . . . . . 0.457 ' HA ' ' O ' ' B' ' 330' ' ' LEU . 76.5 p -152.28 170.57 19.72 Favored 'General case' 0 N--CA 1.488 1.472 0 O-C-N 121.276 -0.89 . . . . 0.22 109.004 -179.938 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' D' D ' 330' ' ' LEU . . . . . 0.498 ' O ' ' HA ' ' B' ' 329' ' ' THR . 32.2 tp -150.65 130.65 13.41 Favored 'General case' 0 C--N 1.302 -1.463 0 O-C-N 121.068 -1.02 . . . . 0.28000000000000003 109.522 -179.901 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' D' D ' 331' ' ' GLN . . . . . . . . . . . . . 1.5 tp60 -87.83 112.27 22.29 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.263 -0.898 . . . . 0.93000000000000005 109.545 179.968 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' D' D ' 332' ' ' ILE . . . . . 0.611 HG21 ' HA ' ' D' ' 338' ' ' PHE . 64.4 mt -103.33 102.85 14.25 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.45 0 O-C-N 121.217 -0.927 . . . . 0.25 109.415 179.835 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' D' D ' 333' ' ' ARG . . . . . 0.541 ' HG2' ' CE2' ' B' ' 327' ' ' TYR . 0.0 OUTLIER -72.33 144.42 48.31 Favored 'General case' 0 N--CA 1.488 1.463 0 O-C-N 121.361 -0.837 . . . . 2.9300000000000002 109.724 -179.981 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' D' D ' 334' ' ' GLY . . . . . . . . . . . . . . . 84.75 130.98 2.21 Favored Glycine 0 N--CA 1.492 2.398 0 N-CA-C 109.605 -1.398 . . . . 0.40999999999999998 109.605 179.933 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' D' D ' 335' ' ' ARG . . . . . 0.445 HH11 ' HG3' ' D' ' 335' ' ' ARG . 0.2 OUTLIER -76.47 -31.79 57.99 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.291 -1.123 . . . . 3.0299999999999998 109.873 -179.93 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' D' D ' 336' ' ' GLU . . . . . . . . . . . . . 4.5 tp10 -57.13 -62.95 1.4 Allowed 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.107 -0.996 . . . . 2.2599999999999998 109.651 -179.635 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' D' D ' 337' ' ' ARG . . . . . 0.418 HH11 ' HG3' ' D' ' 337' ' ' ARG . 7.9 mtm-85 -60.23 -31.93 70.64 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.353 -0.842 . . . . 2.9199999999999999 109.732 -179.824 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' D' D ' 338' ' ' PHE . . . . . 0.611 ' HA ' HG21 ' D' ' 332' ' ' ILE . 72.2 t80 -56.47 -55.74 29.92 Favored 'General case' 0 C--N 1.302 -1.459 0 O-C-N 121.132 -0.98 . . . . 0.37 109.992 -179.858 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' D' D ' 339' ' ' GLU . . . . . . . . . . . . . 96.5 mt-10 -52.16 -37.97 56.18 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.291 -0.881 . . . . 1.99 110.335 -179.399 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' D' D ' 340' ' ' MET . . . . . 0.457 ' SD ' ' OE1' ' A' ' 343' ' ' GLU . 28.3 ttp -62.84 -47.95 81.18 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.208 -0.932 . . . . 0.31 110.199 -179.292 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' D' D ' 341' ' ' PHE . . . . . . . . . . . . . 50.3 m-85 -62.69 -40.75 98.1 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.195 -0.941 . . . . 0.17999999999999999 109.747 -179.755 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' D' D ' 342' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -50.86 -43.38 59.4 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.219 -0.925 . . . . 2.4100000000000001 109.926 -179.882 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' D' D ' 343' ' ' GLU . . . . . 0.479 ' OE2' HD11 ' C' ' 348' ' ' LEU . 1.6 tt0 -58.14 -46.87 84.9 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.378 -0.826 . . . . 2.3500000000000001 109.672 -179.618 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' D' D ' 344' ' ' LEU . . . . . . . . . . . . . 34.5 mt -61.35 -33.15 73.16 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.14 -0.975 . . . . 0.19 109.176 179.96 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' D' D ' 345' ' ' ASN . . . . . . . . . . . . . 12.2 t-20 -57.99 -56.31 23.62 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.449 -0.782 . . . . 1.0900000000000001 109.723 179.972 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' D' D ' 346' ' ' GLU . . . . . . . . . . . . . 56.8 tt0 -63.63 -28.6 70.03 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.163 -0.96 . . . . 1.6899999999999999 110.161 -179.518 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' D' D ' 347' ' ' ALA . . . . . 0.717 ' HB1' ' HB1' ' C' ' 347' ' ' ALA . . . -61.16 -61.65 2.41 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.051 -1.031 . . . . 0.17999999999999999 109.846 -179.674 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' D' D ' 348' ' ' LEU . . . . . 0.589 HD22 ' N ' ' D' ' 348' ' ' LEU . 3.9 mm? -61.74 -40.9 96.73 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.17 -0.956 . . . . 0.31 109.896 -179.695 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' D' D ' 349' ' ' GLU . . . . . . . . . . . . . 96.8 mt-10 -58.49 -34.39 70.87 Favored 'General case' 0 N--CA 1.495 1.787 0 O-C-N 121.281 -0.887 . . . . 1.95 109.895 -179.737 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' D' D ' 350' ' ' LEU . . . . . 1.041 HD13 HD22 ' C' ' 350' ' ' LEU . 3.8 tt -64.75 -46.84 80.48 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.229 -0.919 . . . . 0.42999999999999999 109.672 -179.688 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' D' D ' 351' ' ' LYS . . . . . . . . . . . . . 18.6 tttm -59.08 -41.97 89.3 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.317 -0.864 . . . . 1.3999999999999999 109.987 -179.641 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' D' D ' 352' ' ' ASP . . . . . . . . . . . . . 38.3 m-20 -53.83 -39.67 65.77 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.155 -0.966 . . . . 1.1699999999999999 109.42 179.921 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' D' D ' 353' ' ' ALA . . . . . . . . . . . . . . . -67.24 -31.97 72.69 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.217 -0.927 . . . . 0.58999999999999997 109.586 -179.995 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' D' D ' 354' ' ' GLN . . . . . . . . . . . . . 3.5 tt0 -82.1 3.64 26.18 Favored 'General case' 0 N--CA 1.488 1.463 0 O-C-N 121.209 -0.932 . . . . 1.4399999999999999 109.667 -179.862 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' D' D ' 355' ' ' ALA . . . . . 0.471 ' O ' ' N ' ' D' ' 357' ' ' LYS . . . -69.48 -86.22 0.02 OUTLIER 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.176 -0.952 . . . . 0.97999999999999998 109.597 179.946 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' D' D ' 356' ' ' GLY . . . . . . . . . . . . . . . -55.68 88.63 0.01 OUTLIER Glycine 0 N--CA 1.491 2.364 0 N-CA-C 109.518 -1.433 . . . . 1.28 109.518 -179.881 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' D' D ' 357' ' ' LYS . . . . . 0.471 ' N ' ' O ' ' D' ' 355' ' ' ALA . 0.1 OUTLIER -89.14 18.86 4.63 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.218 -1.166 . . . . 4.0899999999999999 109.688 -179.996 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' D' D ' 358' ' ' GLU . . . . . . . . . . . . . 2.3 tt0 -49.51 137.83 16.55 Favored Pre-proline 0 N--CA 1.49 1.567 0 O-C-N 121.226 -0.921 . . . . 5.71 109.343 -179.92 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' D' D ' 359' ' ' PRO . . . . . . . . . . . . . 2.1 Cg_endo -63.02 -153.84 0.02 OUTLIER 'Trans proline' 0 C--N 1.311 -1.405 0 C-N-CA 122.068 1.845 . . . . 4.9699999999999998 110.091 -179.982 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' D' D ' 360' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.3 0 N-CA-C 109.298 -1.521 . . . . 6.9699999999999998 109.298 179.868 . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 319' ' ' LYS . . . . . . . . . . . . . 64.2 mttt . . . . . 0 N--CA 1.489 1.498 0 N-CA-C 109.168 -0.679 . . . . 7.5499999999999998 109.168 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 320' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 55.66 73.31 0.43 Allowed 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.234 -0.916 . . . . 6.4299999999999997 109.091 -179.657 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 321' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -81.94 126.98 73.78 Favored Pre-proline 0 N--CA 1.49 1.566 0 O-C-N 121.415 -0.803 . . . . 6.1299999999999999 109.383 -179.844 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 322' ' ' PRO . . . . . . . . . . . . . 1.3 Cg_endo -64.12 -80.97 0.01 OUTLIER 'Trans proline' 0 C--N 1.31 -1.455 0 C-N-CA 122.026 1.817 . . . . 2.8300000000000001 110.295 179.837 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 323' ' ' LEU . . . . . 0.456 HD23 ' HA ' ' A' ' 323' ' ' LEU . 61.1 mt -79.72 102.05 8.78 Favored 'General case' 0 N--CA 1.488 1.445 0 O-C-N 121.338 -0.851 . . . . 2.8300000000000001 109.832 -179.324 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 324' ' ' ASP . . . . . . . . . . . . . 5.7 m-20 -81.44 -152.43 0.09 Allowed 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.184 -0.948 . . . . 1.53 109.285 179.683 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 325' ' ' GLY . . . . . . . . . . . . . . . -68.58 -178.93 17.92 Favored Glycine 0 N--CA 1.49 2.251 0 N-CA-C 109.422 -1.471 . . . . 0.60999999999999999 109.422 179.76 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 326' ' ' GLU . . . . . . . . . . . . . 2.8 mt-10 -59.62 176.2 0.29 Allowed 'General case' 0 N--CA 1.488 1.454 0 O-C-N 121.163 -1.198 . . . . 2.1299999999999999 109.397 -179.986 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 327' ' ' TYR . . . . . 0.535 ' CE1' ' HG2' ' C' ' 333' ' ' ARG . 41.0 m-85 -150.54 112.68 4.6 Favored 'General case' 0 C--N 1.303 -1.449 0 O-C-N 121.071 -1.018 . . . . 0.47999999999999998 109.56 179.753 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 328' ' ' PHE . . . . . 0.416 ' HB2' ' CD1' ' C' ' 338' ' ' PHE . 69.6 m-85 -112.99 -171.53 1.88 Allowed 'General case' 0 N--CA 1.488 1.475 0 O-C-N 121.386 -0.821 . . . . 0.31 109.083 179.952 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 329' ' ' THR . . . . . . . . . . . . . 35.3 p -152.39 168.88 24.04 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.254 -0.904 . . . . 0.22 109.387 179.908 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 330' ' ' LEU . . . . . 0.463 ' O ' ' HA ' ' C' ' 329' ' ' THR . 23.3 tp -152.15 132.54 13.75 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.207 -0.933 . . . . 0.28000000000000003 109.679 -179.71 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 331' ' ' GLN . . . . . 0.42 ' OE1' ' O ' ' C' ' 328' ' ' PHE . 9.2 tp-100 -87.05 114.09 23.36 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.15 -0.969 . . . . 0.91000000000000003 109.325 179.692 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 332' ' ' ILE . . . . . 0.758 HG21 ' HA ' ' A' ' 338' ' ' PHE . 57.9 mt -103.96 103.9 15.92 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.59 0 O-C-N 121.22 -0.925 . . . . 0.26000000000000001 109.97 -179.572 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 333' ' ' ARG . . . . . 0.488 ' HG3' ' CD2' ' C' ' 327' ' ' TYR . 5.5 mpt_? -74.19 150.96 40.1 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.191 -0.943 . . . . 2.9199999999999999 109.508 179.477 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 334' ' ' GLY . . . . . . . . . . . . . . . 74.39 131.25 0.22 Allowed Glycine 0 N--CA 1.491 2.349 0 N-CA-C 109.902 -1.279 . . . . 0.40000000000000002 109.902 179.519 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 335' ' ' ARG . . . . . 0.494 ' NH1' ' HG2' ' A' ' 335' ' ' ARG . 1.9 ttt-85 -79.39 -27.96 41.86 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.47 -1.018 . . . . 3.0099999999999998 109.585 179.976 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 336' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -58.13 -66.95 0.4 Allowed 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.344 -0.847 . . . . 2.29 109.781 -179.953 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 337' ' ' ARG . . . . . 0.48 ' NH2' ' OD1' ' C' ' 352' ' ' ASP . 3.0 mtt180 -60.17 -29.57 68.77 Favored 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.091 -1.006 . . . . 2.9300000000000002 109.456 -179.817 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 338' ' ' PHE . . . . . 0.758 ' HA ' HG21 ' A' ' 332' ' ' ILE . 54.9 t80 -55.56 -60.09 3.92 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.129 -0.982 . . . . 0.38 109.802 -179.901 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 339' ' ' GLU . . . . . . . . . . . . . 1.6 mm-40 -50.41 -34.88 26.06 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.291 -0.881 . . . . 1.97 109.701 -179.609 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 340' ' ' MET . . . . . . . . . . . . . 41.8 ttp -63.3 -48.4 78.23 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.155 -0.966 . . . . 0.31 109.751 -179.83 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 341' ' ' PHE . . . . . . . . . . . . . 44.6 m-85 -62.21 -53.15 59.39 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.213 -0.929 . . . . 0.17999999999999999 109.704 -179.956 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 342' ' ' ARG . . . . . 0.458 ' CG ' ' NH1' ' A' ' 342' ' ' ARG . 0.0 OUTLIER -45.68 -41.27 10.24 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.351 -0.843 . . . . 2.4199999999999999 109.832 -179.881 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 343' ' ' GLU . . . . . . . . . . . . . 8.8 tp10 -59.37 -46.65 88.07 Favored 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.2 -0.937 . . . . 2.3500000000000001 109.661 -179.816 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 344' ' ' LEU . . . . . 0.681 HD22 HD22 ' B' ' 344' ' ' LEU . 56.9 mt -62.06 -44.49 96.58 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.153 -0.967 . . . . 0.17999999999999999 110.112 -179.586 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 345' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -55.68 -43.15 76.09 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.176 -0.953 . . . . 1.0900000000000001 109.626 -179.625 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 346' ' ' GLU . . . . . . . . . . . . . 43.4 tt0 -61.13 -38.69 87.25 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.085 -1.009 . . . . 1.6499999999999999 109.362 -179.921 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 347' ' ' ALA . . . . . 1.003 ' HB1' ' HB1' ' B' ' 347' ' ' ALA . . . -60.03 -50.27 74.39 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.305 -0.872 . . . . 0.17999999999999999 109.898 -179.758 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 348' ' ' LEU . . . . . 0.559 HD22 ' N ' ' A' ' 348' ' ' LEU . 3.9 mm? -61.05 -47.3 86.99 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.235 -0.916 . . . . 0.29999999999999999 110.065 -179.413 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 349' ' ' GLU . . . . . . . . . . . . . 1.6 mm-40 -57.54 -36.27 71.4 Favored 'General case' 0 N--CA 1.489 1.485 0 O-C-N 121.213 -0.929 . . . . 1.9399999999999999 109.821 -179.347 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 350' ' ' LEU . . . . . 0.696 HD13 HD22 ' B' ' 350' ' ' LEU . 5.2 tt -62.07 -44.71 96.09 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.13 -0.981 . . . . 0.46000000000000002 109.073 -179.992 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 351' ' ' LYS . . . . . . . . . . . . . 26.1 tttp -58.21 -44.83 88.35 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.31 -0.869 . . . . 1.3999999999999999 109.239 179.762 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 352' ' ' ASP . . . . . . . . . . . . . 5.4 m-20 -56.46 -41.16 76.03 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.256 -0.903 . . . . 1.1599999999999999 109.461 179.893 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 353' ' ' ALA . . . . . . . . . . . . . . . -67.45 -32.83 73.95 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.35 -0.844 . . . . 0.63 109.32 -179.963 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 354' ' ' GLN . . . . . . . . . . . . . 44.9 tt0 -81.42 6.16 15.42 Favored 'General case' 0 N--CA 1.489 1.489 0 O-C-N 121.179 -0.951 . . . . 1.47 109.167 179.693 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 355' ' ' ALA . . . . . 0.446 ' O ' ' HE3' ' A' ' 357' ' ' LYS . . . -69.2 -91.0 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.048 -1.033 . . . . 1.01 109.626 -179.807 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 356' ' ' GLY . . . . . . . . . . . . . . . -74.41 105.58 1.88 Allowed Glycine 0 N--CA 1.493 2.457 0 N-CA-C 109.96 -1.256 . . . . 1.3 109.96 -179.688 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 357' ' ' LYS . . . . . 0.446 ' HE3' ' O ' ' A' ' 355' ' ' ALA . 0.0 OUTLIER -88.77 136.74 32.85 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.174 -1.192 . . . . 4.0999999999999996 109.318 179.825 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 358' ' ' GLU . . . . . 0.573 ' CB ' ' HD3' ' A' ' 359' ' ' PRO . 3.0 mt-10 -52.5 -57.23 16.45 Favored Pre-proline 0 N--CA 1.489 1.513 0 O-C-N 121.097 -1.002 . . . . 5.75 109.751 179.896 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 359' ' ' PRO . . . . . 0.573 ' HD3' ' CB ' ' A' ' 358' ' ' GLU . 2.3 Cg_endo -61.38 112.79 1.53 Allowed 'Trans proline' 0 C--N 1.312 -1.355 0 C-N-CA 121.937 1.758 . . . . 5.0 110.343 -179.989 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 360' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.345 0 N-CA-C 109.613 -1.395 . . . . 6.9699999999999998 109.613 179.899 . . . . . . . . 0 0 . 1 . 011 nuclear build full ' B' B ' 319' ' ' LYS . . . . . . . . . . . . . 60.6 mttt . . . . . 0 N--CA 1.488 1.474 0 N-CA-C 109.456 -0.572 . . . . 7.5499999999999998 109.456 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' B' B ' 320' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 55.58 71.97 0.51 Allowed 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.197 -0.939 . . . . 6.4400000000000004 109.365 179.982 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 321' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -80.65 127.49 75.23 Favored Pre-proline 0 N--CA 1.49 1.54 0 O-C-N 121.525 -0.734 . . . . 6.1299999999999999 109.531 -179.881 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 322' ' ' PRO . . . . . . . . . . . . . 1.0 OUTLIER -64.86 -80.99 0.01 OUTLIER 'Trans proline' 0 C--N 1.313 -1.314 0 C-N-CA 122.082 1.855 . . . . 2.8199999999999998 110.232 179.935 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 323' ' ' LEU . . . . . 0.466 HD23 ' HA ' ' B' ' 323' ' ' LEU . 63.3 mt -79.76 101.35 8.41 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.215 -0.928 . . . . 2.8399999999999999 109.923 -179.494 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 324' ' ' ASP . . . . . . . . . . . . . 5.6 m-20 -80.43 -154.25 0.1 Allowed 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.26 -0.9 . . . . 1.53 109.368 179.511 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 325' ' ' GLY . . . . . . . . . . . . . . . -67.46 -179.21 13.25 Favored Glycine 0 N--CA 1.492 2.373 0 N-CA-C 109.417 -1.473 . . . . 0.58999999999999997 109.417 179.769 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 326' ' ' GLU . . . . . . . . . . . . . 2.7 mt-10 -59.52 176.02 0.3 Allowed 'General case' 0 N--CA 1.489 1.489 0 O-C-N 121.147 -1.207 . . . . 2.1299999999999999 109.631 -179.923 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 327' ' ' TYR . . . . . . . . . . . . . 41.3 m-85 -149.91 112.65 4.78 Favored 'General case' 0 N--CA 1.489 1.491 0 O-C-N 121.089 -1.007 . . . . 0.47999999999999998 109.635 179.751 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 328' ' ' PHE . . . . . 0.446 ' O ' ' OE1' ' D' ' 331' ' ' GLN . 67.7 m-85 -113.57 -172.75 2.13 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.439 -0.788 . . . . 0.32000000000000001 109.244 179.879 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 329' ' ' THR . . . . . . . . . . . . . 37.1 p -151.81 168.95 23.48 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.134 -0.979 . . . . 0.23000000000000001 109.515 -179.799 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 330' ' ' LEU . . . . . . . . . . . . . 20.8 tp -152.29 132.66 13.71 Favored 'General case' 0 C--N 1.304 -1.398 0 O-C-N 121.039 -1.038 . . . . 0.28000000000000003 109.532 -179.726 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 331' ' ' GLN . . . . . . . . . . . . . 9.0 tp-100 -87.03 114.01 23.27 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.33 -0.856 . . . . 0.91000000000000003 109.354 179.727 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 332' ' ' ILE . . . . . 0.753 HG21 ' HA ' ' B' ' 338' ' ' PHE . 57.4 mt -103.94 103.54 15.37 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.633 0 O-C-N 121.151 -0.968 . . . . 0.23999999999999999 110.11 -179.598 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 333' ' ' ARG . . . . . 0.494 ' CG ' ' CE1' ' D' ' 327' ' ' TYR . 5.7 mpt_? -73.65 150.8 41.07 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.193 -0.942 . . . . 2.9300000000000002 109.399 179.798 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 334' ' ' GLY . . . . . . . . . . . . . . . 74.8 131.07 0.24 Allowed Glycine 0 N--CA 1.49 2.264 0 N-CA-C 109.857 -1.297 . . . . 0.40000000000000002 109.857 179.417 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 335' ' ' ARG . . . . . 0.507 ' NH1' ' HG2' ' B' ' 335' ' ' ARG . 1.9 ttt-85 -79.46 -27.48 41.6 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.442 -1.034 . . . . 3.0099999999999998 109.605 -179.976 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 336' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -58.42 -66.84 0.42 Allowed 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.341 -0.849 . . . . 2.2799999999999998 109.63 -179.902 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 337' ' ' ARG . . . . . . . . . . . . . 3.0 mtt180 -60.23 -29.4 68.73 Favored 'General case' 0 N--CA 1.489 1.492 0 O-C-N 121.202 -0.936 . . . . 2.9300000000000002 109.653 -179.841 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 338' ' ' PHE . . . . . 0.753 ' HA ' HG21 ' B' ' 332' ' ' ILE . 58.5 t80 -55.53 -60.0 4.04 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.257 -0.902 . . . . 0.37 109.872 -179.877 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 339' ' ' GLU . . . . . . . . . . . . . 1.9 mm-40 -50.66 -35.16 29.38 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.347 -0.845 . . . . 1.98 109.687 -179.615 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 340' ' ' MET . . . . . . . . . . . . . 43.4 ttp -63.19 -48.49 78.14 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.164 -0.96 . . . . 0.32000000000000001 109.722 -179.702 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 341' ' ' PHE . . . . . . . . . . . . . 45.4 m-85 -62.56 -52.31 63.91 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.124 -0.985 . . . . 0.17999999999999999 109.81 179.933 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 342' ' ' ARG . . . . . 0.439 ' CG ' HH11 ' B' ' 342' ' ' ARG . 0.0 OUTLIER -46.26 -40.98 12.4 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.266 -0.896 . . . . 2.4199999999999999 109.693 -179.803 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' B' B ' 343' ' ' GLU . . . . . . . . . . . . . 8.9 tp10 -59.52 -46.47 88.75 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.255 -0.903 . . . . 2.3500000000000001 109.611 -179.816 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 344' ' ' LEU . . . . . 0.681 HD22 HD22 ' A' ' 344' ' ' LEU . 57.7 mt -62.18 -44.88 95.62 Favored 'General case' 0 N--CA 1.49 1.525 0 O-C-N 121.177 -0.952 . . . . 0.17999999999999999 110.219 -179.608 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 345' ' ' ASN . . . . . 0.535 HD22 HD11 ' D' ' 330' ' ' LEU . 43.1 t-20 -55.59 -42.64 75.08 Favored 'General case' 0 N--CA 1.489 1.476 0 O-C-N 121.177 -0.952 . . . . 1.0900000000000001 109.694 -179.532 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 346' ' ' GLU . . . . . . . . . . . . . 40.9 tt0 -61.06 -39.02 88.28 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.251 -0.905 . . . . 1.6599999999999999 109.391 -179.894 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 347' ' ' ALA . . . . . 1.003 ' HB1' ' HB1' ' A' ' 347' ' ' ALA . . . -60.21 -50.17 74.71 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.324 -0.86 . . . . 0.17000000000000001 109.964 -179.857 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 348' ' ' LEU . . . . . 0.56 HD22 ' N ' ' B' ' 348' ' ' LEU . 3.9 mm? -60.81 -47.53 85.91 Favored 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.285 -0.884 . . . . 0.28999999999999998 109.973 -179.369 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 349' ' ' GLU . . . . . . . . . . . . . 1.5 mm-40 -57.65 -35.56 70.69 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.222 -0.923 . . . . 1.95 109.983 -179.574 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 350' ' ' LEU . . . . . 0.696 HD22 HD13 ' A' ' 350' ' ' LEU . 5.2 tt -62.67 -44.69 95.6 Favored 'General case' 0 N--CA 1.489 1.505 0 O-C-N 120.968 -1.083 . . . . 0.45000000000000001 108.999 179.799 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 351' ' ' LYS . . . . . . . . . . . . . 28.2 tttp -58.82 -44.69 90.9 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.195 -0.941 . . . . 1.3799999999999999 109.428 179.647 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 352' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 -56.44 -41.85 77.15 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.261 -0.899 . . . . 1.1599999999999999 109.286 179.659 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 353' ' ' ALA . . . . . . . . . . . . . . . -66.63 -32.77 74.31 Favored 'General case' 0 N--CA 1.494 1.749 0 O-C-N 121.27 -0.894 . . . . 0.60999999999999999 109.47 179.656 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 354' ' ' GLN . . . . . . . . . . . . . 45.7 tt0 -80.96 5.26 16.83 Favored 'General case' 0 C--N 1.304 -1.387 0 O-C-N 121.222 -0.924 . . . . 1.45 109.38 179.951 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 355' ' ' ALA . . . . . 0.434 ' O ' ' HE3' ' B' ' 357' ' ' LYS . . . -68.96 -91.61 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.102 -0.999 . . . . 0.97999999999999998 109.851 -179.698 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 356' ' ' GLY . . . . . . . . . . . . . . . -72.89 105.0 1.65 Allowed Glycine 0 N--CA 1.49 2.25 0 N-CA-C 109.911 -1.276 . . . . 1.29 109.911 -179.619 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 357' ' ' LYS . . . . . 0.434 ' HE3' ' O ' ' B' ' 355' ' ' ALA . 0.0 OUTLIER -88.79 136.13 33.16 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.382 -1.07 . . . . 4.0899999999999999 109.37 179.84 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' B' B ' 358' ' ' GLU . . . . . 0.573 ' CB ' ' HD3' ' B' ' 359' ' ' PRO . 2.7 mt-10 -52.13 -57.07 16.54 Favored Pre-proline 0 N--CA 1.489 1.504 0 O-C-N 121.168 -0.958 . . . . 5.7199999999999998 109.866 179.934 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 359' ' ' PRO . . . . . 0.573 ' HD3' ' CB ' ' B' ' 358' ' ' GLU . 2.3 Cg_endo -61.46 115.2 2.6 Favored 'Trans proline' 0 C--N 1.311 -1.413 0 C-N-CA 121.979 1.786 . . . . 4.9800000000000004 110.349 -179.834 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 360' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.276 0 CA-C-O 117.979 -1.456 . . . . 6.9800000000000004 109.491 179.892 . . . . . . . . 0 0 . 1 . 011 nuclear build full ' C' C ' 319' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.488 1.446 0 N-CA-C 109.498 -0.556 . . . . 6.8200000000000003 109.498 . . . . . . . . . 1 1 . 1 . 011 nuclear build full ' C' C ' 320' ' ' LYS . . . . . 0.452 ' O ' ' O ' ' C' ' 321' ' ' LYS . 0.1 OUTLIER -81.72 -19.12 42.14 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.416 -0.803 . . . . 6.4900000000000002 109.742 -179.951 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' C' C ' 321' ' ' LYS . . . . . 0.452 ' O ' ' O ' ' C' ' 320' ' ' LYS . 11.8 mmtm 60.58 121.04 0.02 OUTLIER Pre-proline 0 N--CA 1.492 1.656 0 O-C-N 121.269 -0.894 . . . . 6.4000000000000004 109.769 179.871 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' C' C ' 322' ' ' PRO . . . . . . . . . . . . . 1.0 OUTLIER -64.06 -80.98 0.01 OUTLIER 'Trans proline' 0 C--N 1.315 -1.208 0 C-N-CA 122.138 1.892 . . . . 3.4199999999999999 110.551 179.824 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' C' C ' 323' ' ' LEU . . . . . . . . . . . . . 58.8 mt -79.87 95.21 6.0 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.107 -0.995 . . . . 3.9500000000000002 109.419 -179.766 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' C' C ' 324' ' ' ASP . . . . . 0.47 ' OD1' ' N ' ' C' ' 324' ' ' ASP . 1.1 m-20 -79.33 -144.7 0.04 OUTLIER 'General case' 0 C--N 1.304 -1.405 0 O-C-N 121.174 -0.953 . . . . 1.6299999999999999 108.858 179.8 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' C' C ' 325' ' ' GLY . . . . . 0.532 ' O ' ' CE1' ' C' ' 327' ' ' TYR . . . -68.72 175.12 31.07 Favored Glycine 0 N--CA 1.49 2.273 0 N-CA-C 109.711 -1.356 . . . . 0.72999999999999998 109.711 -179.97 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' C' C ' 326' ' ' GLU . . . . . . . . . . . . . 11.6 mm-40 -58.13 -176.52 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.189 -1.183 . . . . 2.1699999999999999 109.578 -179.993 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' C' C ' 327' ' ' TYR . . . . . 0.532 ' CE1' ' O ' ' C' ' 325' ' ' GLY . 59.5 m-85 -150.85 103.21 3.05 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.176 -0.953 . . . . 0.47999999999999998 109.698 -179.877 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' C' C ' 328' ' ' PHE . . . . . 0.439 ' C ' HG23 ' C' ' 329' ' ' THR . 38.3 m-85 -102.13 -169.13 1.63 Allowed 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.294 -0.879 . . . . 0.33000000000000002 109.432 -179.984 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' C' C ' 329' ' ' THR . . . . . 0.463 ' HA ' ' O ' ' A' ' 330' ' ' LEU . 68.1 p -154.41 170.4 21.46 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.107 -0.996 . . . . 0.23000000000000001 109.259 179.991 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' C' C ' 330' ' ' LEU . . . . . . . . . . . . . 22.6 tp -151.31 124.76 8.91 Favored 'General case' 0 N--CA 1.489 1.495 0 O-C-N 121.272 -0.893 . . . . 0.28000000000000003 109.746 -179.692 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' C' C ' 331' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -87.24 112.49 22.07 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.289 -0.882 . . . . 1.48 109.189 179.522 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' C' C ' 332' ' ' ILE . . . . . 0.541 HG21 ' HA ' ' C' ' 338' ' ' PHE . 94.2 mt -103.84 111.12 32.28 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.528 0 O-C-N 121.105 -0.997 . . . . 0.23999999999999999 109.632 -179.895 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' C' C ' 333' ' ' ARG . . . . . 0.535 ' HG2' ' CE1' ' A' ' 327' ' ' TYR . 61.2 mtm180 -74.24 141.78 45.36 Favored 'General case' 0 C--N 1.301 -1.503 0 O-C-N 121.458 -0.776 . . . . 2.7400000000000002 109.517 179.718 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' C' C ' 334' ' ' GLY . . . . . . . . . . . . . . . 86.73 132.85 3.43 Favored Glycine 0 N--CA 1.492 2.381 0 N-CA-C 109.667 -1.373 . . . . 0.34999999999999998 109.667 179.921 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' C' C ' 335' ' ' ARG . . . . . . . . . . . . . 6.6 ttm180 -78.28 -27.21 47.36 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.264 -1.139 . . . . 2.5299999999999998 109.437 179.889 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' C' C ' 336' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -58.02 -70.76 0.13 Allowed 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.411 -0.805 . . . . 2.6200000000000001 110.126 -179.864 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' C' C ' 337' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -57.98 -30.66 66.21 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.328 -0.857 . . . . 2.8100000000000001 109.677 -179.372 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' C' C ' 338' ' ' PHE . . . . . 0.541 ' HA ' HG21 ' C' ' 332' ' ' ILE . 77.8 t80 -53.38 -60.39 3.36 Favored 'General case' 0 C--N 1.303 -1.438 0 O-C-N 121.167 -0.958 . . . . 0.40000000000000002 109.545 -179.797 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' C' C ' 339' ' ' GLU . . . . . . . . . . . . . 51.5 mt-10 -51.22 -32.41 23.94 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.391 -0.818 . . . . 2.0499999999999998 109.954 -179.64 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' C' C ' 340' ' ' MET . . . . . . . . . . . . . 59.2 ttp -64.16 -51.12 65.38 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.222 -0.923 . . . . 0.32000000000000001 109.643 -179.944 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' C' C ' 341' ' ' PHE . . . . . . . . . . . . . 49.3 m-85 -62.08 -49.86 74.25 Favored 'General case' 0 N--CA 1.489 1.495 0 O-C-N 121.184 -0.948 . . . . 0.17999999999999999 110.022 -179.597 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' C' C ' 342' ' ' ARG . . . . . 0.419 ' O ' ' HB3' ' C' ' 345' ' ' ASN . 22.7 tpt180 -49.32 -37.41 24.21 Favored 'General case' 0 N--CA 1.488 1.451 0 O-C-N 121.09 -1.006 . . . . 2.9100000000000001 109.552 -179.879 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' C' C ' 343' ' ' GLU . . . . . . . . . . . . . 1.1 tp10 -59.18 -52.33 66.16 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.233 -0.917 . . . . 2.1400000000000001 109.566 179.868 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' C' C ' 344' ' ' LEU . . . . . 0.626 HD22 HD22 ' D' ' 344' ' ' LEU . 60.0 mt -62.59 -25.5 68.11 Favored 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.157 -0.964 . . . . 0.22 109.242 179.803 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' C' C ' 345' ' ' ASN . . . . . 0.419 ' HB3' ' O ' ' C' ' 342' ' ' ARG . 16.2 t-20 -57.86 -56.8 17.28 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.414 -0.803 . . . . 1.0800000000000001 109.383 -179.896 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' C' C ' 346' ' ' GLU . . . . . . . . . . . . . 20.8 tt0 -62.03 -29.45 70.29 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.34 -0.85 . . . . 2.21 110.042 -179.641 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' C' C ' 347' ' ' ALA . . . . . 0.996 ' HB1' ' HB1' ' D' ' 347' ' ' ALA . . . -61.29 -54.54 42.75 Favored 'General case' 0 N--CA 1.494 1.74 0 O-C-N 121.018 -1.051 . . . . 0.17999999999999999 110.199 -179.311 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' C' C ' 348' ' ' LEU . . . . . 0.568 ' N ' HD22 ' C' ' 348' ' ' LEU . 4.2 mm? -61.7 -51.49 68.18 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.318 -0.864 . . . . 0.32000000000000001 110.463 -179.402 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' C' C ' 349' ' ' GLU . . . . . . . . . . . . . 11.5 mt-10 -57.41 -33.37 67.79 Favored 'General case' 0 N--CA 1.494 1.757 0 O-C-N 121.11 -0.994 . . . . 2.1899999999999999 110.244 -179.352 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' C' C ' 350' ' ' LEU . . . . . 0.809 HD22 HD13 ' D' ' 350' ' ' LEU . 9.3 tt -62.9 -42.86 99.93 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.116 -0.99 . . . . 0.46000000000000002 109.365 -179.758 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' C' C ' 351' ' ' LYS . . . . . 0.521 ' HA ' ' HG2' ' C' ' 354' ' ' GLN . 38.4 tttp -60.14 -51.62 68.82 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.288 -0.882 . . . . 1.3500000000000001 109.445 179.547 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' C' C ' 352' ' ' ASP . . . . . 0.48 ' OD1' ' NH2' ' A' ' 337' ' ' ARG . 18.1 m-20 -55.46 -37.91 68.37 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.297 -0.877 . . . . 1.1899999999999999 109.84 179.887 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' C' C ' 353' ' ' ALA . . . . . . . . . . . . . . . -66.96 -38.91 86.98 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.298 -0.876 . . . . 0.56999999999999995 109.958 -179.581 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' C' C ' 354' ' ' GLN . . . . . 0.521 ' HG2' ' HA ' ' C' ' 351' ' ' LYS . 10.9 pt20 -81.83 -11.6 58.89 Favored 'General case' 0 N--CA 1.489 1.484 0 O-C-N 121.186 -0.946 . . . . 1.47 109.708 -179.592 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' C' C ' 355' ' ' ALA . . . . . . . . . . . . . . . -72.52 -35.39 68.07 Favored 'General case' 0 N--CA 1.489 1.491 0 O-C-N 121.182 -0.949 . . . . 0.93000000000000005 109.682 179.921 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' C' C ' 356' ' ' GLY . . . . . . . . . . . . . . . -80.57 9.76 48.51 Favored Glycine 0 N--CA 1.492 2.374 0 N-CA-C 110.177 -1.169 . . . . 1.3300000000000001 110.177 -179.787 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' C' C ' 357' ' ' LYS . . . . . . . . . . . . . 3.4 tttp -84.78 100.85 11.8 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.131 -1.217 . . . . 4.0099999999999998 109.254 179.784 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' C' C ' 358' ' ' GLU . . . . . . . . . . . . . 3.6 mt-10 -49.64 149.88 4.01 Favored Pre-proline 0 N--CA 1.49 1.572 0 O-C-N 121.195 -0.94 . . . . 5.75 109.019 179.93 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' C' C ' 359' ' ' PRO . . . . . . . . . . . . . 2.0 Cg_endo -67.05 -5.92 14.77 Favored 'Trans proline' 0 C--N 1.31 -1.468 0 C-N-CA 122.393 2.062 . . . . 4.9400000000000004 110.301 -179.866 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' C' C ' 360' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.28 0 N-CA-C 109.327 -1.509 . . . . 6.5 109.327 179.887 . . . . . . . . 0 0 . 1 . 011 nuclear build full ' D' D ' 319' ' ' LYS . . . . . . . . . . . . . 54.6 mttt . . . . . 0 N--CA 1.492 1.647 0 N-CA-C 109.532 -0.544 . . . . 7.5300000000000002 109.532 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' D' D ' 320' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 57.11 71.78 0.55 Allowed 'General case' 0 N--CA 1.489 1.478 0 O-C-N 121.249 -0.907 . . . . 6.4100000000000001 109.279 -179.909 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' D' D ' 321' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -80.94 126.59 77.12 Favored Pre-proline 0 N--CA 1.493 1.682 0 O-C-N 121.386 -0.821 . . . . 6.1100000000000003 109.35 -179.667 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' D' D ' 322' ' ' PRO . . . . . . . . . . . . . 0.9 OUTLIER -64.52 -80.87 0.01 OUTLIER 'Trans proline' 0 C--N 1.314 -1.276 0 C-N-CA 122.168 1.912 . . . . 2.8199999999999998 110.101 -179.878 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' D' D ' 323' ' ' LEU . . . . . 0.444 ' HA ' HD23 ' D' ' 323' ' ' LEU . 62.6 mt -79.18 100.99 7.71 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.272 -0.893 . . . . 2.8300000000000001 109.905 -179.779 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' D' D ' 324' ' ' ASP . . . . . . . . . . . . . 5.5 m-20 -80.41 -153.34 0.09 Allowed 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.284 -0.885 . . . . 1.54 109.359 179.635 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' D' D ' 325' ' ' GLY . . . . . . . . . . . . . . . -68.77 -178.84 18.56 Favored Glycine 0 N--CA 1.491 2.33 0 N-CA-C 109.443 -1.463 . . . . 0.58999999999999997 109.443 -179.956 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' D' D ' 326' ' ' GLU . . . . . . . . . . . . . 2.6 mt-10 -59.29 176.46 0.24 Allowed 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.029 -1.277 . . . . 2.1299999999999999 109.469 -179.934 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' D' D ' 327' ' ' TYR . . . . . 0.494 ' CE1' ' CG ' ' B' ' 333' ' ' ARG . 42.5 m-85 -150.53 112.49 4.55 Favored 'General case' 0 N--CA 1.488 1.442 0 O-C-N 121.204 -0.935 . . . . 0.46999999999999997 109.421 179.913 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' D' D ' 328' ' ' PHE . . . . . 0.411 ' HB2' ' CD1' ' B' ' 338' ' ' PHE . 69.7 m-85 -114.06 -173.02 2.2 Favored 'General case' 0 N--CA 1.489 1.52 0 N-CA-C 108.985 -0.746 . . . . 0.29999999999999999 108.985 179.802 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' D' D ' 329' ' ' THR . . . . . . . . . . . . . 39.7 p -151.44 169.65 21.52 Favored 'General case' 0 C--N 1.302 -1.473 0 O-C-N 121.288 -0.883 . . . . 0.22 109.379 -179.916 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' D' D ' 330' ' ' LEU . . . . . 0.535 HD11 HD22 ' B' ' 345' ' ' ASN . 19.5 tp -152.4 132.4 13.41 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.311 -0.868 . . . . 0.28000000000000003 109.706 -179.767 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' D' D ' 331' ' ' GLN . . . . . 0.446 ' OE1' ' O ' ' B' ' 328' ' ' PHE . 9.0 tp-100 -86.83 113.77 22.92 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.313 -0.867 . . . . 0.93000000000000005 109.306 179.639 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' D' D ' 332' ' ' ILE . . . . . 0.747 HG21 ' HA ' ' D' ' 338' ' ' PHE . 54.3 mt -103.72 102.97 14.46 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.746 0 O-C-N 121.242 -0.911 . . . . 0.25 110.235 -179.593 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' D' D ' 333' ' ' ARG . . . . . . . . . . . . . 5.6 mpt_? -73.45 150.92 41.31 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.027 -1.045 . . . . 2.9300000000000002 109.639 179.615 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' D' D ' 334' ' ' GLY . . . . . . . . . . . . . . . 74.86 130.73 0.24 Allowed Glycine 0 N--CA 1.491 2.33 0 N-CA-C 109.836 -1.305 . . . . 0.40999999999999998 109.836 179.57 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' D' D ' 335' ' ' ARG . . . . . 0.507 ' NH1' ' HG2' ' D' ' 335' ' ' ARG . 1.9 ttt-85 -79.06 -27.88 43.14 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.299 -1.118 . . . . 3.0299999999999998 109.642 -179.997 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' D' D ' 336' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -57.71 -66.54 0.45 Allowed 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.21 -0.931 . . . . 2.2599999999999998 109.695 -179.937 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' D' D ' 337' ' ' ARG . . . . . . . . . . . . . 2.9 mpt_? -60.73 -29.29 69.28 Favored 'General case' 0 N--CA 1.489 1.486 0 O-C-N 121.223 -0.923 . . . . 2.9199999999999999 109.386 -179.772 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' D' D ' 338' ' ' PHE . . . . . 0.747 ' HA ' HG21 ' D' ' 332' ' ' ILE . 57.1 t80 -55.52 -60.55 3.26 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.19 -0.944 . . . . 0.37 109.611 -179.785 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' D' D ' 339' ' ' GLU . . . . . . . . . . . . . 2.2 mm-40 -49.91 -34.9 21.8 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.259 -0.901 . . . . 1.99 109.898 -179.745 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' D' D ' 340' ' ' MET . . . . . . . . . . . . . 42.0 ttp -63.36 -48.87 76.15 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.144 -0.972 . . . . 0.31 109.796 -179.663 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' D' D ' 341' ' ' PHE . . . . . . . . . . . . . 45.9 m-85 -62.39 -52.64 62.81 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.137 -0.977 . . . . 0.17999999999999999 109.583 -179.875 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' D' D ' 342' ' ' ARG . . . . . 0.457 ' CG ' HH11 ' D' ' 342' ' ' ARG . 0.0 OUTLIER -45.78 -40.58 9.8 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.24 -0.913 . . . . 2.4100000000000001 109.638 -179.896 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' D' D ' 343' ' ' GLU . . . . . . . . . . . . . 9.1 tp10 -59.67 -46.56 88.67 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.171 -0.956 . . . . 2.3500000000000001 109.724 -179.835 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' D' D ' 344' ' ' LEU . . . . . 0.626 HD22 HD22 ' C' ' 344' ' ' LEU . 57.1 mt -62.5 -44.92 95.19 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.289 -0.882 . . . . 0.19 110.186 -179.374 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' D' D ' 345' ' ' ASN . . . . . . . . . . . . . 44.9 t-20 -55.52 -42.47 74.58 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.176 -0.953 . . . . 1.0900000000000001 109.632 -179.622 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' D' D ' 346' ' ' GLU . . . . . . . . . . . . . 33.7 tt0 -60.86 -39.49 89.36 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.204 -0.935 . . . . 1.6899999999999999 109.614 -179.962 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' D' D ' 347' ' ' ALA . . . . . 0.996 ' HB1' ' HB1' ' C' ' 347' ' ' ALA . . . -60.5 -49.62 76.83 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.393 -0.817 . . . . 0.17999999999999999 109.97 -179.861 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' D' D ' 348' ' ' LEU . . . . . 0.555 HD22 ' N ' ' D' ' 348' ' ' LEU . 3.9 mm? -60.93 -47.18 87.62 Favored 'General case' 0 N--CA 1.493 1.711 0 O-C-N 121.237 -0.914 . . . . 0.31 110.024 -179.327 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' D' D ' 349' ' ' GLU . . . . . . . . . . . . . 1.4 mm-40 -58.12 -36.01 72.32 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.11 -0.994 . . . . 1.95 109.796 -179.66 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' D' D ' 350' ' ' LEU . . . . . 0.809 HD13 HD22 ' C' ' 350' ' ' LEU . 5.2 tt -62.32 -44.54 96.26 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.124 -0.985 . . . . 0.42999999999999999 109.01 -179.971 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' D' D ' 351' ' ' LYS . . . . . . . . . . . . . 28.4 tttp -59.09 -44.64 91.93 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.292 -0.88 . . . . 1.3999999999999999 109.289 179.767 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' D' D ' 352' ' ' ASP . . . . . . . . . . . . . 4.2 m-20 -56.66 -41.2 76.81 Favored 'General case' 0 N--CA 1.488 1.434 0 O-C-N 121.343 -0.848 . . . . 1.1699999999999999 109.255 179.823 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' D' D ' 353' ' ' ALA . . . . . . . . . . . . . . . -67.63 -31.81 72.08 Favored 'General case' 0 N--CA 1.488 1.447 0 O-C-N 121.22 -0.925 . . . . 0.58999999999999997 109.31 -179.799 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' D' D ' 354' ' ' GLN . . . . . . . . . . . . . 44.8 tt0 -81.51 5.35 18.11 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.442 -0.786 . . . . 1.4399999999999999 109.485 179.897 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' D' D ' 355' ' ' ALA . . . . . 0.458 ' O ' ' HE3' ' D' ' 357' ' ' LYS . . . -69.47 -92.63 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.259 -0.901 . . . . 0.97999999999999998 109.624 -179.781 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' D' D ' 356' ' ' GLY . . . . . . . . . . . . . . . -71.51 104.62 1.48 Allowed Glycine 0 N--CA 1.495 2.613 0 N-CA-C 109.911 -1.276 . . . . 1.28 109.911 -179.686 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' D' D ' 357' ' ' LYS . . . . . 0.458 ' HE3' ' O ' ' D' ' 355' ' ' ALA . 0.0 OUTLIER -88.42 136.08 33.16 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.125 -1.22 . . . . 4.0899999999999999 109.239 179.622 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' D' D ' 358' ' ' GLU . . . . . 0.57 ' CB ' ' HD3' ' D' ' 359' ' ' PRO . 2.9 mt-10 -52.23 -56.7 19.76 Favored Pre-proline 0 N--CA 1.491 1.609 0 O-C-N 121.08 -1.013 . . . . 5.71 109.669 -179.915 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' D' D ' 359' ' ' PRO . . . . . 0.57 ' HD3' ' CB ' ' D' ' 358' ' ' GLU . 2.5 Cg_endo -61.47 117.01 3.78 Favored 'Trans proline' 0 C--N 1.312 -1.374 0 C-N-CA 121.96 1.773 . . . . 4.9699999999999998 110.377 -179.894 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' D' D ' 360' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.286 0 CA-C-O 117.977 -1.457 . . . . 6.9699999999999998 109.546 179.789 . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 319' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.49 1.534 0 N-CA-C 109.521 -0.548 . . . . 7.5499999999999998 109.521 . . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 320' ' ' LYS . . . . . 0.47 ' O ' ' HD3' ' A' ' 322' ' ' PRO . 0.7 OUTLIER 64.53 43.21 4.54 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.293 -0.88 . . . . 6.4299999999999997 109.721 179.818 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 321' ' ' LYS . . . . . . . . . . . . . 33.8 mttt -82.05 114.19 48.89 Favored Pre-proline 0 N--CA 1.492 1.64 0 O-C-N 121.23 -0.919 . . . . 6.1299999999999999 109.28 179.753 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 322' ' ' PRO . . . . . 0.47 ' HD3' ' O ' ' A' ' 320' ' ' LYS . 2.3 Cg_endo -68.54 -3.72 11.64 Favored 'Trans proline' 0 C--N 1.313 -1.291 0 C-N-CA 121.904 1.736 . . . . 2.8300000000000001 110.514 -179.892 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 323' ' ' LEU . . . . . 0.416 ' HA ' HD23 ' A' ' 323' ' ' LEU . 42.4 mt -82.12 92.06 6.79 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.106 -0.996 . . . . 2.8300000000000001 109.512 179.95 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 324' ' ' ASP . . . . . . . . . . . . . 3.5 m-20 -81.55 127.76 33.19 Favored 'General case' 0 N--CA 1.489 1.499 0 O-C-N 121.277 -0.889 . . . . 1.53 109.223 179.823 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 325' ' ' GLY . . . . . 0.5 ' O ' ' CD1' ' A' ' 327' ' ' TYR . . . -67.55 176.57 23.79 Favored Glycine 0 N--CA 1.49 2.273 0 N-CA-C 109.145 -1.582 . . . . 0.60999999999999999 109.145 179.988 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 326' ' ' GLU . . . . . . . . . . . . . 19.9 mm-40 -56.87 171.52 0.33 Allowed 'General case' 0 N--CA 1.487 1.422 0 O-C-N 121.102 -1.234 . . . . 2.1299999999999999 109.217 -179.882 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 327' ' ' TYR . . . . . 0.606 ' CE2' ' HG2' ' C' ' 333' ' ' ARG . 42.4 m-85 -148.14 109.24 4.29 Favored 'General case' 0 C--N 1.302 -1.499 0 O-C-N 121.317 -0.864 . . . . 0.47999999999999998 109.318 -179.938 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 328' ' ' PHE . . . . . 0.417 ' C ' HG23 ' A' ' 329' ' ' THR . 81.5 m-85 -110.65 -170.22 1.6 Allowed 'General case' 0 N--CA 1.488 1.446 0 O-C-N 121.356 -0.84 . . . . 0.31 109.344 -179.901 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 329' ' ' THR . . . . . 0.417 HG23 ' C ' ' A' ' 328' ' ' PHE . 73.2 p -153.7 162.22 41.43 Favored 'General case' 0 C--N 1.302 -1.462 0 O-C-N 121.267 -0.896 . . . . 0.22 109.3 -179.905 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 330' ' ' LEU . . . . . 0.481 ' O ' ' HA ' ' C' ' 329' ' ' THR . 15.8 tp -149.32 130.06 14.14 Favored 'General case' 0 N--CA 1.488 1.434 0 O-C-N 121.166 -0.959 . . . . 0.28000000000000003 109.367 -179.752 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 331' ' ' GLN . . . . . . . . . . . . . 2.0 tp60 -86.03 121.64 28.93 Favored 'General case' 0 N--CA 1.489 1.482 0 O-C-N 121.35 -0.844 . . . . 0.91000000000000003 109.54 -179.906 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 332' ' ' ILE . . . . . 0.875 HG21 ' HA ' ' A' ' 338' ' ' PHE . 72.1 mt -103.45 103.73 15.59 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.561 0 O-C-N 121.238 -0.914 . . . . 0.26000000000000001 109.425 -179.999 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 333' ' ' ARG . . . . . 0.559 ' HG2' ' CE1' ' C' ' 327' ' ' TYR . 0.3 OUTLIER -72.68 146.24 46.66 Favored 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.258 -0.901 . . . . 2.9199999999999999 109.461 -179.985 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 334' ' ' GLY . . . . . . . . . . . . . . . 75.68 119.67 0.13 Allowed Glycine 0 N--CA 1.491 2.319 0 N-CA-C 109.621 -1.392 . . . . 0.40000000000000002 109.621 179.993 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 335' ' ' ARG . . . . . 0.456 ' O ' ' HB3' ' A' ' 338' ' ' PHE . 1.8 ttt180 -65.6 -27.31 68.31 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.308 -1.113 . . . . 3.0099999999999998 109.612 179.951 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 336' ' ' GLU . . . . . . . . . . . . . 23.4 tt0 -57.37 -63.79 1.11 Allowed 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.198 -0.939 . . . . 2.29 109.656 -179.941 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 337' ' ' ARG . . . . . 0.54 ' HG3' ' NH1' ' A' ' 337' ' ' ARG . 0.6 OUTLIER -60.03 -27.15 66.68 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.193 -0.942 . . . . 2.9300000000000002 109.376 -179.93 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 338' ' ' PHE . . . . . 0.875 ' HA ' HG21 ' A' ' 332' ' ' ILE . 83.8 t80 -55.31 -61.61 2.22 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.38 -0.825 . . . . 0.38 109.841 -179.808 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 339' ' ' GLU . . . . . . . . . . . . . 18.0 mt-10 -51.54 -33.62 32.89 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.26 -0.9 . . . . 1.97 110.164 -179.543 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 340' ' ' MET . . . . . . . . . . . . . 38.0 ttp -64.38 -52.7 56.96 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.126 -0.984 . . . . 0.31 110.453 -179.353 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 341' ' ' PHE . . . . . . . . . . . . . 42.5 m-85 -62.1 -46.22 90.02 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.164 -0.96 . . . . 0.17999999999999999 110.142 -179.284 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 342' ' ' ARG . . . . . 0.451 ' CG ' HH11 ' A' ' 342' ' ' ARG . 0.0 OUTLIER -48.17 -38.51 18.27 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.054 -1.029 . . . . 2.4199999999999999 109.883 -179.678 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 343' ' ' GLU . . . . . . . . . . . . . 33.3 tt0 -59.76 -51.27 70.5 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.113 -0.992 . . . . 2.3500000000000001 109.833 -179.757 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 344' ' ' LEU . . . . . 0.652 HD22 HD22 ' B' ' 344' ' ' LEU . 34.9 mt -61.57 -31.39 71.43 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.154 -0.966 . . . . 0.17999999999999999 109.556 -179.817 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 345' ' ' ASN . . . . . . . . . . . . . 13.2 t-20 -57.82 -60.3 3.91 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.297 -0.877 . . . . 1.0900000000000001 109.72 -179.868 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 346' ' ' GLU . . . . . . . . . . . . . 26.1 tt0 -61.25 -26.45 67.77 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.295 -0.878 . . . . 1.6499999999999999 109.916 -179.723 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 347' ' ' ALA . . . . . 0.879 ' HB1' ' HB1' ' B' ' 347' ' ' ALA . . . -61.11 -58.98 6.12 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.196 -0.94 . . . . 0.17999999999999999 109.966 -179.81 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 348' ' ' LEU . . . . . 0.784 HD12 ' NH2' ' C' ' 337' ' ' ARG . 3.8 mm? -62.22 -42.19 99.08 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.237 -0.914 . . . . 0.29999999999999999 109.974 -179.541 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 349' ' ' GLU . . . . . . . . . . . . . 31.5 mt-10 -57.67 -37.51 73.54 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.209 -0.932 . . . . 1.9399999999999999 110.209 -179.287 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 350' ' ' LEU . . . . . 0.699 HD13 HD22 ' B' ' 350' ' ' LEU . 6.0 tt -64.37 -44.38 91.58 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.142 -0.974 . . . . 0.46000000000000002 109.943 -179.573 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 351' ' ' LYS . . . . . . . . . . . . . 40.1 tttp -57.96 -37.67 74.6 Favored 'General case' 0 N--CA 1.488 1.466 0 O-C-N 121.093 -1.004 . . . . 1.3999999999999999 109.508 -179.676 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 352' ' ' ASP . . . . . . . . . . . . . 11.3 m-20 -55.34 -41.44 72.51 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.278 -0.889 . . . . 1.1599999999999999 109.42 179.868 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 353' ' ' ALA . . . . . . . . . . . . . . . -67.81 -30.76 70.26 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.282 -0.886 . . . . 0.63 109.707 -179.866 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 354' ' ' GLN . . . . . . . . . . . . . 4.8 mt-30 -80.55 1.56 29.08 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.154 -0.966 . . . . 1.47 109.631 -179.948 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 355' ' ' ALA . . . . . . . . . . . . . . . -69.13 -83.74 0.03 OUTLIER 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.24 -0.913 . . . . 1.01 109.334 179.96 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 356' ' ' GLY . . . . . . . . . . . . . . . -62.69 99.48 0.26 Allowed Glycine 0 N--CA 1.49 2.288 0 N-CA-C 109.54 -1.424 . . . . 1.3 109.54 179.996 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 357' ' ' LYS . . . . . . . . . . . . . 16.6 mttt -86.1 150.29 24.53 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.312 -1.11 . . . . 4.0999999999999996 109.344 179.956 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 358' ' ' GLU . . . . . 0.416 ' HG2' ' HD2' ' A' ' 359' ' ' PRO . 2.8 mt-10 -49.5 161.86 0.47 Allowed Pre-proline 0 N--CA 1.49 1.538 0 O-C-N 121.166 -0.959 . . . . 5.75 109.533 -179.961 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 359' ' ' PRO . . . . . 0.416 ' HD2' ' HG2' ' A' ' 358' ' ' GLU . 3.1 Cg_exo -61.21 -156.1 0.02 OUTLIER 'Trans proline' 0 C--N 1.311 -1.427 0 C-N-CA 122.199 1.932 . . . . 5.0 110.351 -179.918 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 360' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.313 0 CA-C-O 117.992 -1.449 . . . . 6.9699999999999998 109.545 -179.936 . . . . . . . . 0 0 . 1 . 012 nuclear build full ' B' B ' 319' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.49 1.554 0 CA-C-O 121.277 0.56 . . . . 7.5499999999999998 109.492 . . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 320' ' ' LYS . . . . . 0.473 ' O ' ' HD3' ' B' ' 322' ' ' PRO . 0.7 OUTLIER 64.35 43.37 4.73 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.303 -0.873 . . . . 6.4400000000000004 109.762 179.934 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' B' B ' 321' ' ' LYS . . . . . . . . . . . . . 33.8 mttt -82.21 114.24 49.63 Favored Pre-proline 0 N--CA 1.492 1.632 0 O-C-N 121.166 -0.958 . . . . 6.1299999999999999 109.2 179.796 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 322' ' ' PRO . . . . . 0.473 ' HD3' ' O ' ' B' ' 320' ' ' LYS . 2.3 Cg_endo -68.59 -3.6 11.44 Favored 'Trans proline' 0 C--N 1.312 -1.355 0 C-N-CA 121.941 1.761 . . . . 2.8199999999999998 110.53 -179.853 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 323' ' ' LEU . . . . . 0.466 ' HA ' HD23 ' B' ' 323' ' ' LEU . 42.7 mt -82.2 92.19 6.85 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.141 -0.974 . . . . 2.8399999999999999 109.523 179.916 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 324' ' ' ASP . . . . . . . . . . . . . 3.6 m-20 -81.86 126.48 31.94 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.295 -0.878 . . . . 1.53 109.367 179.892 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 325' ' ' GLY . . . . . 0.501 ' O ' ' CD2' ' B' ' 327' ' ' TYR . . . -65.78 176.58 15.4 Favored Glycine 0 N--CA 1.489 2.209 0 N-CA-C 109.233 -1.547 . . . . 0.58999999999999997 109.233 179.801 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 326' ' ' GLU . . . . . . . . . . . . . 20.0 mm-40 -57.16 171.82 0.35 Allowed 'General case' 0 N--CA 1.487 1.421 0 O-C-N 121.101 -1.235 . . . . 2.1299999999999999 109.138 179.982 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 327' ' ' TYR . . . . . 0.501 ' CD2' ' O ' ' B' ' 325' ' ' GLY . 41.7 m-85 -148.4 109.24 4.24 Favored 'General case' 0 N--CA 1.488 1.471 0 O-C-N 121.24 -0.913 . . . . 0.47999999999999998 109.345 179.988 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 328' ' ' PHE . . . . . 0.413 ' C ' HG23 ' B' ' 329' ' ' THR . 81.3 m-85 -110.56 -170.23 1.6 Allowed 'General case' 0 N--CA 1.489 1.488 0 O-C-N 121.287 -0.883 . . . . 0.32000000000000001 109.374 -179.869 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 329' ' ' THR . . . . . 0.413 HG23 ' C ' ' B' ' 328' ' ' PHE . 73.6 p -153.68 162.17 41.48 Favored 'General case' 0 N--CA 1.488 1.443 0 O-C-N 121.254 -0.904 . . . . 0.23000000000000001 109.312 -179.99 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 330' ' ' LEU . . . . . . . . . . . . . 15.9 tp -149.13 130.18 14.42 Favored 'General case' 0 N--CA 1.488 1.469 0 O-C-N 121.288 -0.883 . . . . 0.28000000000000003 109.476 -179.869 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 331' ' ' GLN . . . . . . . . . . . . . 2.0 tp60 -86.02 121.52 28.76 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.283 -0.885 . . . . 0.91000000000000003 109.563 -179.957 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 332' ' ' ILE . . . . . 0.873 HG21 ' HA ' ' B' ' 338' ' ' PHE . 71.7 mt -103.37 103.7 15.53 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.526 0 O-C-N 121.248 -0.907 . . . . 0.23999999999999999 109.519 179.889 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 333' ' ' ARG . . . . . 0.5 ' HG2' ' CE1' ' D' ' 327' ' ' TYR . 0.3 OUTLIER -72.6 146.22 46.81 Favored 'General case' 0 N--CA 1.489 1.487 0 O-C-N 121.219 -0.925 . . . . 2.9300000000000002 109.527 179.941 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' B' B ' 334' ' ' GLY . . . . . . . . . . . . . . . 75.78 119.56 0.13 Allowed Glycine 0 N--CA 1.49 2.242 0 N-CA-C 109.63 -1.388 . . . . 0.40000000000000002 109.63 179.992 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 335' ' ' ARG . . . . . 0.483 ' HG3' ' CZ ' ' D' ' 328' ' ' PHE . 1.8 ttt180 -65.61 -27.39 68.37 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.267 -1.137 . . . . 3.0099999999999998 109.462 -179.961 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 336' ' ' GLU . . . . . . . . . . . . . 23.5 tt0 -57.38 -63.73 1.13 Allowed 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.264 -0.897 . . . . 2.2799999999999998 109.615 -179.873 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 337' ' ' ARG . . . . . 0.562 ' NH1' ' HG3' ' B' ' 337' ' ' ARG . 0.5 OUTLIER -59.88 -27.24 66.53 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.237 -0.914 . . . . 2.9300000000000002 109.417 179.937 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' B' B ' 338' ' ' PHE . . . . . 0.873 ' HA ' HG21 ' B' ' 332' ' ' ILE . 84.4 t80 -55.38 -61.48 2.31 Favored 'General case' 0 N--CA 1.488 1.455 0 O-C-N 121.273 -0.892 . . . . 0.37 109.865 -179.722 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 339' ' ' GLU . . . . . . . . . . . . . 18.0 mt-10 -51.67 -33.48 34.03 Favored 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.176 -0.953 . . . . 1.98 110.171 -179.533 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 340' ' ' MET . . . . . . . . . . . . . 38.1 ttp -64.5 -52.75 56.23 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.08 -1.012 . . . . 0.32000000000000001 110.388 -179.312 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 341' ' ' PHE . . . . . . . . . . . . . 42.2 m-85 -61.96 -46.42 89.35 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.115 -0.99 . . . . 0.17999999999999999 110.08 -179.285 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 342' ' ' ARG . . . . . 0.455 ' NH1' ' CG ' ' B' ' 342' ' ' ARG . 0.0 OUTLIER -47.98 -38.83 17.78 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.202 -0.936 . . . . 2.4199999999999999 109.868 -179.691 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' B' B ' 343' ' ' GLU . . . . . . . . . . . . . 33.1 tt0 -59.45 -51.35 70.26 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.139 -0.976 . . . . 2.3500000000000001 109.818 -179.731 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 344' ' ' LEU . . . . . 0.652 HD22 HD22 ' A' ' 344' ' ' LEU . 34.3 mt -61.57 -31.5 71.55 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.144 -0.972 . . . . 0.17999999999999999 109.586 -179.757 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 345' ' ' ASN . . . . . . . . . . . . . 13.1 t-20 -57.86 -60.14 4.16 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.302 -0.874 . . . . 1.0900000000000001 109.747 -179.849 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 346' ' ' GLU . . . . . . . . . . . . . 26.1 tt0 -61.28 -26.63 67.9 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.34 -0.85 . . . . 1.6599999999999999 109.745 -179.736 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 347' ' ' ALA . . . . . 0.879 ' HB1' ' HB1' ' A' ' 347' ' ' ALA . . . -60.93 -59.17 5.8 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.125 -0.984 . . . . 0.17000000000000001 109.934 -179.702 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 348' ' ' LEU . . . . . 0.578 HD22 ' N ' ' B' ' 348' ' ' LEU . 3.8 mm? -62.01 -42.15 98.85 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.212 -0.93 . . . . 0.28999999999999998 110.042 -179.526 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 349' ' ' GLU . . . . . . . . . . . . . 31.6 mt-10 -57.81 -37.38 73.68 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.145 -0.972 . . . . 1.95 110.246 -179.303 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 350' ' ' LEU . . . . . 0.699 HD22 HD13 ' A' ' 350' ' ' LEU . 6.0 tt -64.45 -44.28 91.59 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.163 -0.96 . . . . 0.45000000000000001 109.969 -179.565 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 351' ' ' LYS . . . . . . . . . . . . . 40.1 tttp -58.01 -37.73 74.85 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.161 -0.962 . . . . 1.3799999999999999 109.43 -179.704 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 352' ' ' ASP . . . . . . . . . . . . . 11.4 m-20 -55.3 -41.44 72.34 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.219 -0.926 . . . . 1.1599999999999999 109.45 179.829 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 353' ' ' ALA . . . . . . . . . . . . . . . -67.78 -30.75 70.27 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.29 -0.881 . . . . 0.60999999999999999 109.705 -179.891 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 354' ' ' GLN . . . . . . . . . . . . . 4.7 mt-30 -80.75 1.67 29.39 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.18 -0.95 . . . . 1.45 109.577 -179.863 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 355' ' ' ALA . . . . . . . . . . . . . . . -69.14 -83.69 0.03 OUTLIER 'General case' 0 N--CA 1.489 1.491 0 O-C-N 121.096 -1.003 . . . . 0.97999999999999998 109.401 179.841 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 356' ' ' GLY . . . . . . . . . . . . . . . -62.6 99.32 0.24 Allowed Glycine 0 N--CA 1.49 2.29 0 N-CA-C 109.584 -1.407 . . . . 1.29 109.584 179.939 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 357' ' ' LYS . . . . . . . . . . . . . 16.7 mttt -86.1 150.24 24.57 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.232 -1.158 . . . . 4.0899999999999999 109.321 179.976 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 358' ' ' GLU . . . . . 0.415 ' HG2' ' HD2' ' B' ' 359' ' ' PRO . 2.8 mt-10 -49.51 162.09 0.45 Allowed Pre-proline 0 N--CA 1.491 1.587 0 O-C-N 121.202 -0.937 . . . . 5.7199999999999998 109.546 -179.889 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 359' ' ' PRO . . . . . 0.415 ' HD2' ' HG2' ' B' ' 358' ' ' GLU . 3.2 Cg_exo -61.23 -156.3 0.02 OUTLIER 'Trans proline' 0 C--N 1.31 -1.498 0 C-N-CA 122.236 1.958 . . . . 4.9800000000000004 110.322 -179.909 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 360' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.229 0 CA-C-O 118.016 -1.436 . . . . 6.9800000000000004 109.556 179.854 . . . . . . . . 0 0 . 1 . 012 nuclear build full ' C' C ' 319' ' ' LYS . . . . . 0.436 ' O ' ' HB2' ' C' ' 320' ' ' LYS . 0.2 OUTLIER . . . . . 0 N--CA 1.49 1.548 0 N-CA-C 109.48 -0.563 . . . . 6.8200000000000003 109.48 . . . . . . . . . 2 2 . 1 . 012 nuclear build full ' C' C ' 320' ' ' LYS . . . . . 0.436 ' HB2' ' O ' ' C' ' 319' ' ' LYS . 0.0 OUTLIER 60.34 150.33 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.286 -0.884 . . . . 6.4900000000000002 109.628 179.824 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' C' C ' 321' ' ' LYS . . . . . 0.56 ' N ' ' HD3' ' C' ' 322' ' ' PRO . 0.0 OUTLIER -158.02 57.09 1.15 Allowed Pre-proline 0 N--CA 1.489 1.49 0 O-C-N 121.288 -0.882 . . . . 6.4000000000000004 109.671 179.832 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' C' C ' 322' ' ' PRO . . . . . 0.56 ' HD3' ' N ' ' C' ' 321' ' ' LYS . 2.9 Cg_endo -60.71 -151.47 0.01 OUTLIER 'Trans proline' 0 C--N 1.311 -1.424 0 C-N-CA 122.07 1.846 . . . . 3.4199999999999999 109.914 179.653 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' C' C ' 323' ' ' LEU . . . . . . . . . . . . . 71.6 mt -78.68 117.03 19.44 Favored 'General case' 0 N--CA 1.488 1.458 0 O-C-N 121.108 -0.995 . . . . 3.9500000000000002 109.012 179.733 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' C' C ' 324' ' ' ASP . . . . . . . . . . . . . 91.7 m-20 -78.95 142.34 36.78 Favored 'General case' 0 N--CA 1.488 1.47 0 O-C-N 121.276 -0.89 . . . . 1.6299999999999999 109.664 -179.629 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' C' C ' 325' ' ' GLY . . . . . . . . . . . . . . . -68.1 176.74 25.7 Favored Glycine 0 N--CA 1.489 2.172 0 N-CA-C 109.284 -1.526 . . . . 0.72999999999999998 109.284 179.872 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' C' C ' 326' ' ' GLU . . . . . . . . . . . . . 9.9 mm-40 -57.32 -177.65 0.03 OUTLIER 'General case' 0 N--CA 1.488 1.47 0 O-C-N 121.129 -1.218 . . . . 2.1699999999999999 109.241 -179.976 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' C' C ' 327' ' ' TYR . . . . . 0.559 ' CE1' ' HG2' ' A' ' 333' ' ' ARG . 41.1 m-85 -148.95 108.16 3.92 Favored 'General case' 0 N--CA 1.488 1.464 0 O-C-N 121.395 -0.816 . . . . 0.47999999999999998 109.257 179.906 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' C' C ' 328' ' ' PHE . . . . . 0.551 ' N ' ' CD1' ' C' ' 328' ' ' PHE . 5.0 m-85 -112.95 -168.41 1.32 Allowed 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.374 -0.829 . . . . 0.33000000000000002 109.251 -179.887 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' C' C ' 329' ' ' THR . . . . . 0.481 ' HA ' ' O ' ' A' ' 330' ' ' LEU . 57.0 p -151.65 174.59 13.29 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.202 -0.936 . . . . 0.23000000000000001 109.376 -179.926 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' C' C ' 330' ' ' LEU . . . . . . . . . . . . . 14.8 tp -151.28 125.93 9.59 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.186 -0.946 . . . . 0.28000000000000003 109.695 -179.736 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' C' C ' 331' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -87.91 114.49 24.57 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.246 -0.909 . . . . 1.48 108.999 179.636 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' C' C ' 332' ' ' ILE . . . . . 0.52 HD13 ' CD2' ' C' ' 341' ' ' PHE . 11.2 mt -103.36 112.36 36.55 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.566 0 O-C-N 121.15 -0.969 . . . . 0.23999999999999999 110.006 -179.73 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' C' C ' 333' ' ' ARG . . . . . 0.606 ' HG2' ' CE2' ' A' ' 327' ' ' TYR . 0.7 OUTLIER -72.6 154.46 40.75 Favored 'General case' 0 N--CA 1.488 1.44 0 O-C-N 121.283 -0.886 . . . . 2.7400000000000002 109.127 179.443 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' C' C ' 334' ' ' GLY . . . . . . . . . . . . . . . 73.84 128.17 0.14 Allowed Glycine 0 N--CA 1.489 2.223 0 N-CA-C 109.552 -1.419 . . . . 0.34999999999999998 109.552 179.956 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' C' C ' 335' ' ' ARG . . . . . 0.414 ' HA ' ' CE1' ' A' ' 328' ' ' PHE . 9.0 ttt180 -73.64 -40.0 64.08 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.324 -1.103 . . . . 2.5299999999999998 109.656 -179.853 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' C' C ' 336' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -56.97 -48.84 77.45 Favored 'General case' 0 N--CA 1.494 1.739 0 O-C-N 121.262 -0.899 . . . . 2.6200000000000001 109.684 -179.789 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' C' C ' 337' ' ' ARG . . . . . 0.784 ' NH2' HD12 ' A' ' 348' ' ' LEU . 0.0 OUTLIER -62.9 -37.76 88.24 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.139 -0.976 . . . . 2.8100000000000001 109.502 179.822 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' C' C ' 338' ' ' PHE . . . . . . . . . . . . . 82.2 t80 -55.16 -51.18 67.3 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.35 -0.844 . . . . 0.40000000000000002 109.861 -179.73 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' C' C ' 339' ' ' GLU . . . . . . . . . . . . . 10.3 mt-10 -52.55 -36.64 56.18 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.113 -0.992 . . . . 2.0499999999999998 110.38 -179.557 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' C' C ' 340' ' ' MET . . . . . . . . . . . . . 35.5 ttp -63.77 -51.52 64.45 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.073 -1.017 . . . . 0.32000000000000001 110.402 -179.262 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' C' C ' 341' ' ' PHE . . . . . 0.52 ' CD2' HD13 ' C' ' 332' ' ' ILE . 40.2 m-85 -61.84 -41.24 97.56 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.146 -0.971 . . . . 0.17999999999999999 110.1 -179.281 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' C' C ' 342' ' ' ARG . . . . . . . . . . . . . 1.4 ttt180 -52.24 -40.97 62.36 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.093 -1.004 . . . . 2.9100000000000001 109.526 179.934 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' C' C ' 343' ' ' GLU . . . . . . . . . . . . . 25.2 tt0 -58.95 -53.87 53.49 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.25 -0.906 . . . . 2.1400000000000001 109.59 -179.743 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' C' C ' 344' ' ' LEU . . . . . 0.512 HD22 HD22 ' D' ' 344' ' ' LEU . 30.6 mt -59.87 -26.08 65.58 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.217 -0.927 . . . . 0.22 108.939 179.915 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' C' C ' 345' ' ' ASN . . . . . . . . . . . . . 6.4 t-20 -59.52 -64.09 1.07 Allowed 'General case' 0 N--CA 1.488 1.453 0 O-C-N 121.414 -0.804 . . . . 1.0800000000000001 109.534 179.823 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' C' C ' 346' ' ' GLU . . . . . . . . . . . . . 9.1 tp10 -62.77 -25.42 68.21 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.396 -0.815 . . . . 2.21 109.972 -179.743 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' C' C ' 347' ' ' ALA . . . . . 0.683 ' HB1' ' HB1' ' D' ' 347' ' ' ALA . . . -60.58 -57.32 13.21 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.185 -0.947 . . . . 0.17999999999999999 109.862 -179.687 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' C' C ' 348' ' ' LEU . . . . . 0.529 ' N ' HD22 ' C' ' 348' ' ' LEU . 3.6 mm? -62.57 -45.0 94.93 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.184 -0.948 . . . . 0.32000000000000001 110.045 -179.503 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' C' C ' 349' ' ' GLU . . . . . 0.42 ' O ' ' HB2' ' C' ' 352' ' ' ASP . 97.7 mt-10 -57.37 -34.4 68.79 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.267 -0.895 . . . . 2.1899999999999999 110.157 -179.312 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' C' C ' 350' ' ' LEU . . . . . 0.814 HD22 HD13 ' D' ' 350' ' ' LEU . 7.9 tt -63.23 -44.55 94.93 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.067 -1.021 . . . . 0.46000000000000002 109.209 -179.929 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' C' C ' 351' ' ' LYS . . . . . . . . . . . . . 62.9 tttm -60.65 -33.29 72.58 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.323 -0.861 . . . . 1.3500000000000001 109.576 179.955 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' C' C ' 352' ' ' ASP . . . . . 0.42 ' HB2' ' O ' ' C' ' 349' ' ' GLU . 4.0 m-20 -52.75 -50.76 62.83 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.164 -0.96 . . . . 1.1899999999999999 109.172 -179.979 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' C' C ' 353' ' ' ALA . . . . . . . . . . . . . . . -68.4 -23.3 64.63 Favored 'General case' 0 N--CA 1.488 1.447 0 O-C-N 121.316 -0.865 . . . . 0.56999999999999995 108.968 179.564 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' C' C ' 354' ' ' GLN . . . . . . . . . . . . . 52.3 tt0 -83.06 1.83 38.18 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.413 -0.804 . . . . 1.47 109.87 -179.873 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' C' C ' 355' ' ' ALA . . . . . . . . . . . . . . . -67.35 -91.48 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.057 -1.027 . . . . 0.93000000000000005 109.311 -179.885 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' C' C ' 356' ' ' GLY . . . . . . . . . . . . . . . -61.26 104.12 0.64 Allowed Glycine 0 N--CA 1.489 2.209 0 N-CA-C 109.288 -1.525 . . . . 1.3300000000000001 109.288 179.83 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' C' C ' 357' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -86.16 101.95 13.46 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.175 -1.191 . . . . 4.0099999999999998 109.562 -179.86 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' C' C ' 358' ' ' GLU . . . . . . . . . . . . . 4.6 mm-40 -49.91 119.64 10.36 Favored Pre-proline 0 N--CA 1.49 1.526 0 O-C-N 121.35 -0.843 . . . . 5.75 109.495 -179.993 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' C' C ' 359' ' ' PRO . . . . . . . . . . . . . 4.1 Cg_exo -59.8 -153.58 0.01 OUTLIER 'Trans proline' 0 C--N 1.313 -1.305 0 C-N-CA 121.928 1.752 . . . . 4.9400000000000004 110.079 179.939 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' C' C ' 360' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.29 0 N-CA-C 109.525 -1.43 . . . . 6.5 109.525 179.991 . . . . . . . . 0 0 . 1 . 012 nuclear build full ' D' D ' 319' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.49 1.531 0 N-CA-C 109.492 -0.558 . . . . 7.5300000000000002 109.492 . . . . . . . . . 1 1 . 1 . 012 nuclear build full ' D' D ' 320' ' ' LYS . . . . . 0.48 ' O ' ' HD3' ' D' ' 322' ' ' PRO . 0.7 OUTLIER 64.57 43.19 4.5 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.367 -0.833 . . . . 6.4100000000000001 109.692 179.827 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' D' D ' 321' ' ' LYS . . . . . . . . . . . . . 33.8 mttt -82.02 114.18 48.75 Favored Pre-proline 0 N--CA 1.49 1.56 0 O-C-N 121.264 -0.898 . . . . 6.1100000000000003 109.282 179.739 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' D' D ' 322' ' ' PRO . . . . . 0.48 ' HD3' ' O ' ' D' ' 320' ' ' LYS . 2.3 Cg_endo -68.53 -3.61 11.42 Favored 'Trans proline' 0 C--N 1.313 -1.324 0 C-N-CA 121.903 1.735 . . . . 2.8199999999999998 110.524 -179.865 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' D' D ' 323' ' ' LEU . . . . . 0.446 HD23 ' HA ' ' D' ' 323' ' ' LEU . 42.7 mt -82.13 92.03 6.78 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.119 -0.988 . . . . 2.8300000000000001 109.432 179.939 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' D' D ' 324' ' ' ASP . . . . . . . . . . . . . 3.6 m-20 -81.67 127.36 32.83 Favored 'General case' 0 N--CA 1.489 1.489 0 O-C-N 121.211 -0.93 . . . . 1.54 109.195 179.818 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' D' D ' 325' ' ' GLY . . . . . 0.501 ' O ' ' CD2' ' D' ' 327' ' ' TYR . . . -67.04 176.79 21.3 Favored Glycine 0 N--CA 1.489 2.207 0 N-CA-C 109.167 -1.573 . . . . 0.58999999999999997 109.167 179.908 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' D' D ' 326' ' ' GLU . . . . . . . . . . . . . 20.0 mm-40 -57.06 171.63 0.35 Allowed 'General case' 0 N--CA 1.487 1.418 0 O-C-N 121.159 -1.201 . . . . 2.1299999999999999 109.229 -179.904 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' D' D ' 327' ' ' TYR . . . . . 0.501 ' CD2' ' O ' ' D' ' 325' ' ' GLY . 42.1 m-85 -148.23 109.28 4.28 Favored 'General case' 0 C--N 1.303 -1.453 0 O-C-N 121.339 -0.85 . . . . 0.46999999999999997 109.368 -179.998 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' D' D ' 328' ' ' PHE . . . . . 0.483 ' CZ ' ' HG3' ' B' ' 335' ' ' ARG . 81.6 m-85 -110.59 -170.11 1.58 Allowed 'General case' 0 N--CA 1.489 1.487 0 O-C-N 121.346 -0.846 . . . . 0.29999999999999999 109.319 -179.867 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' D' D ' 329' ' ' THR . . . . . 0.42 HG23 ' C ' ' D' ' 328' ' ' PHE . 73.4 p -153.8 162.14 41.49 Favored 'General case' 0 N--CA 1.488 1.449 0 O-C-N 121.222 -0.924 . . . . 0.22 109.271 -179.963 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' D' D ' 330' ' ' LEU . . . . . . . . . . . . . 16.0 tp -149.05 130.24 14.55 Favored 'General case' 0 N--CA 1.489 1.491 0 O-C-N 121.295 -0.878 . . . . 0.28000000000000003 109.43 -179.753 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' D' D ' 331' ' ' GLN . . . . . . . . . . . . . 2.0 tp60 -86.24 121.6 29.06 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.251 -0.906 . . . . 0.93000000000000005 109.474 -179.92 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' D' D ' 332' ' ' ILE . . . . . 0.848 HG21 ' HA ' ' D' ' 338' ' ' PHE . 71.9 mt -103.5 103.54 15.31 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.537 0 O-C-N 121.263 -0.898 . . . . 0.25 109.461 179.969 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' D' D ' 333' ' ' ARG . . . . . 0.466 ' HG2' ' CE1' ' B' ' 327' ' ' TYR . 0.3 OUTLIER -72.5 146.35 46.9 Favored 'General case' 0 N--CA 1.489 1.495 0 O-C-N 121.241 -0.912 . . . . 2.9300000000000002 109.407 179.976 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' D' D ' 334' ' ' GLY . . . . . . . . . . . . . . . 75.76 119.39 0.13 Allowed Glycine 0 N--CA 1.491 2.364 0 N-CA-C 109.574 -1.411 . . . . 0.40999999999999998 109.574 179.921 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' D' D ' 335' ' ' ARG . . . . . 0.449 ' O ' ' HB3' ' D' ' 338' ' ' PHE . 1.8 ttt180 -65.49 -27.49 68.52 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.245 -1.15 . . . . 3.0299999999999998 109.513 179.911 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' D' D ' 336' ' ' GLU . . . . . . . . . . . . . 23.2 tt0 -57.24 -63.75 1.12 Allowed 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.209 -0.932 . . . . 2.2599999999999998 109.643 -179.897 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' D' D ' 337' ' ' ARG . . . . . 0.561 ' HG3' ' NH1' ' D' ' 337' ' ' ARG . 0.6 OUTLIER -60.04 -27.16 66.7 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.225 -0.922 . . . . 2.9199999999999999 109.374 179.999 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' D' D ' 338' ' ' PHE . . . . . 0.848 ' HA ' HG21 ' D' ' 332' ' ' ILE . 83.8 t80 -55.39 -61.6 2.23 Favored 'General case' 0 N--CA 1.488 1.474 0 O-C-N 121.351 -0.843 . . . . 0.37 109.893 -179.8 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' D' D ' 339' ' ' GLU . . . . . . . . . . . . . 17.8 mt-10 -51.5 -33.72 32.8 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.173 -0.955 . . . . 1.99 110.131 -179.551 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' D' D ' 340' ' ' MET . . . . . . . . . . . . . 37.9 ttp -64.24 -52.85 56.75 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.143 -0.973 . . . . 0.31 110.382 -179.336 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' D' D ' 341' ' ' PHE . . . . . . . . . . . . . 42.5 m-85 -62.01 -46.16 90.44 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.223 -0.923 . . . . 0.17999999999999999 110.147 -179.228 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' D' D ' 342' ' ' ARG . . . . . 0.455 ' CG ' HH11 ' D' ' 342' ' ' ARG . 0.0 OUTLIER -48.28 -38.63 19.26 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.113 -0.992 . . . . 2.4100000000000001 109.869 -179.676 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' D' D ' 343' ' ' GLU . . . . . . . . . . . . . 33.1 tt0 -59.7 -51.32 70.27 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.121 -0.987 . . . . 2.3500000000000001 109.779 -179.705 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' D' D ' 344' ' ' LEU . . . . . 0.512 HD22 HD22 ' C' ' 344' ' ' LEU . 34.1 mt -61.45 -31.35 71.3 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.176 -0.953 . . . . 0.19 109.667 -179.911 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' D' D ' 345' ' ' ASN . . . . . . . . . . . . . 13.0 t-20 -57.91 -60.21 4.06 Favored 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.297 -0.877 . . . . 1.0900000000000001 109.758 -179.907 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' D' D ' 346' ' ' GLU . . . . . . . . . . . . . 25.9 tt0 -61.19 -26.76 67.94 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.279 -0.888 . . . . 1.6899999999999999 109.782 -179.741 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' D' D ' 347' ' ' ALA . . . . . 0.683 ' HB1' ' HB1' ' C' ' 347' ' ' ALA . . . -60.83 -59.1 5.91 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.127 -0.983 . . . . 0.17999999999999999 110.016 -179.743 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' D' D ' 348' ' ' LEU . . . . . 0.586 HD22 ' N ' ' D' ' 348' ' ' LEU . 3.8 mm? -62.17 -42.04 98.89 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.166 -0.959 . . . . 0.31 110.016 -179.533 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' D' D ' 349' ' ' GLU . . . . . . . . . . . . . 30.9 mt-10 -57.89 -37.31 73.76 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.195 -0.941 . . . . 1.95 110.182 -179.249 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' D' D ' 350' ' ' LEU . . . . . 0.814 HD13 HD22 ' C' ' 350' ' ' LEU . 6.0 tt -64.58 -44.28 91.19 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.106 -0.996 . . . . 0.42999999999999999 109.904 -179.563 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' D' D ' 351' ' ' LYS . . . . . . . . . . . . . 40.1 tttp -57.95 -37.82 74.85 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.208 -0.932 . . . . 1.3999999999999999 109.501 -179.746 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' D' D ' 352' ' ' ASP . . . . . . . . . . . . . 11.6 m-20 -55.22 -41.5 72.14 Favored 'General case' 0 N--CA 1.489 1.49 0 O-C-N 121.22 -0.925 . . . . 1.1699999999999999 109.433 179.834 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' D' D ' 353' ' ' ALA . . . . . . . . . . . . . . . -67.89 -30.71 70.12 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.316 -0.865 . . . . 0.58999999999999997 109.692 -179.837 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' D' D ' 354' ' ' GLN . . . . . . . . . . . . . 4.7 mt-30 -80.67 1.7 28.96 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.112 -0.993 . . . . 1.4399999999999999 109.59 -179.94 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' D' D ' 355' ' ' ALA . . . . . . . . . . . . . . . -69.14 -83.58 0.03 OUTLIER 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.173 -0.954 . . . . 0.97999999999999998 109.354 179.873 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' D' D ' 356' ' ' GLY . . . . . . . . . . . . . . . -62.72 99.45 0.26 Allowed Glycine 0 N--CA 1.489 2.204 0 N-CA-C 109.577 -1.409 . . . . 1.28 109.577 179.979 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' D' D ' 357' ' ' LYS . . . . . . . . . . . . . 16.7 mttt -86.25 150.21 24.53 Favored 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.282 -1.128 . . . . 4.0899999999999999 109.381 179.929 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' D' D ' 358' ' ' GLU . . . . . 0.412 ' HG2' ' HD2' ' D' ' 359' ' ' PRO . 2.8 mt-10 -49.5 161.97 0.46 Allowed Pre-proline 0 N--CA 1.49 1.556 0 O-C-N 121.266 -0.896 . . . . 5.71 109.56 -179.882 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' D' D ' 359' ' ' PRO . . . . . 0.412 ' HD2' ' HG2' ' D' ' 358' ' ' GLU . 3.1 Cg_exo -61.19 -156.21 0.02 OUTLIER 'Trans proline' 0 C--N 1.31 -1.457 0 C-N-CA 122.168 1.912 . . . . 4.9699999999999998 110.388 -179.985 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' D' D ' 360' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.264 0 CA-C-O 117.958 -1.468 . . . . 6.9699999999999998 109.502 -179.942 . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 319' ' ' LYS . . . . . 0.441 ' O ' ' N ' ' A' ' 321' ' ' LYS . 0.0 OUTLIER . . . . . 0 N--CA 1.488 1.472 0 N-CA-C 109.017 -0.735 . . . . 7.5499999999999998 109.017 . . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 320' ' ' LYS . . . . . 0.401 ' CG ' ' N ' ' A' ' 321' ' ' LYS . 2.8 tptt 55.51 -92.63 0.03 OUTLIER 'General case' 0 N--CA 1.488 1.474 0 O-C-N 121.031 -1.043 . . . . 6.4299999999999997 109.17 179.99 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 321' ' ' LYS . . . . . 0.441 ' N ' ' O ' ' A' ' 319' ' ' LYS . 0.2 OUTLIER -159.02 82.45 2.55 Favored Pre-proline 0 N--CA 1.491 1.596 0 O-C-N 121.349 -0.844 . . . . 6.1299999999999999 109.642 179.64 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 322' ' ' PRO . . . . . . . . . . . . . 1.9 Cg_endo -66.9 -4.33 11.13 Favored 'Trans proline' 0 C--N 1.309 -1.543 0 C-N-CA 122.481 2.121 . . . . 2.8300000000000001 110.597 179.863 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 323' ' ' LEU . . . . . 0.471 HD23 ' HA ' ' A' ' 323' ' ' LEU . 47.1 mt -84.95 59.74 5.8 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.329 -0.857 . . . . 2.8300000000000001 109.671 179.985 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 324' ' ' ASP . . . . . 0.426 ' OD1' ' N ' ' A' ' 324' ' ' ASP . 2.9 m-20 -81.23 -142.16 0.04 OUTLIER 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.217 -0.927 . . . . 1.53 109.52 -179.715 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 325' ' ' GLY . . . . . . . . . . . . . . . -66.88 -172.86 5.43 Favored Glycine 0 N--CA 1.49 2.296 0 N-CA-C 109.39 -1.484 . . . . 0.60999999999999999 109.39 -179.936 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 326' ' ' GLU . . . . . 0.443 ' HB2' ' CE1' ' A' ' 328' ' ' PHE . 30.6 mm-40 -60.74 178.99 0.19 Allowed 'General case' 0 N--CA 1.489 1.489 0 O-C-N 121.404 -1.057 . . . . 2.1299999999999999 109.779 -179.769 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 327' ' ' TYR . . . . . 0.632 ' CE2' ' CG ' ' C' ' 333' ' ' ARG . 44.2 m-85 -148.87 107.16 3.75 Favored 'General case' 0 N--CA 1.489 1.485 0 O-C-N 121.326 -0.859 . . . . 0.47999999999999998 109.523 -179.967 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 328' ' ' PHE . . . . . 0.443 ' CE1' ' HB2' ' A' ' 326' ' ' GLU . 5.5 m-85 -112.93 -166.17 1.06 Allowed 'General case' 0 N--CA 1.488 1.45 0 O-C-N 121.533 -0.729 . . . . 0.31 109.081 -179.891 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 329' ' ' THR . . . . . 0.444 ' HA ' ' O ' ' C' ' 330' ' ' LEU . 36.5 p -155.32 178.5 10.15 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.109 -0.995 . . . . 0.22 109.552 179.768 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 330' ' ' LEU . . . . . 0.465 ' O ' ' HA ' ' C' ' 329' ' ' THR . 67.8 tp -151.98 130.15 11.94 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.241 -0.912 . . . . 0.28000000000000003 109.024 179.937 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 331' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -87.54 109.2 19.45 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.365 -0.834 . . . . 0.91000000000000003 109.688 -179.724 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 332' ' ' ILE . . . . . 0.522 HG21 ' HA ' ' A' ' 338' ' ' PHE . 52.7 mt -102.25 110.7 29.69 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.521 0 O-C-N 120.941 -1.099 . . . . 0.26000000000000001 109.577 179.794 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 333' ' ' ARG . . . . . 0.533 ' HG2' ' CE1' ' C' ' 327' ' ' TYR . 0.0 OUTLIER -73.33 142.74 47.09 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.461 -0.774 . . . . 2.9199999999999999 109.632 179.523 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 334' ' ' GLY . . . . . . . . . . . . . . . 82.64 132.78 1.8 Allowed Glycine 0 N--CA 1.488 2.106 0 N-CA-C 109.653 -1.379 . . . . 0.40000000000000002 109.653 179.815 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 335' ' ' ARG . . . . . . . . . . . . . 10.2 ttp180 -79.95 -26.14 40.17 Favored 'General case' 0 C--N 1.302 -1.493 0 O-C-N 121.416 -1.049 . . . . 3.0099999999999998 109.002 179.696 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 336' ' ' GLU . . . . . . . . . . . . . 2.2 tt0 -58.2 -68.77 0.22 Allowed 'General case' 0 N--CA 1.488 1.467 0 O-C-N 121.14 -0.975 . . . . 2.29 109.649 -179.732 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 337' ' ' ARG . . . . . . . . . . . . . 2.8 mmt180 -60.17 -27.45 67.12 Favored 'General case' 0 N--CA 1.489 1.481 0 O-C-N 121.115 -0.991 . . . . 2.9300000000000002 109.421 179.752 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 338' ' ' PHE . . . . . 0.522 ' HA ' HG21 ' A' ' 332' ' ' ILE . 47.1 t80 -54.79 -58.72 6.45 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.254 -0.904 . . . . 0.38 109.604 179.914 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 339' ' ' GLU . . . . . . . . . . . . . 11.4 mt-10 -53.42 -31.82 46.93 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.176 -0.953 . . . . 1.97 109.996 -179.675 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 340' ' ' MET . . . . . . . . . . . . . 9.4 ttp -64.19 -50.64 67.32 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.249 -0.907 . . . . 0.31 109.953 -179.781 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 341' ' ' PHE . . . . . . . . . . . . . 48.2 m-85 -63.58 -50.38 69.68 Favored 'General case' 0 C--N 1.3 -1.57 0 O-C-N 121.246 -0.909 . . . . 0.17999999999999999 110.001 -179.327 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 342' ' ' ARG . . . . . . . . . . . . . 71.5 ttt180 -48.87 -40.39 29.5 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.142 -0.974 . . . . 2.4199999999999999 110.041 -179.373 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 343' ' ' GLU . . . . . . . . . . . . . 3.2 tt0 -61.57 -43.68 98.41 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.121 -0.987 . . . . 2.3500000000000001 110.038 -179.441 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 344' ' ' LEU . . . . . 0.995 HD22 HD22 ' B' ' 344' ' ' LEU . 45.9 mt -63.4 -41.69 98.74 Favored 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.084 -1.01 . . . . 0.17999999999999999 109.587 179.985 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 345' ' ' ASN . . . . . 0.494 HD22 HD11 ' C' ' 330' ' ' LEU . 46.4 t30 -56.45 -49.19 75.31 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.149 -0.969 . . . . 1.0900000000000001 109.932 -179.746 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 346' ' ' GLU . . . . . . . . . . . . . 11.5 tt0 -61.27 -30.16 70.3 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.177 -0.952 . . . . 1.6499999999999999 109.686 -179.702 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 347' ' ' ALA . . . . . 1.023 ' HB1' ' HB1' ' B' ' 347' ' ' ALA . . . -63.28 -49.21 74.96 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.333 -0.854 . . . . 0.17999999999999999 109.745 -179.983 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 348' ' ' LEU . . . . . 0.584 HD22 ' N ' ' A' ' 348' ' ' LEU . 4.3 mm? -62.66 -51.44 67.23 Favored 'General case' 0 N--CA 1.494 1.754 0 O-C-N 121.444 -0.785 . . . . 0.29999999999999999 109.833 -179.789 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 349' ' ' GLU . . . . . . . . . . . . . 26.2 mt-10 -58.09 -30.83 66.55 Favored 'General case' 0 N--CA 1.488 1.446 0 O-C-N 121.352 -0.842 . . . . 1.9399999999999999 109.738 -179.406 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 350' ' ' LEU . . . . . 0.845 HD23 ' O ' ' A' ' 350' ' ' LEU . 4.1 tt -63.93 -41.62 97.58 Favored 'General case' 0 C--N 1.304 -1.393 0 O-C-N 121.271 -0.893 . . . . 0.46000000000000002 109.064 179.972 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 351' ' ' LYS . . . . . . . . . . . . . 15.8 tttt -60.41 -41.8 94.66 Favored 'General case' 0 N--CA 1.486 1.37 0 O-C-N 121.336 -0.853 . . . . 1.3999999999999999 109.5 -179.863 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 352' ' ' ASP . . . . . . . . . . . . . 94.9 m-20 -55.71 -39.45 71.08 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.083 -1.01 . . . . 1.1599999999999999 109.951 -179.8 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 353' ' ' ALA . . . . . . . . . . . . . . . -66.05 -40.13 90.7 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.079 -1.013 . . . . 0.63 109.815 -179.669 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 354' ' ' GLN . . . . . . . . . . . . . 1.4 mt-30 -80.32 -7.31 59.0 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.127 -0.983 . . . . 1.47 109.573 -179.722 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 355' ' ' ALA . . . . . . . . . . . . . . . -70.92 -83.8 0.03 OUTLIER 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.032 -1.043 . . . . 1.01 109.822 -179.969 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 356' ' ' GLY . . . . . . . . . . . . . . . -71.05 89.96 0.41 Allowed Glycine 0 N--CA 1.49 2.283 0 N-CA-C 109.94 -1.264 . . . . 1.3 109.94 -179.779 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 357' ' ' LYS . . . . . . . . . . . . . 2.7 mttt -89.26 41.08 1.02 Allowed 'General case' 0 N--CA 1.487 1.38 0 O-C-N 121.403 -1.057 . . . . 4.0999999999999996 109.11 179.601 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 358' ' ' GLU . . . . . . . . . . . . . 65.6 tt0 -47.91 108.43 0.91 Allowed Pre-proline 0 N--CA 1.49 1.567 0 O-C-N 121.167 -0.958 . . . . 5.75 109.562 -179.927 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 359' ' ' PRO . . . . . . . . . . . . . 2.7 Cg_endo -62.31 113.79 2.07 Favored 'Trans proline' 0 C--N 1.313 -1.318 0 C-N-CA 121.879 1.719 . . . . 5.0 109.74 179.634 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 360' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.488 2.165 0 CA-C-O 118.016 -1.436 . . . . 6.9699999999999998 109.737 -179.928 . . . . . . . . 0 0 . 1 . 013 nuclear build full ' B' B ' 319' ' ' LYS . . . . . 0.413 ' O ' ' HD3' ' B' ' 322' ' ' PRO . 0.0 OUTLIER . . . . . 0 N--CA 1.491 1.615 0 N-CA-C 109.45 -0.574 . . . . 7.5499999999999998 109.45 . . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 320' ' ' LYS . . . . . . . . . . . . . 1.9 tptt 56.07 -93.23 0.04 OUTLIER 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.326 -0.859 . . . . 6.4400000000000004 109.345 179.783 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 321' ' ' LYS . . . . . 0.404 ' N ' ' O ' ' B' ' 319' ' ' LYS . 0.1 OUTLIER -159.15 81.11 2.64 Favored Pre-proline 0 N--CA 1.494 1.729 0 O-C-N 121.169 -0.957 . . . . 6.1299999999999999 109.783 179.689 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' B' B ' 322' ' ' PRO . . . . . 0.413 ' HD3' ' O ' ' B' ' 319' ' ' LYS . 2.0 Cg_endo -63.92 -4.07 6.82 Favored 'Trans proline' 0 C--N 1.313 -1.299 0 C-N-CA 122.428 2.085 . . . . 2.8199999999999998 110.96 179.834 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 323' ' ' LEU . . . . . 0.452 ' HA ' HD23 ' B' ' 323' ' ' LEU . 55.5 mt -84.69 61.66 6.88 Favored 'General case' 0 N--CA 1.489 1.525 0 O-C-N 121.067 -1.021 . . . . 2.8399999999999999 109.835 -179.733 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 324' ' ' ASP . . . . . 0.424 ' N ' ' OD1' ' B' ' 324' ' ' ASP . 2.5 m-20 -82.03 -144.65 0.06 Allowed 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.261 -0.9 . . . . 1.53 109.352 179.792 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 325' ' ' GLY . . . . . 0.402 ' O ' ' CE1' ' B' ' 327' ' ' TYR . . . -65.35 -175.98 5.56 Favored Glycine 0 N--CA 1.487 2.053 0 N-CA-C 109.252 -1.539 . . . . 0.58999999999999997 109.252 179.791 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 326' ' ' GLU . . . . . 0.429 ' HB2' ' CE1' ' B' ' 328' ' ' PHE . 26.2 mm-40 -59.02 178.12 0.13 Allowed 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.179 -1.189 . . . . 2.1299999999999999 109.846 -179.809 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 327' ' ' TYR . . . . . 0.518 ' CE2' ' HG2' ' D' ' 333' ' ' ARG . 42.0 m-85 -147.38 108.04 4.14 Favored 'General case' 0 N--CA 1.488 1.457 0 O-C-N 121.149 -0.969 . . . . 0.47999999999999998 109.699 -179.934 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 328' ' ' PHE . . . . . 0.433 ' O ' HG23 ' B' ' 329' ' ' THR . 4.9 m-85 -113.04 -166.46 1.08 Allowed 'General case' 0 N--CA 1.488 1.438 0 O-C-N 121.441 -0.787 . . . . 0.32000000000000001 109.486 179.772 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 329' ' ' THR . . . . . 0.459 ' HA ' ' O ' ' D' ' 330' ' ' LEU . 28.8 p -155.27 178.66 9.97 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.003 -1.061 . . . . 0.23000000000000001 109.847 179.917 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 330' ' ' LEU . . . . . 0.458 HD21 ' HB2' ' D' ' 345' ' ' ASN . 62.9 tp -151.24 129.98 12.36 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.557 -0.714 . . . . 0.28000000000000003 109.396 179.823 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 331' ' ' GLN . . . . . 0.415 ' HA ' HG22 ' D' ' 329' ' ' THR . 0.3 OUTLIER -88.45 110.81 21.14 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.126 -0.984 . . . . 0.91000000000000003 109.557 -179.75 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' B' B ' 332' ' ' ILE . . . . . 0.579 HG21 ' HA ' ' B' ' 338' ' ' PHE . 50.7 mt -103.68 109.27 26.61 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.759 0 O-C-N 121.257 -0.902 . . . . 0.23999999999999999 110.075 -179.516 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 333' ' ' ARG . . . . . 0.5 ' HG2' ' CE2' ' D' ' 327' ' ' TYR . 0.0 OUTLIER -72.1 142.72 49.17 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.086 -1.009 . . . . 2.9300000000000002 109.349 179.798 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' B' B ' 334' ' ' GLY . . . . . . . . . . . . . . . 82.12 132.63 1.61 Allowed Glycine 0 N--CA 1.489 2.224 0 N-CA-C 109.814 -1.314 . . . . 0.40000000000000002 109.814 179.68 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 335' ' ' ARG . . . . . . . . . . . . . 11.3 ttp180 -78.95 -26.71 43.55 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.488 -1.007 . . . . 3.0099999999999998 109.437 179.77 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 336' ' ' GLU . . . . . . . . . . . . . 2.5 tt0 -58.04 -69.16 0.19 Allowed 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.191 -0.943 . . . . 2.2799999999999998 109.578 179.864 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 337' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -59.86 -28.0 67.14 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.273 -0.892 . . . . 2.9300000000000002 109.336 -179.898 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 338' ' ' PHE . . . . . 0.579 ' HA ' HG21 ' B' ' 332' ' ' ILE . 49.7 t80 -55.15 -59.58 4.57 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.214 -0.929 . . . . 0.37 109.534 179.775 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 339' ' ' GLU . . . . . . . . . . . . . 9.4 mt-10 -53.13 -33.08 50.78 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.199 -0.938 . . . . 1.98 109.748 -179.873 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 340' ' ' MET . . . . . . . . . . . . . 9.7 ttp -62.95 -51.33 67.33 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 120.955 -1.091 . . . . 0.32000000000000001 109.808 -179.637 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 341' ' ' PHE . . . . . . . . . . . . . 48.7 m-85 -62.6 -48.78 77.94 Favored 'General case' 0 N--CA 1.488 1.465 0 O-C-N 121.171 -0.956 . . . . 0.17999999999999999 109.968 -179.606 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 342' ' ' ARG . . . . . . . . . . . . . 70.7 ttt180 -48.62 -44.11 36.97 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.066 -1.021 . . . . 2.4199999999999999 109.834 -179.791 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 343' ' ' GLU . . . . . . . . . . . . . 3.1 tt0 -58.05 -44.14 87.27 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.321 -0.862 . . . . 2.3500000000000001 110.086 -179.309 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 344' ' ' LEU . . . . . 0.995 HD22 HD22 ' A' ' 344' ' ' LEU . 58.8 mt -63.85 -40.85 97.55 Favored 'General case' 0 N--CA 1.494 1.74 0 O-C-N 121.186 -0.946 . . . . 0.17999999999999999 109.746 -179.982 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 345' ' ' ASN . . . . . 0.426 ' HA ' ' CZ ' ' D' ' 341' ' ' PHE . 48.6 t30 -57.02 -50.21 73.43 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.354 -0.841 . . . . 1.0900000000000001 109.753 -179.852 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 346' ' ' GLU . . . . . . . . . . . . . 12.4 tt0 -61.58 -30.37 70.63 Favored 'General case' 0 N--CA 1.488 1.447 0 O-C-N 121.04 -1.038 . . . . 1.6599999999999999 109.552 -179.876 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 347' ' ' ALA . . . . . 1.023 ' HB1' ' HB1' ' A' ' 347' ' ' ALA . . . -62.46 -48.85 77.8 Favored 'General case' 0 N--CA 1.493 1.692 0 O-C-N 121.2 -0.938 . . . . 0.17000000000000001 110.038 -179.836 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 348' ' ' LEU . . . . . 0.577 HD22 ' N ' ' B' ' 348' ' ' LEU . 4.2 mm? -64.07 -50.87 66.65 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 120.996 -1.065 . . . . 0.28999999999999998 109.584 -179.859 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 349' ' ' GLU . . . . . . . . . . . . . 29.3 mt-10 -56.5 -31.63 64.26 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.401 -0.812 . . . . 1.95 110.055 -179.321 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 350' ' ' LEU . . . . . 0.829 HD23 ' O ' ' B' ' 350' ' ' LEU . 3.6 tt -63.88 -40.56 96.83 Favored 'General case' 0 N--CA 1.489 1.493 0 O-C-N 121.352 -0.842 . . . . 0.45000000000000001 109.321 -179.934 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 351' ' ' LYS . . . . . . . . . . . . . 15.9 tttt -60.68 -41.99 96.19 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.199 -0.938 . . . . 1.3799999999999999 109.452 179.949 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 352' ' ' ASP . . . . . . . . . . . . . 94.6 m-20 -56.0 -40.22 73.04 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.311 -0.868 . . . . 1.1599999999999999 109.883 -179.723 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 353' ' ' ALA . . . . . . . . . . . . . . . -66.22 -40.34 90.22 Favored 'General case' 0 N--CA 1.494 1.74 0 O-C-N 121.073 -1.017 . . . . 0.60999999999999999 109.572 -179.644 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 354' ' ' GLN . . . . . . . . . . . . . 1.7 mt-30 -80.5 -5.66 56.99 Favored 'General case' 0 C--N 1.302 -1.471 0 O-C-N 121.323 -0.861 . . . . 1.45 109.817 -179.588 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 355' ' ' ALA . . . . . . . . . . . . . . . -73.08 -84.39 0.04 OUTLIER 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.096 -1.003 . . . . 0.97999999999999998 110.04 179.927 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 356' ' ' GLY . . . . . . . . . . . . . . . -70.46 88.64 0.34 Allowed Glycine 0 N--CA 1.491 2.331 0 N-CA-C 110.231 -1.148 . . . . 1.29 110.231 -179.566 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 357' ' ' LYS . . . . . . . . . . . . . 3.7 mttt -88.42 38.87 0.88 Allowed 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.279 -1.13 . . . . 4.0899999999999999 109.424 179.13 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 358' ' ' GLU . . . . . . . . . . . . . 59.3 tt0 -46.47 108.89 0.9 Allowed Pre-proline 0 N--CA 1.492 1.66 0 O-C-N 121.105 -0.997 . . . . 5.7199999999999998 109.82 179.93 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 359' ' ' PRO . . . . . . . . . . . . . 1.8 Cg_endo -62.38 114.67 2.46 Favored 'Trans proline' 0 C--N 1.312 -1.385 0 C-N-CA 121.913 1.742 . . . . 4.9800000000000004 109.783 -179.985 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 360' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.488 2.135 0 CA-C-O 117.87 -1.517 . . . . 6.9800000000000004 109.578 -179.647 . . . . . . . . 0 0 . 1 . 013 nuclear build full ' C' C ' 319' ' ' LYS . . . . . 0.423 ' O ' ' CB ' ' C' ' 320' ' ' LYS . 4.1 mmtm . . . . . 0 N--CA 1.489 1.509 0 N-CA-C 109.119 -0.697 . . . . 6.8200000000000003 109.119 . . . . . . . . . 1 1 . 1 . 013 nuclear build full ' C' C ' 320' ' ' LYS . . . . . 0.423 ' CB ' ' O ' ' C' ' 319' ' ' LYS . 0.0 OUTLIER 69.8 6.84 5.93 Favored 'General case' 0 N--CA 1.488 1.445 0 O-C-N 121.383 -0.823 . . . . 6.4900000000000002 109.418 -179.71 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' C' C ' 321' ' ' LYS . . . . . 0.593 ' CB ' ' HD3' ' C' ' 322' ' ' PRO . 0.7 OUTLIER -81.94 -58.42 0.47 Allowed Pre-proline 0 N--CA 1.493 1.691 0 O-C-N 121.187 -0.946 . . . . 6.4000000000000004 110.052 -179.955 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' C' C ' 322' ' ' PRO . . . . . 0.593 ' HD3' ' CB ' ' C' ' 321' ' ' LYS . 1.8 Cg_endo -64.14 138.79 63.46 Favored 'Trans proline' 0 C--N 1.315 -1.205 0 C-N-CA 121.809 1.673 . . . . 3.4199999999999999 109.971 -179.96 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' C' C ' 323' ' ' LEU . . . . . . . . . . . . . 14.1 mt -82.18 -159.86 0.33 Allowed 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.153 -0.967 . . . . 3.9500000000000002 109.208 179.72 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' C' C ' 324' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -81.83 126.7 32.18 Favored 'General case' 0 C--N 1.304 -1.4 0 O-C-N 120.958 -1.089 . . . . 1.6299999999999999 108.955 179.872 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' C' C ' 325' ' ' GLY . . . . . 0.459 ' O ' ' CE2' ' C' ' 327' ' ' TYR . . . -68.92 179.61 22.96 Favored Glycine 0 N--CA 1.492 2.394 0 N-CA-C 109.666 -1.374 . . . . 0.72999999999999998 109.666 -179.394 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' C' C ' 326' ' ' GLU . . . . . . . . . . . . . 69.0 mm-40 -58.88 174.08 0.38 Allowed 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.199 -1.177 . . . . 2.1699999999999999 109.098 179.728 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' C' C ' 327' ' ' TYR . . . . . 0.533 ' CE1' ' HG2' ' A' ' 333' ' ' ARG . 47.9 m-85 -151.76 90.61 1.56 Allowed 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.005 -1.06 . . . . 0.47999999999999998 109.961 -179.514 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' C' C ' 328' ' ' PHE . . . . . 0.489 ' O ' ' CG2' ' C' ' 329' ' ' THR . 37.4 m-85 -99.34 -159.57 0.75 Allowed 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.171 -0.955 . . . . 0.33000000000000002 109.361 179.588 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' C' C ' 329' ' ' THR . . . . . 0.489 ' CG2' ' O ' ' C' ' 328' ' ' PHE . 75.7 p -157.55 -177.96 6.98 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.452 -0.78 . . . . 0.23000000000000001 109.481 -179.948 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' C' C ' 330' ' ' LEU . . . . . 0.494 HD11 HD22 ' A' ' 345' ' ' ASN . 38.6 tp -154.45 127.61 8.37 Favored 'General case' 0 C--N 1.302 -1.492 0 O-C-N 121.32 -0.862 . . . . 0.28000000000000003 109.798 -179.705 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' C' C ' 331' ' ' GLN . . . . . . . . . . . . . 37.5 tp60 -84.68 107.21 16.76 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.163 -0.961 . . . . 1.48 109.625 179.776 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' C' C ' 332' ' ' ILE . . . . . 0.519 HG21 ' HA ' ' C' ' 338' ' ' PHE . 61.1 mt -104.63 107.88 23.52 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.56 0 O-C-N 121.148 -0.97 . . . . 0.23999999999999999 109.8 -179.831 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' C' C ' 333' ' ' ARG . . . . . 0.632 ' CG ' ' CE2' ' A' ' 327' ' ' TYR . 6.8 mpt_? -74.14 139.52 44.57 Favored 'General case' 0 N--CA 1.488 1.43 0 O-C-N 121.454 -0.779 . . . . 2.7400000000000002 109.757 179.969 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' C' C ' 334' ' ' GLY . . . . . . . . . . . . . . . 87.92 129.98 3.21 Favored Glycine 0 N--CA 1.494 2.528 0 N-CA-C 109.985 -1.246 . . . . 0.34999999999999998 109.985 179.506 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' C' C ' 335' ' ' ARG . . . . . 0.469 ' NH2' ' OE1' ' C' ' 339' ' ' GLU . 2.9 ttp180 -79.87 -28.76 39.91 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.522 -0.987 . . . . 2.5299999999999998 110.002 -179.95 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' C' C ' 336' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -56.04 -72.7 0.07 Allowed 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.136 -0.977 . . . . 2.6200000000000001 109.873 -179.388 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' C' C ' 337' ' ' ARG . . . . . . . . . . . . . 99.3 mtt180 -60.09 -27.47 67.03 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.355 -0.841 . . . . 2.8100000000000001 109.566 179.942 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' C' C ' 338' ' ' PHE . . . . . 0.519 ' HA ' HG21 ' C' ' 332' ' ' ILE . 45.7 t80 -53.15 -61.34 2.36 Favored 'General case' 0 N--CA 1.487 1.39 0 O-C-N 121.19 -0.944 . . . . 0.40000000000000002 109.249 179.942 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' C' C ' 339' ' ' GLU . . . . . 0.469 ' OE1' ' NH2' ' C' ' 335' ' ' ARG . 57.6 mt-10 -50.01 -30.74 11.22 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.406 -0.809 . . . . 2.0499999999999998 109.823 -180.0 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' C' C ' 340' ' ' MET . . . . . . . . . . . . . 27.1 ttp -64.72 -51.04 64.52 Favored 'General case' 0 N--CA 1.496 1.833 0 O-C-N 121.361 -0.837 . . . . 0.32000000000000001 109.995 -179.49 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' C' C ' 341' ' ' PHE . . . . . . . . . . . . . 49.7 m-85 -63.82 -49.58 72.3 Favored 'General case' 0 N--CA 1.494 1.732 0 O-C-N 121.229 -0.919 . . . . 0.17999999999999999 109.888 -179.507 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' C' C ' 342' ' ' ARG . . . . . . . . . . . . . 16.3 ttp180 -48.3 -43.16 32.68 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.172 -0.955 . . . . 2.9100000000000001 109.804 -179.916 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' C' C ' 343' ' ' GLU . . . . . . . . . . . . . 4.0 tt0 -59.4 -44.32 92.84 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.075 -1.016 . . . . 2.1400000000000001 110.408 -179.361 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' C' C ' 344' ' ' LEU . . . . . 0.614 HD22 HD22 ' D' ' 344' ' ' LEU . 46.2 mt -64.19 -37.03 85.99 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 120.802 -1.186 . . . . 0.22 109.96 -179.604 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' C' C ' 345' ' ' ASN . . . . . 0.448 ' HB2' HD21 ' A' ' 330' ' ' LEU . 52.2 t-20 -56.68 -46.91 80.87 Favored 'General case' 0 C--N 1.301 -1.536 0 O-C-N 121.065 -1.022 . . . . 1.0800000000000001 109.107 -179.825 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' C' C ' 346' ' ' GLU . . . . . . . . . . . . . 32.6 tt0 -62.11 -30.65 71.16 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.281 -0.887 . . . . 2.21 109.518 179.737 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' C' C ' 347' ' ' ALA . . . . . 1.007 ' HB1' ' HB1' ' D' ' 347' ' ' ALA . . . -61.66 -51.55 67.99 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.098 -1.001 . . . . 0.17999999999999999 109.735 179.668 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' C' C ' 348' ' ' LEU . . . . . 0.548 ' N ' HD22 ' C' ' 348' ' ' LEU . 4.4 mm? -61.88 -53.22 58.82 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.162 -0.961 . . . . 0.32000000000000001 110.471 -179.249 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' C' C ' 349' ' ' GLU . . . . . 0.412 ' O ' ' HB2' ' C' ' 352' ' ' ASP . 9.6 mt-10 -57.23 -32.47 66.57 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.097 -1.002 . . . . 2.1899999999999999 109.21 -179.727 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' C' C ' 350' ' ' LEU . . . . . 0.925 ' CD2' HD13 ' D' ' 350' ' ' LEU . 5.1 tt -62.48 -42.51 99.54 Favored 'General case' 0 C--N 1.301 -1.506 0 N-CA-C 109.383 -0.599 . . . . 0.46000000000000002 109.383 179.926 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' C' C ' 351' ' ' LYS . . . . . 0.51 ' N ' HD23 ' C' ' 350' ' ' LEU . 0.0 OUTLIER -58.6 -34.06 70.69 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.158 -0.964 . . . . 1.3500000000000001 109.593 179.983 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' C' C ' 352' ' ' ASP . . . . . 0.412 ' HB2' ' O ' ' C' ' 349' ' ' GLU . 7.9 m-20 -55.62 -40.3 71.94 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.254 -0.904 . . . . 1.1899999999999999 109.015 179.98 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' C' C ' 353' ' ' ALA . . . . . . . . . . . . . . . -67.64 -27.41 66.85 Favored 'General case' 0 N--CA 1.488 1.467 0 O-C-N 121.244 -0.91 . . . . 0.56999999999999995 109.114 179.809 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' C' C ' 354' ' ' GLN . . . . . 0.492 ' CD ' HD11 ' D' ' 350' ' ' LEU . 0.0 OUTLIER -79.1 -1.09 34.29 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.469 -0.769 . . . . 1.47 109.773 -179.907 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' C' C ' 355' ' ' ALA . . . . . . . . . . . . . . . -68.99 -91.49 0.01 OUTLIER 'General case' 0 N--CA 1.488 1.427 0 O-C-N 120.895 -1.128 . . . . 0.93000000000000005 108.674 179.879 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' C' C ' 356' ' ' GLY . . . . . . . . . . . . . . . -73.47 113.76 4.39 Favored Glycine 0 N--CA 1.492 2.432 0 N-CA-C 108.857 -1.697 . . . . 1.3300000000000001 108.857 179.205 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' C' C ' 357' ' ' LYS . . . . . . . . . . . . . 3.5 pttp -87.8 132.92 33.99 Favored 'General case' 0 N--CA 1.491 1.625 0 O-C-N 121.166 -1.197 . . . . 4.0099999999999998 110.118 -179.371 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' C' C ' 358' ' ' GLU . . . . . 0.437 ' CG ' ' HD2' ' C' ' 359' ' ' PRO . 5.3 tt0 -47.1 140.18 6.75 Favored Pre-proline 0 N--CA 1.493 1.715 0 O-C-N 121.372 -0.83 . . . . 5.75 109.177 179.917 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' C' C ' 359' ' ' PRO . . . . . 0.437 ' HD2' ' CG ' ' C' ' 358' ' ' GLU . 5.3 Cg_exo -59.39 -153.64 0.01 OUTLIER 'Trans proline' 0 C--N 1.312 -1.392 0 C-N-CA 121.901 1.734 . . . . 4.9400000000000004 109.979 179.781 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' C' C ' 360' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.261 0 N-CA-C 109.498 -1.441 . . . . 6.5 109.498 179.783 . . . . . . . . 0 0 . 1 . 013 nuclear build full ' D' D ' 319' ' ' LYS . . . . . 0.421 ' O ' ' N ' ' D' ' 321' ' ' LYS . 0.0 OUTLIER . . . . . 0 N--CA 1.492 1.668 0 N-CA-C 109.342 -0.614 . . . . 7.5300000000000002 109.342 . . . . . . . . . 2 2 . 1 . 013 nuclear build full ' D' D ' 320' ' ' LYS . . . . . 0.404 ' CG ' ' N ' ' D' ' 321' ' ' LYS . 2.1 tptt 55.69 -93.28 0.04 OUTLIER 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.053 -1.029 . . . . 6.4100000000000001 109.283 -179.602 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' D' D ' 321' ' ' LYS . . . . . 0.421 ' N ' ' O ' ' D' ' 319' ' ' LYS . 0.0 OUTLIER -158.59 83.24 2.61 Favored Pre-proline 0 N--CA 1.49 1.574 0 O-C-N 121.092 -1.005 . . . . 6.1100000000000003 109.516 179.706 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' D' D ' 322' ' ' PRO . . . . . . . . . . . . . 1.0 OUTLIER -66.15 -3.01 7.82 Favored 'Trans proline' 0 C--N 1.312 -1.389 0 C-N-CA 122.357 2.038 . . . . 2.8199999999999998 111.089 179.872 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' D' D ' 323' ' ' LEU . . . . . 0.443 HD23 ' HA ' ' D' ' 323' ' ' LEU . 55.1 mt -85.47 61.17 6.69 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.102 -0.999 . . . . 2.8300000000000001 110.042 -179.846 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' D' D ' 324' ' ' ASP . . . . . 0.458 ' N ' ' OD1' ' D' ' 324' ' ' ASP . 1.6 m-20 -81.91 -144.02 0.06 Allowed 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.301 -0.874 . . . . 1.54 109.593 179.946 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' D' D ' 325' ' ' GLY . . . . . 0.442 ' O ' ' CE1' ' D' ' 327' ' ' TYR . . . -64.92 -177.31 5.82 Favored Glycine 0 N--CA 1.489 2.215 0 N-CA-C 109.489 -1.445 . . . . 0.58999999999999997 109.489 179.893 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' D' D ' 326' ' ' GLU . . . . . 0.421 ' HB2' ' CE1' ' D' ' 328' ' ' PHE . 24.9 mm-40 -57.65 179.77 0.06 Allowed 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.418 -1.048 . . . . 2.1299999999999999 109.721 -179.711 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' D' D ' 327' ' ' TYR . . . . . 0.5 ' CE2' ' HG2' ' B' ' 333' ' ' ARG . 42.5 m-85 -149.01 108.8 4.03 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.353 -0.842 . . . . 0.46999999999999997 109.674 -179.988 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' D' D ' 328' ' ' PHE . . . . . 0.423 ' CD1' ' N ' ' D' ' 328' ' ' PHE . 4.3 m-85 -114.02 -167.51 1.22 Allowed 'General case' 0 N--CA 1.489 1.499 0 O-C-N 121.473 -0.767 . . . . 0.29999999999999999 108.986 179.813 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' D' D ' 329' ' ' THR . . . . . 0.457 ' HA ' ' O ' ' B' ' 330' ' ' LEU . 27.0 p -154.71 176.7 12.11 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.017 -1.052 . . . . 0.22 109.701 179.953 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' D' D ' 330' ' ' LEU . . . . . 0.459 ' O ' ' HA ' ' B' ' 329' ' ' THR . 64.5 tp -149.81 129.32 13.05 Favored 'General case' 0 N--CA 1.489 1.488 0 O-C-N 121.057 -1.027 . . . . 0.28000000000000003 109.508 -179.786 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' D' D ' 331' ' ' GLN . . . . . 0.406 ' HA ' HG22 ' B' ' 329' ' ' THR . 0.0 OUTLIER -87.79 111.01 20.91 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.395 -0.816 . . . . 0.93000000000000005 109.695 -179.882 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' D' D ' 332' ' ' ILE . . . . . 0.588 HG21 ' HA ' ' D' ' 338' ' ' PHE . 57.8 mt -103.57 111.89 34.99 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.595 0 O-C-N 121.308 -0.87 . . . . 0.25 109.793 179.987 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' D' D ' 333' ' ' ARG . . . . . 0.518 ' HG2' ' CE2' ' B' ' 327' ' ' TYR . 0.0 OUTLIER -73.86 141.13 46.12 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.145 -0.972 . . . . 2.9300000000000002 109.4 179.72 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' D' D ' 334' ' ' GLY . . . . . . . . . . . . . . . 83.29 132.27 1.94 Allowed Glycine 0 N--CA 1.493 2.473 0 N-CA-C 109.866 -1.294 . . . . 0.40999999999999998 109.866 179.921 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' D' D ' 335' ' ' ARG . . . . . . . . . . . . . 11.7 ttp180 -78.32 -25.86 46.67 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.206 -1.173 . . . . 3.0299999999999998 109.12 179.668 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' D' D ' 336' ' ' GLU . . . . . . . . . . . . . 2.8 tt0 -58.93 -67.96 0.32 Allowed 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.318 -0.864 . . . . 2.2599999999999998 109.991 -179.692 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' D' D ' 337' ' ' ARG . . . . . 0.402 ' HA ' ' HD2' ' D' ' 337' ' ' ARG . 1.0 OUTLIER -61.97 -26.46 68.22 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 120.857 -1.152 . . . . 2.9199999999999999 109.026 179.951 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' D' D ' 338' ' ' PHE . . . . . 0.588 ' HA ' HG21 ' D' ' 332' ' ' ILE . 47.7 t80 -54.67 -60.9 2.72 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.344 -0.847 . . . . 0.37 109.303 179.553 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' D' D ' 339' ' ' GLU . . . . . . . . . . . . . 8.4 mt-10 -52.02 -34.03 41.13 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.247 -0.908 . . . . 1.99 109.848 -179.754 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' D' D ' 340' ' ' MET . . . . . . . . . . . . . 8.9 ttp -62.02 -50.26 72.76 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.2 -0.937 . . . . 0.31 109.923 -179.735 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' D' D ' 341' ' ' PHE . . . . . 0.426 ' CZ ' ' HA ' ' B' ' 345' ' ' ASN . 52.2 m-85 -63.73 -48.9 75.17 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 120.797 -1.19 . . . . 0.17999999999999999 110.209 -179.638 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' D' D ' 342' ' ' ARG . . . . . . . . . . . . . 71.3 ttt180 -48.66 -44.96 38.13 Favored 'General case' 0 C--N 1.302 -1.498 0 O-C-N 121.296 -0.878 . . . . 2.4100000000000001 109.834 -179.358 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' D' D ' 343' ' ' GLU . . . . . . . . . . . . . 3.0 tt0 -56.49 -45.48 80.95 Favored 'General case' 0 N--CA 1.489 1.494 0 O-C-N 121.204 -0.935 . . . . 2.3500000000000001 109.902 -179.489 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' D' D ' 344' ' ' LEU . . . . . 0.614 HD22 HD22 ' C' ' 344' ' ' LEU . 47.4 mt -62.94 -40.51 97.86 Favored 'General case' 0 N--CA 1.494 1.757 0 O-C-N 121.147 -0.971 . . . . 0.19 110.088 -179.712 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' D' D ' 345' ' ' ASN . . . . . 0.458 ' HB2' HD21 ' B' ' 330' ' ' LEU . 55.5 t30 -56.86 -49.47 75.4 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.173 -0.954 . . . . 1.0900000000000001 109.71 -179.605 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' D' D ' 346' ' ' GLU . . . . . . . . . . . . . 9.2 tt0 -61.9 -29.91 70.53 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.365 -0.834 . . . . 1.6899999999999999 109.747 -179.929 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' D' D ' 347' ' ' ALA . . . . . 1.007 ' HB1' ' HB1' ' C' ' 347' ' ' ALA . . . -62.52 -49.47 75.19 Favored 'General case' 0 N--CA 1.494 1.739 0 O-C-N 121.112 -0.993 . . . . 0.17999999999999999 109.977 -179.984 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' D' D ' 348' ' ' LEU . . . . . 0.592 HD22 ' N ' ' D' ' 348' ' ' LEU . 4.2 mm? -63.23 -52.61 61.51 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.154 -0.966 . . . . 0.31 109.524 -179.683 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' D' D ' 349' ' ' GLU . . . . . . . . . . . . . 25.1 mt-10 -55.36 -31.18 61.54 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.494 -0.754 . . . . 1.95 109.948 -179.683 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' D' D ' 350' ' ' LEU . . . . . 0.925 HD13 ' CD2' ' C' ' 350' ' ' LEU . 4.4 tt -64.6 -41.3 96.31 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.316 -0.865 . . . . 0.42999999999999999 109.106 179.982 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' D' D ' 351' ' ' LYS . . . . . . . . . . . . . 17.8 tttt -59.04 -44.01 91.72 Favored 'General case' 0 N--CA 1.489 1.497 0 O-C-N 121.278 -0.889 . . . . 1.3999999999999999 109.648 -179.973 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' D' D ' 352' ' ' ASP . . . . . . . . . . . . . 86.6 m-20 -55.1 -40.32 70.32 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.421 -0.799 . . . . 1.1699999999999999 110.125 -179.404 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' D' D ' 353' ' ' ALA . . . . . . . . . . . . . . . -66.19 -38.39 87.9 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.239 -0.913 . . . . 0.58999999999999997 109.741 -179.658 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' D' D ' 354' ' ' GLN . . . . . . . . . . . . . 1.3 mt-30 -81.76 -6.09 58.74 Favored 'General case' 0 C--N 1.302 -1.484 0 O-C-N 121.238 -0.914 . . . . 1.4399999999999999 109.873 -179.541 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' D' D ' 355' ' ' ALA . . . . . . . . . . . . . . . -73.35 -85.71 0.03 OUTLIER 'General case' 0 N--CA 1.488 1.455 0 O-C-N 121.218 -0.926 . . . . 0.97999999999999998 109.847 -179.747 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' D' D ' 356' ' ' GLY . . . . . . . . . . . . . . . -67.85 86.19 0.16 Allowed Glycine 0 N--CA 1.495 2.614 0 N-CA-C 110.265 -1.134 . . . . 1.28 110.265 -179.554 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' D' D ' 357' ' ' LYS . . . . . . . . . . . . . 2.8 mttt -87.99 39.11 0.88 Allowed 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.116 -1.226 . . . . 4.0899999999999999 109.311 179.765 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' D' D ' 358' ' ' GLU . . . . . . . . . . . . . 50.0 tt0 -47.16 109.62 1.11 Allowed Pre-proline 0 N--CA 1.495 1.791 0 O-C-N 121.123 -0.986 . . . . 5.71 109.79 -179.884 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' D' D ' 359' ' ' PRO . . . . . . . . . . . . . 1.6 Cg_endo -62.21 113.79 2.05 Favored 'Trans proline' 0 C--N 1.315 -1.205 0 C-N-CA 122.064 1.843 . . . . 4.9699999999999998 110.411 179.831 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' D' D ' 360' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.218 0 N-CA-C 109.172 -1.571 . . . . 6.9699999999999998 109.172 179.631 . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 319' ' ' LYS . . . . . 0.418 ' O ' ' O ' ' A' ' 320' ' ' LYS . 0.9 OUTLIER . . . . . 0 N--CA 1.491 1.582 0 CA-C-O 121.304 0.574 . . . . 7.5499999999999998 109.466 . . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 320' ' ' LYS . . . . . 0.418 ' O ' ' O ' ' A' ' 319' ' ' LYS . 0.1 OUTLIER 63.07 135.93 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.207 -0.933 . . . . 6.4299999999999997 109.401 179.995 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 321' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -157.94 79.73 3.25 Favored Pre-proline 0 N--CA 1.49 1.538 0 O-C-N 121.285 -0.885 . . . . 6.1299999999999999 109.491 -179.979 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 322' ' ' PRO . . . . . . . . . . . . . 3.4 Cg_exo -60.51 157.54 36.09 Favored 'Trans proline' 0 C--N 1.309 -1.518 0 C-N-CA 122.184 1.923 . . . . 2.8300000000000001 110.1 179.964 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 323' ' ' LEU . . . . . . . . . . . . . 42.8 mt -80.87 113.97 19.44 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.205 -0.934 . . . . 2.8300000000000001 109.715 -179.954 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 324' ' ' ASP . . . . . 0.418 ' HB2' ' OH ' ' A' ' 327' ' ' TYR . 26.9 m-20 -80.88 -156.67 0.14 Allowed 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.343 -0.848 . . . . 1.53 109.476 179.882 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 325' ' ' GLY . . . . . . . . . . . . . . . -68.86 -173.55 8.69 Favored Glycine 0 N--CA 1.49 2.264 0 N-CA-C 109.671 -1.371 . . . . 0.60999999999999999 109.671 -179.956 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 326' ' ' GLU . . . . . . . . . . . . . 4.3 mm-40 -59.11 -174.09 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.258 -1.142 . . . . 2.1299999999999999 109.499 179.976 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 327' ' ' TYR . . . . . 0.604 ' CE2' ' HG2' ' C' ' 333' ' ' ARG . 43.4 m-85 -149.52 106.11 3.53 Favored 'General case' 0 N--CA 1.488 1.444 0 O-C-N 121.289 -0.882 . . . . 0.47999999999999998 109.56 179.837 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 328' ' ' PHE . . . . . 0.442 ' O ' ' NE2' ' C' ' 331' ' ' GLN . 22.6 m-85 -111.98 -167.57 1.2 Allowed 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.388 -0.82 . . . . 0.31 108.938 179.717 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 329' ' ' THR . . . . . 0.422 ' HA ' ' O ' ' C' ' 330' ' ' LEU . 77.7 p -153.59 -179.73 8.05 Favored 'General case' 0 C--N 1.303 -1.441 0 O-C-N 121.152 -0.968 . . . . 0.22 109.374 179.883 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 330' ' ' LEU . . . . . 0.428 ' O ' ' HA ' ' C' ' 329' ' ' THR . 52.1 tp -152.73 131.96 12.76 Favored 'General case' 0 N--CA 1.488 1.469 0 O-C-N 121.18 -0.95 . . . . 0.28000000000000003 109.564 -179.892 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 331' ' ' GLN . . . . . . . . . . . . . 44.6 tp60 -87.99 106.64 18.27 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.359 -0.838 . . . . 0.91000000000000003 109.5 179.933 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 332' ' ' ILE . . . . . . . . . . . . . 31.9 mt -103.49 103.1 14.63 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.541 0 O-C-N 121.129 -0.982 . . . . 0.26000000000000001 109.534 179.926 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 333' ' ' ARG . . . . . 0.531 ' NH1' ' HG2' ' A' ' 333' ' ' ARG . 0.0 OUTLIER -72.46 151.49 42.51 Favored 'General case' 0 N--CA 1.488 1.464 0 O-C-N 121.265 -0.897 . . . . 2.9199999999999999 109.445 179.861 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 334' ' ' GLY . . . . . . . . . . . . . . . 86.47 128.99 2.45 Favored Glycine 0 N--CA 1.491 2.315 0 N-CA-C 109.593 -1.403 . . . . 0.40000000000000002 109.593 -179.984 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 335' ' ' ARG . . . . . 0.451 ' HA ' ' CE2' ' C' ' 328' ' ' PHE . 3.5 ttm180 -79.66 -39.09 32.2 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.278 -1.131 . . . . 3.0099999999999998 109.586 179.988 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 336' ' ' GLU . . . . . . . . . . . . . 2.2 mt-10 -58.05 -61.42 2.56 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.225 -0.922 . . . . 2.29 109.7 -179.916 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 337' ' ' ARG . . . . . 0.457 ' CG ' ' NH1' ' A' ' 337' ' ' ARG . 0.0 OUTLIER -59.75 -29.33 68.08 Favored 'General case' 0 N--CA 1.489 1.494 0 O-C-N 121.168 -0.957 . . . . 2.9300000000000002 109.528 -179.842 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 338' ' ' PHE . . . . . 0.449 ' HB3' ' O ' ' A' ' 335' ' ' ARG . 48.3 t80 -55.69 -56.03 25.17 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.145 -0.972 . . . . 0.38 109.465 179.993 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 339' ' ' GLU . . . . . . . . . . . . . 24.0 mt-10 -50.24 -33.27 19.05 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.195 -0.941 . . . . 1.97 110.045 -179.647 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 340' ' ' MET . . . . . . . . . . . . . 32.1 ttp -63.19 -51.0 68.13 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.158 -0.963 . . . . 0.31 109.878 -179.713 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 341' ' ' PHE . . . . . . . . . . . . . 38.9 m-85 -62.67 -52.02 64.93 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.177 -0.952 . . . . 0.17999999999999999 109.704 -179.741 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 342' ' ' ARG . . . . . . . . . . . . . 9.7 ttm180 -47.63 -36.65 11.21 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.188 -0.945 . . . . 2.4199999999999999 109.438 -179.948 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 343' ' ' GLU . . . . . . . . . . . . . 32.2 tt0 -59.18 -49.61 77.18 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.219 -0.926 . . . . 2.3500000000000001 109.433 -179.92 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 344' ' ' LEU . . . . . 0.687 HD22 ' CD2' ' B' ' 344' ' ' LEU . 57.5 mt -62.42 -32.31 73.14 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.223 -0.923 . . . . 0.17999999999999999 109.437 179.984 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 345' ' ' ASN . . . . . . . . . . . . . 9.6 t-20 -56.81 -54.93 40.77 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.302 -0.874 . . . . 1.0900000000000001 109.618 -179.886 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 346' ' ' GLU . . . . . . . . . . . . . 43.8 tp10 -61.35 -31.66 71.54 Favored 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.274 -0.891 . . . . 1.6499999999999999 109.813 -179.797 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 347' ' ' ALA . . . . . 0.772 ' HB1' ' HB1' ' B' ' 347' ' ' ALA . . . -59.91 -57.86 11.04 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.204 -0.935 . . . . 0.17999999999999999 109.988 -179.73 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 348' ' ' LEU . . . . . 0.71 HD12 ' HE ' ' C' ' 337' ' ' ARG . 4.2 mm? -61.59 -41.91 98.11 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.206 -0.934 . . . . 0.29999999999999999 109.81 -179.584 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 349' ' ' GLU . . . . . . . . . . . . . 98.5 mt-10 -58.08 -34.93 70.69 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.264 -0.898 . . . . 1.9399999999999999 110.007 -179.53 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 350' ' ' LEU . . . . . 0.86 HD13 HD22 ' B' ' 350' ' ' LEU . 5.7 tt -63.54 -46.46 85.89 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.111 -0.993 . . . . 0.46000000000000002 109.523 -179.819 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 351' ' ' LYS . . . . . . . . . . . . . 42.4 tttt -59.38 -38.0 79.37 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.274 -0.891 . . . . 1.3999999999999999 109.443 -179.978 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 352' ' ' ASP . . . . . . . . . . . . . 23.0 m-20 -55.71 -36.14 66.86 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.199 -0.938 . . . . 1.1599999999999999 109.671 -179.995 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 353' ' ' ALA . . . . . . . . . . . . . . . -66.88 -35.75 80.74 Favored 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.235 -0.916 . . . . 0.63 109.76 -179.745 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 354' ' ' GLN . . . . . . . . . . . . . 5.9 mt-30 -81.23 -3.9 53.81 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.215 -0.928 . . . . 1.47 109.657 -179.92 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 355' ' ' ALA . . . . . . . . . . . . . . . -70.97 -82.72 0.04 OUTLIER 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.134 -0.979 . . . . 1.01 109.579 179.887 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 356' ' ' GLY . . . . . . . . . . . . . . . -59.08 93.39 0.05 OUTLIER Glycine 0 N--CA 1.491 2.302 0 N-CA-C 109.688 -1.365 . . . . 1.3 109.688 -179.941 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 357' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -86.81 134.25 33.57 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.235 -1.156 . . . . 4.0999999999999996 109.301 179.836 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 358' ' ' GLU . . . . . . . . . . . . . 19.0 tt0 -49.53 133.42 18.86 Favored Pre-proline 0 N--CA 1.49 1.558 0 O-C-N 121.234 -0.917 . . . . 5.75 109.412 -179.816 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 359' ' ' PRO . . . . . . . . . . . . . 2.2 Cg_endo -62.69 167.76 11.23 Favored 'Trans proline' 0 C--N 1.313 -1.329 0 C-N-CA 122.074 1.849 . . . . 5.0 110.164 179.929 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 360' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.35 0 CA-C-O 118.004 -1.442 . . . . 6.9699999999999998 109.54 179.932 . . . . . . . . 0 0 . 1 . 014 nuclear build full ' B' B ' 319' ' ' LYS . . . . . 0.412 ' O ' ' O ' ' B' ' 320' ' ' LYS . 0.9 OUTLIER . . . . . 0 N--CA 1.492 1.647 0 N-CA-C 109.451 -0.574 . . . . 7.5499999999999998 109.451 . . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 320' ' ' LYS . . . . . 0.412 ' O ' ' O ' ' B' ' 319' ' ' LYS . 0.1 OUTLIER 63.14 135.85 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.247 -0.908 . . . . 6.4400000000000004 109.383 -179.992 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' B' B ' 321' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -157.85 79.73 3.28 Favored Pre-proline 0 N--CA 1.489 1.478 0 O-C-N 121.229 -0.919 . . . . 6.1299999999999999 109.558 179.984 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 322' ' ' PRO . . . . . . . . . . . . . 3.4 Cg_exo -60.49 157.44 36.45 Favored 'Trans proline' 0 C--N 1.311 -1.419 0 C-N-CA 122.161 1.907 . . . . 2.8199999999999998 110.23 180.0 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 323' ' ' LEU . . . . . . . . . . . . . 43.5 mt -80.92 113.96 19.48 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.238 -0.914 . . . . 2.8399999999999999 109.519 -179.741 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 324' ' ' ASP . . . . . 0.414 ' HB2' ' OH ' ' B' ' 327' ' ' TYR . 26.9 m-20 -81.01 -156.4 0.14 Allowed 'General case' 0 N--CA 1.489 1.488 0 O-C-N 121.284 -0.885 . . . . 1.53 109.608 179.896 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 325' ' ' GLY . . . . . . . . . . . . . . . -68.87 -173.47 8.64 Favored Glycine 0 N--CA 1.49 2.291 0 N-CA-C 109.562 -1.415 . . . . 0.58999999999999997 109.562 -179.885 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 326' ' ' GLU . . . . . . . . . . . . . 4.3 mm-40 -59.21 -173.96 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.327 -1.102 . . . . 2.1299999999999999 109.43 179.904 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 327' ' ' TYR . . . . . 0.517 ' CE2' ' HG2' ' D' ' 333' ' ' ARG . 43.1 m-85 -149.59 106.1 3.52 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.365 -0.835 . . . . 0.47999999999999998 109.46 179.823 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 328' ' ' PHE . . . . . 0.488 ' CE1' ' HA ' ' D' ' 335' ' ' ARG . 22.5 m-85 -111.97 -167.74 1.22 Allowed 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.236 -0.915 . . . . 0.32000000000000001 108.974 179.653 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 329' ' ' THR . . . . . 0.414 HG23 ' C ' ' B' ' 328' ' ' PHE . 75.7 p -153.38 -179.55 7.85 Favored 'General case' 0 N--CA 1.488 1.453 0 O-C-N 121.195 -0.941 . . . . 0.23000000000000001 109.331 179.899 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 330' ' ' LEU . . . . . . . . . . . . . 52.2 tp -152.93 131.87 12.53 Favored 'General case' 0 N--CA 1.489 1.484 0 O-C-N 121.274 -0.891 . . . . 0.28000000000000003 109.484 -179.867 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 331' ' ' GLN . . . . . . . . . . . . . 44.6 tp60 -88.09 106.41 18.14 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.284 -0.885 . . . . 0.91000000000000003 109.505 179.967 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 332' ' ' ILE . . . . . . . . . . . . . 31.5 mt -103.28 103.26 14.84 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.601 0 O-C-N 121.198 -0.939 . . . . 0.23999999999999999 109.609 179.86 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 333' ' ' ARG . . . . . 0.566 ' HG2' ' CE2' ' D' ' 327' ' ' TYR . 0.0 OUTLIER -72.55 151.39 42.45 Favored 'General case' 0 N--CA 1.489 1.5 0 O-C-N 121.278 -0.889 . . . . 2.9300000000000002 109.465 179.835 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' B' B ' 334' ' ' GLY . . . . . . . . . . . . . . . 86.6 128.96 2.48 Favored Glycine 0 N--CA 1.49 2.254 0 N-CA-C 109.556 -1.418 . . . . 0.40000000000000002 109.556 -179.977 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 335' ' ' ARG . . . . . 0.444 ' O ' ' HB3' ' B' ' 338' ' ' PHE . 3.4 ttm180 -79.58 -39.29 32.06 Favored 'General case' 0 N--CA 1.489 1.495 0 O-C-N 121.3 -1.117 . . . . 3.0099999999999998 109.506 -179.994 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 336' ' ' GLU . . . . . . . . . . . . . 2.2 mt-10 -57.89 -61.36 2.59 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.221 -0.924 . . . . 2.2799999999999998 109.77 -179.921 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 337' ' ' ARG . . . . . 0.455 ' NH1' ' CG ' ' B' ' 337' ' ' ARG . 0.0 OUTLIER -59.82 -29.35 68.19 Favored 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.226 -0.921 . . . . 2.9300000000000002 109.502 -179.871 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' B' B ' 338' ' ' PHE . . . . . 0.444 ' HB3' ' O ' ' B' ' 335' ' ' ARG . 48.0 t80 -55.54 -56.12 23.96 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.184 -0.948 . . . . 0.37 109.469 179.943 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 339' ' ' GLU . . . . . . . . . . . . . 23.9 mt-10 -50.36 -33.17 19.49 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.27 -0.894 . . . . 1.98 109.99 -179.657 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 340' ' ' MET . . . . . . . . . . . . . 32.3 ttp -63.39 -50.85 68.24 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.052 -1.03 . . . . 0.32000000000000001 109.812 -179.73 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 341' ' ' PHE . . . . . . . . . . . . . 39.3 m-85 -62.74 -51.8 65.75 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.19 -0.944 . . . . 0.17999999999999999 109.819 -179.812 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 342' ' ' ARG . . . . . . . . . . . . . 9.7 ttm180 -47.78 -36.83 12.26 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.245 -0.91 . . . . 2.4199999999999999 109.522 -179.988 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 343' ' ' GLU . . . . . . . . . . . . . 32.5 tt0 -58.88 -49.72 76.72 Favored 'General case' 0 N--CA 1.489 1.486 0 O-C-N 121.214 -0.929 . . . . 2.3500000000000001 109.47 179.957 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 344' ' ' LEU . . . . . 0.687 ' CD2' HD22 ' A' ' 344' ' ' LEU . 56.8 mt -62.39 -32.34 73.14 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.174 -0.954 . . . . 0.17999999999999999 109.466 179.947 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 345' ' ' ASN . . . . . . . . . . . . . 9.6 t-20 -56.81 -54.88 41.26 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.352 -0.842 . . . . 1.0900000000000001 109.678 -179.87 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 346' ' ' GLU . . . . . . . . . . . . . 43.8 tp10 -61.37 -31.66 71.56 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.237 -0.914 . . . . 1.6599999999999999 109.787 -179.849 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 347' ' ' ALA . . . . . 0.772 ' HB1' ' HB1' ' A' ' 347' ' ' ALA . . . -59.93 -57.8 11.29 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.235 -0.916 . . . . 0.17000000000000001 109.974 -179.663 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 348' ' ' LEU . . . . . 0.6 HD22 ' N ' ' B' ' 348' ' ' LEU . 4.2 mm? -61.6 -41.91 98.11 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.198 -0.939 . . . . 0.28999999999999998 109.828 -179.558 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 349' ' ' GLU . . . . . . . . . . . . . 98.5 mt-10 -57.97 -35.18 70.81 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.246 -0.909 . . . . 1.95 109.946 -179.492 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 350' ' ' LEU . . . . . 0.86 HD22 HD13 ' A' ' 350' ' ' LEU . 5.7 tt -63.33 -46.59 85.92 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.157 -0.964 . . . . 0.45000000000000001 109.576 -179.836 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 351' ' ' LYS . . . . . . . . . . . . . 42.4 tttt -59.37 -37.86 78.98 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.294 -0.879 . . . . 1.3799999999999999 109.398 -179.899 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 352' ' ' ASP . . . . . . . . . . . . . 22.8 m-20 -55.72 -36.17 66.93 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.349 -0.844 . . . . 1.1599999999999999 109.717 179.992 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 353' ' ' ALA . . . . . . . . . . . . . . . -66.91 -35.75 80.7 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.217 -0.927 . . . . 0.60999999999999999 109.838 -179.752 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 354' ' ' GLN . . . . . . . . . . . . . 5.9 mt-30 -81.19 -4.09 54.31 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.115 -0.991 . . . . 1.45 109.543 -179.892 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 355' ' ' ALA . . . . . . . . . . . . . . . -70.68 -82.52 0.04 OUTLIER 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.187 -0.946 . . . . 0.97999999999999998 109.692 179.877 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 356' ' ' GLY . . . . . . . . . . . . . . . -59.35 93.6 0.05 OUTLIER Glycine 0 N--CA 1.491 2.34 0 N-CA-C 109.623 -1.391 . . . . 1.29 109.623 -179.926 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 357' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -86.88 134.16 33.55 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.259 -1.142 . . . . 4.0899999999999999 109.265 179.816 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 358' ' ' GLU . . . . . . . . . . . . . 19.0 tt0 -49.49 133.57 18.54 Favored Pre-proline 0 N--CA 1.491 1.58 0 O-C-N 121.15 -0.969 . . . . 5.7199999999999998 109.375 -179.81 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 359' ' ' PRO . . . . . . . . . . . . . 2.3 Cg_endo -62.83 167.75 11.46 Favored 'Trans proline' 0 C--N 1.312 -1.343 0 C-N-CA 121.962 1.775 . . . . 4.9800000000000004 110.129 179.956 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 360' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.285 0 CA-C-O 117.961 -1.466 . . . . 6.9800000000000004 109.507 179.954 . . . . . . . . 0 0 . 1 . 014 nuclear build full ' C' C ' 319' ' ' LYS . . . . . 0.423 ' HB3' ' HE2' ' C' ' 320' ' ' LYS . 0.2 OUTLIER . . . . . 0 N--CA 1.49 1.571 0 N-CA-C 109.476 -0.565 . . . . 6.8200000000000003 109.476 . . . . . . . . . 2 2 . 1 . 014 nuclear build full ' C' C ' 320' ' ' LYS . . . . . 0.423 ' HE2' ' HB3' ' C' ' 319' ' ' LYS . 0.0 OUTLIER 63.93 62.74 0.86 Allowed 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.222 -0.924 . . . . 6.4900000000000002 109.524 179.969 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' C' C ' 321' ' ' LYS . . . . . 0.552 ' N ' ' HD2' ' C' ' 322' ' ' PRO . 0.0 OUTLIER -80.7 -54.25 0.79 Allowed Pre-proline 0 N--CA 1.49 1.573 0 O-C-N 121.341 -0.85 . . . . 6.4000000000000004 110.542 -179.649 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' C' C ' 322' ' ' PRO . . . . . 0.552 ' HD2' ' N ' ' C' ' 321' ' ' LYS . 5.0 Cg_exo -60.7 159.58 27.95 Favored 'Trans proline' 0 C--N 1.31 -1.459 0 C-N-CA 121.835 1.69 . . . . 3.4199999999999999 110.452 -179.374 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' C' C ' 323' ' ' LEU . . . . . . . . . . . . . 78.9 mt -78.53 151.38 32.54 Favored 'General case' 0 N--CA 1.489 1.499 0 O-C-N 121.247 -0.908 . . . . 3.9500000000000002 109.139 -179.949 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' C' C ' 324' ' ' ASP . . . . . 0.48 ' HB2' ' OH ' ' C' ' 327' ' ' TYR . 2.5 m-20 -77.8 177.07 8.47 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.22 -0.925 . . . . 1.6299999999999999 109.744 -179.563 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' C' C ' 325' ' ' GLY . . . . . 0.407 ' O ' ' O ' ' C' ' 326' ' ' GLU . . . -68.62 -169.58 5.68 Favored Glycine 0 N--CA 1.49 2.259 0 N-CA-C 109.761 -1.336 . . . . 0.72999999999999998 109.761 -179.796 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' C' C ' 326' ' ' GLU . . . . . 0.522 ' O ' ' CD1' ' C' ' 327' ' ' TYR . 5.2 mt-10 -57.96 -163.85 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.285 -1.127 . . . . 2.1699999999999999 109.428 179.998 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' C' C ' 327' ' ' TYR . . . . . 0.522 ' CD1' ' O ' ' C' ' 326' ' ' GLU . 40.3 m-85 -149.77 109.11 3.96 Favored 'General case' 0 N--CA 1.489 1.494 0 O-C-N 121.149 -0.97 . . . . 0.47999999999999998 109.723 -179.973 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' C' C ' 328' ' ' PHE . . . . . 0.451 ' CE2' ' HA ' ' A' ' 335' ' ' ARG . 83.7 m-85 -113.89 -167.04 1.15 Allowed 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.401 -0.812 . . . . 0.33000000000000002 109.137 179.81 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' C' C ' 329' ' ' THR . . . . . 0.431 HG23 ' C ' ' C' ' 328' ' ' PHE . 22.4 p -153.73 179.19 9.08 Favored 'General case' 0 N--CA 1.489 1.487 0 O-C-N 121.124 -0.985 . . . . 0.23000000000000001 109.494 179.988 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' C' C ' 330' ' ' LEU . . . . . 0.422 ' O ' ' HA ' ' A' ' 329' ' ' THR . 54.1 tp -152.99 131.61 12.27 Favored 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.243 -0.911 . . . . 0.28000000000000003 109.761 -179.802 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' C' C ' 331' ' ' GLN . . . . . 0.442 ' NE2' ' O ' ' A' ' 328' ' ' PHE . 0.0 OUTLIER -88.52 102.35 14.83 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.268 -0.895 . . . . 1.48 108.838 179.818 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' C' C ' 332' ' ' ILE . . . . . . . . . . . . . 53.6 mt -104.01 112.04 36.01 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.704 0 O-C-N 121.118 -0.988 . . . . 0.23999999999999999 110.204 -179.606 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' C' C ' 333' ' ' ARG . . . . . 0.604 ' HG2' ' CE2' ' A' ' 327' ' ' TYR . 1.4 mpp_? -75.18 163.94 27.01 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.294 -0.879 . . . . 2.7400000000000002 109.656 179.407 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' C' C ' 334' ' ' GLY . . . . . . . . . . . . . . . 72.55 130.3 0.12 Allowed Glycine 0 N--CA 1.493 2.476 0 N-CA-C 110.344 -1.102 . . . . 0.34999999999999998 110.344 179.172 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' C' C ' 335' ' ' ARG . . . . . 0.481 ' O ' ' HB3' ' C' ' 338' ' ' PHE . 3.9 ttp180 -80.67 -37.98 29.88 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.401 -1.058 . . . . 2.5299999999999998 109.414 179.684 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' C' C ' 336' ' ' GLU . . . . . . . . . . . . . 4.0 mt-10 -58.36 -60.98 2.94 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.218 -0.927 . . . . 2.6200000000000001 109.676 -179.738 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' C' C ' 337' ' ' ARG . . . . . 0.71 ' HE ' HD12 ' A' ' 348' ' ' LEU . 0.0 OUTLIER -59.47 -29.24 67.68 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.208 -0.932 . . . . 2.8100000000000001 109.463 -179.789 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' C' C ' 338' ' ' PHE . . . . . 0.481 ' HB3' ' O ' ' C' ' 335' ' ' ARG . 47.6 t80 -54.87 -55.55 29.2 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.228 -0.92 . . . . 0.40000000000000002 109.245 179.825 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' C' C ' 339' ' ' GLU . . . . . . . . . . . . . 85.4 mt-10 -50.84 -29.17 11.08 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.297 -0.877 . . . . 2.0499999999999998 109.672 -179.985 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' C' C ' 340' ' ' MET . . . . . . . . . . . . . 14.9 ttp -63.4 -53.83 46.29 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.132 -0.98 . . . . 0.32000000000000001 109.64 -179.766 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' C' C ' 341' ' ' PHE . . . . . . . . . . . . . 38.8 m-85 -62.76 -46.1 89.61 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.211 -0.931 . . . . 0.17999999999999999 109.729 -179.783 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' C' C ' 342' ' ' ARG . . . . . 0.445 HH11 ' CG ' ' C' ' 342' ' ' ARG . 0.0 OUTLIER -49.72 -42.45 46.01 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.215 -0.928 . . . . 2.9100000000000001 109.621 -179.89 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' C' C ' 343' ' ' GLU . . . . . . . . . . . . . 23.1 tt0 -57.89 -47.26 83.32 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.134 -0.978 . . . . 2.1400000000000001 109.298 -179.966 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' C' C ' 344' ' ' LEU . . . . . 0.615 HD22 HD22 ' D' ' 344' ' ' LEU . 76.3 mt -62.61 -29.07 70.33 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.211 -0.93 . . . . 0.22 109.232 179.704 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' C' C ' 345' ' ' ASN . . . . . . . . . . . . . 13.1 t-20 -58.84 -58.33 9.1 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.491 -0.756 . . . . 1.0800000000000001 109.837 179.998 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' C' C ' 346' ' ' GLU . . . . . . . . . . . . . 6.6 tm-20 -60.8 -25.86 66.87 Favored 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.322 -0.861 . . . . 2.21 109.785 -179.644 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' C' C ' 347' ' ' ALA . . . . . 0.854 ' HB1' ' HB1' ' D' ' 347' ' ' ALA . . . -63.84 -58.2 7.53 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.137 -0.977 . . . . 0.17999999999999999 110.028 -179.945 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' C' C ' 348' ' ' LEU . . . . . 0.567 ' N ' HD22 ' C' ' 348' ' ' LEU . 3.9 mm? -62.6 -49.61 74.54 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.202 -0.936 . . . . 0.32000000000000001 110.582 -179.355 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' C' C ' 349' ' ' GLU . . . . . . . . . . . . . 54.3 mt-10 -56.97 -39.05 73.88 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.187 -0.946 . . . . 2.1899999999999999 110.301 -179.096 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' C' C ' 350' ' ' LEU . . . . . 0.794 ' CD2' HD13 ' D' ' 350' ' ' LEU . 7.1 tt -64.57 -30.42 71.44 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.046 -1.033 . . . . 0.46000000000000002 109.653 -179.761 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' C' C ' 351' ' ' LYS . . . . . . . . . . . . . 10.2 tttt -59.34 -48.88 79.94 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.308 -0.87 . . . . 1.3500000000000001 109.414 -179.854 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' C' C ' 352' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -60.03 -47.06 87.41 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.331 -0.856 . . . . 1.1899999999999999 109.588 179.867 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' C' C ' 353' ' ' ALA . . . . . . . . . . . . . . . -66.41 -10.51 44.41 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.224 -0.922 . . . . 0.56999999999999995 109.461 -179.787 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' C' C ' 354' ' ' GLN . . . . . . . . . . . . . 32.6 tt0 -81.37 -65.77 0.97 Allowed 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.355 -0.841 . . . . 1.47 109.247 179.756 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' C' C ' 355' ' ' ALA . . . . . . . . . . . . . . . -69.42 -8.87 50.54 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.254 -0.904 . . . . 0.93000000000000005 109.293 179.895 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' C' C ' 356' ' ' GLY . . . . . . . . . . . . . . . -80.48 4.37 68.75 Favored Glycine 0 N--CA 1.49 2.298 0 N-CA-C 109.55 -1.42 . . . . 1.3300000000000001 109.55 179.76 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' C' C ' 357' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -85.16 138.74 32.18 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.245 -1.15 . . . . 4.0099999999999998 109.464 -179.717 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' C' C ' 358' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -49.87 140.57 15.36 Favored Pre-proline 0 N--CA 1.49 1.526 0 O-C-N 121.223 -0.923 . . . . 5.75 109.466 -179.814 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' C' C ' 359' ' ' PRO . . . . . . . . . . . . . 2.4 Cg_endo -62.42 100.67 0.23 Allowed 'Trans proline' 0 C--N 1.31 -1.473 0 C-N-CA 122.046 1.83 . . . . 4.9400000000000004 110.001 179.88 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' C' C ' 360' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.213 0 N-CA-C 109.559 -1.416 . . . . 6.5 109.559 -179.99 . . . . . . . . 0 0 . 1 . 014 nuclear build full ' D' D ' 319' ' ' LYS . . . . . 0.415 ' O ' ' O ' ' D' ' 320' ' ' LYS . 0.8 OUTLIER . . . . . 0 N--CA 1.489 1.519 0 N-CA-C 109.487 -0.56 . . . . 7.5300000000000002 109.487 . . . . . . . . . 2 2 . 1 . 014 nuclear build full ' D' D ' 320' ' ' LYS . . . . . 0.415 ' O ' ' O ' ' D' ' 319' ' ' LYS . 0.1 OUTLIER 63.22 135.97 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.27 -0.894 . . . . 6.4100000000000001 109.396 -179.907 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' D' D ' 321' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -158.06 79.53 3.23 Favored Pre-proline 0 N--CA 1.488 1.47 0 O-C-N 121.267 -0.896 . . . . 6.1100000000000003 109.52 -179.994 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' D' D ' 322' ' ' PRO . . . . . . . . . . . . . 3.2 Cg_exo -60.41 157.26 36.88 Favored 'Trans proline' 0 C--N 1.31 -1.468 0 C-N-CA 122.22 1.947 . . . . 2.8199999999999998 110.185 -179.893 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' D' D ' 323' ' ' LEU . . . . . . . . . . . . . 43.6 mt -80.66 113.86 19.15 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.306 -0.871 . . . . 2.8300000000000001 109.657 -179.845 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' D' D ' 324' ' ' ASP . . . . . 0.416 ' HB2' ' OH ' ' D' ' 327' ' ' TYR . 26.7 m-20 -80.89 -156.58 0.14 Allowed 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.299 -0.876 . . . . 1.54 109.543 179.819 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' D' D ' 325' ' ' GLY . . . . . . . . . . . . . . . -68.75 -173.36 8.35 Favored Glycine 0 N--CA 1.491 2.315 0 N-CA-C 109.669 -1.372 . . . . 0.58999999999999997 109.669 -179.969 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' D' D ' 326' ' ' GLU . . . . . 0.401 ' O ' ' CD1' ' D' ' 327' ' ' TYR . 4.3 mm-40 -59.23 -174.09 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.29 -1.124 . . . . 2.1299999999999999 109.451 179.924 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' D' D ' 327' ' ' TYR . . . . . 0.566 ' CE2' ' HG2' ' B' ' 333' ' ' ARG . 43.7 m-85 -149.61 106.04 3.51 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.268 -0.895 . . . . 0.46999999999999997 109.534 179.824 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' D' D ' 328' ' ' PHE . . . . . 0.434 ' CE1' ' HA ' ' B' ' 335' ' ' ARG . 23.4 m-85 -111.87 -167.5 1.19 Allowed 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.339 -0.85 . . . . 0.29999999999999999 109.007 179.683 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' D' D ' 329' ' ' THR . . . . . 0.408 HG23 ' C ' ' D' ' 328' ' ' PHE . 75.5 p -153.59 -179.76 8.08 Favored 'General case' 0 N--CA 1.488 1.452 0 O-C-N 121.158 -0.964 . . . . 0.22 109.424 179.925 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' D' D ' 330' ' ' LEU . . . . . . . . . . . . . 52.2 tp -152.75 131.91 12.71 Favored 'General case' 0 N--CA 1.488 1.467 0 O-C-N 121.205 -0.934 . . . . 0.28000000000000003 109.532 -179.877 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' D' D ' 331' ' ' GLN . . . . . . . . . . . . . 44.6 tp60 -88.13 106.55 18.25 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.274 -0.891 . . . . 0.93000000000000005 109.521 179.922 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' D' D ' 332' ' ' ILE . . . . . . . . . . . . . 31.9 mt -103.41 103.37 15.04 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.545 0 O-C-N 121.168 -0.957 . . . . 0.25 109.519 179.919 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' D' D ' 333' ' ' ARG . . . . . 0.547 ' NH1' ' HG2' ' D' ' 333' ' ' ARG . 0.0 OUTLIER -72.66 151.45 42.25 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.249 -0.907 . . . . 2.9300000000000002 109.398 179.861 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' D' D ' 334' ' ' GLY . . . . . . . . . . . . . . . 86.56 128.87 2.46 Favored Glycine 0 N--CA 1.49 2.235 0 N-CA-C 109.595 -1.402 . . . . 0.40999999999999998 109.595 -179.978 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' D' D ' 335' ' ' ARG . . . . . 0.488 ' HA ' ' CE1' ' B' ' 328' ' ' PHE . 3.4 ttm180 -79.54 -39.18 32.51 Favored 'General case' 0 N--CA 1.489 1.487 0 O-C-N 121.202 -1.175 . . . . 3.0299999999999998 109.524 -179.975 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' D' D ' 336' ' ' GLU . . . . . . . . . . . . . 2.2 mt-10 -57.98 -61.4 2.57 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.252 -0.905 . . . . 2.2599999999999998 109.731 -179.89 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' D' D ' 337' ' ' ARG . . . . . 0.457 ' CG ' HH11 ' D' ' 337' ' ' ARG . 0.0 OUTLIER -59.85 -29.35 68.23 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.18 -0.95 . . . . 2.9199999999999999 109.504 -179.84 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' D' D ' 338' ' ' PHE . . . . . 0.44 ' HB3' ' O ' ' D' ' 335' ' ' ARG . 48.2 t80 -55.53 -56.2 23.04 Favored 'General case' 0 N--CA 1.488 1.474 0 O-C-N 121.219 -0.926 . . . . 0.37 109.483 179.886 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' D' D ' 339' ' ' GLU . . . . . . . . . . . . . 24.1 mt-10 -50.09 -33.49 18.76 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.23 -0.919 . . . . 1.99 110.03 -179.716 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' D' D ' 340' ' ' MET . . . . . . . . . . . . . 32.2 ttp -63.13 -51.11 67.78 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.2 -0.938 . . . . 0.31 109.814 -179.674 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' D' D ' 341' ' ' PHE . . . . . . . . . . . . . 39.3 m-85 -62.46 -51.99 65.28 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.146 -0.971 . . . . 0.17999999999999999 109.757 -179.741 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' D' D ' 342' ' ' ARG . . . . . . . . . . . . . 9.7 ttm180 -47.69 -36.76 11.69 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.156 -0.965 . . . . 2.4100000000000001 109.483 -179.926 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' D' D ' 343' ' ' GLU . . . . . . . . . . . . . 32.7 tt0 -58.91 -49.64 77.03 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.278 -0.889 . . . . 2.3500000000000001 109.504 179.935 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' D' D ' 344' ' ' LEU . . . . . 0.615 HD22 HD22 ' C' ' 344' ' ' LEU . 57.5 mt -62.47 -32.37 73.25 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.177 -0.952 . . . . 0.19 109.453 -179.996 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' D' D ' 345' ' ' ASN . . . . . . . . . . . . . 9.6 t-20 -56.77 -54.93 40.6 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.266 -0.896 . . . . 1.0900000000000001 109.63 -179.858 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' D' D ' 346' ' ' GLU . . . . . . . . . . . . . 44.0 tp10 -61.4 -31.61 71.53 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.258 -0.902 . . . . 1.6899999999999999 109.755 -179.746 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' D' D ' 347' ' ' ALA . . . . . 0.854 ' HB1' ' HB1' ' C' ' 347' ' ' ALA . . . -59.93 -57.82 11.21 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.236 -0.915 . . . . 0.17999999999999999 109.988 -179.709 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' D' D ' 348' ' ' LEU . . . . . 0.608 HD22 ' N ' ' D' ' 348' ' ' LEU . 4.2 mm? -61.53 -42.0 98.18 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.219 -0.926 . . . . 0.31 109.885 -179.664 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' D' D ' 349' ' ' GLU . . . . . . . . . . . . . 98.5 mt-10 -57.9 -35.12 70.59 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.245 -0.91 . . . . 1.95 109.943 -179.541 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' D' D ' 350' ' ' LEU . . . . . 0.794 HD13 ' CD2' ' C' ' 350' ' ' LEU . 5.7 tt -63.39 -46.37 86.73 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.125 -0.985 . . . . 0.42999999999999999 109.603 -179.814 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' D' D ' 351' ' ' LYS . . . . . . . . . . . . . 42.4 tttt -59.48 -37.87 79.36 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.253 -0.904 . . . . 1.3999999999999999 109.475 -179.996 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' D' D ' 352' ' ' ASP . . . . . . . . . . . . . 22.9 m-20 -55.76 -36.15 66.99 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.258 -0.901 . . . . 1.1699999999999999 109.635 179.975 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' D' D ' 353' ' ' ALA . . . . . . . . . . . . . . . -66.95 -35.83 80.85 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.239 -0.913 . . . . 0.58999999999999997 109.738 -179.739 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' D' D ' 354' ' ' GLN . . . . . . . . . . . . . 5.8 mt-30 -81.28 -3.88 53.85 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.229 -0.919 . . . . 1.4399999999999999 109.595 -179.829 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' D' D ' 355' ' ' ALA . . . . . . . . . . . . . . . -70.97 -82.52 0.04 OUTLIER 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.239 -0.913 . . . . 0.97999999999999998 109.579 179.926 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' D' D ' 356' ' ' GLY . . . . . . . . . . . . . . . -59.37 93.54 0.05 OUTLIER Glycine 0 N--CA 1.49 2.295 0 N-CA-C 109.651 -1.379 . . . . 1.28 109.651 -179.873 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' D' D ' 357' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -86.71 134.03 33.62 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.341 -1.093 . . . . 4.0899999999999999 109.377 179.796 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' D' D ' 358' ' ' GLU . . . . . . . . . . . . . 18.9 tt0 -49.35 133.38 17.54 Favored Pre-proline 0 N--CA 1.491 1.597 0 O-C-N 121.231 -0.918 . . . . 5.71 109.457 -179.871 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' D' D ' 359' ' ' PRO . . . . . . . . . . . . . 2.2 Cg_endo -62.67 167.61 11.43 Favored 'Trans proline' 0 C--N 1.311 -1.421 0 C-N-CA 122.075 1.85 . . . . 4.9699999999999998 110.168 -179.994 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' D' D ' 360' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.326 0 N-CA-C 109.483 -1.447 . . . . 6.9699999999999998 109.483 179.921 . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 319' ' ' LYS . . . . . . . . . . . . . 22.2 mttt . . . . . 0 N--CA 1.49 1.547 0 N-CA-C 109.596 -0.52 . . . . 7.5499999999999998 109.596 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 320' ' ' LYS . . . . . . . . . . . . . 4.4 tttm 53.23 50.93 16.57 Favored 'General case' 0 N--CA 1.489 1.525 0 O-C-N 121.241 -0.912 . . . . 6.4299999999999997 109.087 -179.997 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 321' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -157.47 84.6 2.84 Favored Pre-proline 0 N--CA 1.491 1.585 0 O-C-N 121.381 -0.824 . . . . 6.1299999999999999 109.492 -179.786 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 322' ' ' PRO . . . . . . . . . . . . . 1.8 Cg_endo -68.68 -1.43 7.55 Favored 'Trans proline' 0 C--N 1.311 -1.43 0 C-N-CA 122.319 2.013 . . . . 2.8300000000000001 110.567 179.722 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 323' ' ' LEU . . . . . . . . . . . . . 23.4 mt -84.16 47.6 1.35 Allowed 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.153 -0.967 . . . . 2.8300000000000001 109.475 179.854 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 324' ' ' ASP . . . . . . . . . . . . . 49.4 m-20 -77.82 -175.76 4.1 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.261 -0.899 . . . . 1.53 109.349 -179.94 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 325' ' ' GLY . . . . . . . . . . . . . . . -68.61 -178.75 17.55 Favored Glycine 0 N--CA 1.489 2.172 0 N-CA-C 109.418 -1.473 . . . . 0.60999999999999999 109.418 179.919 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 326' ' ' GLU . . . . . . . . . . . . . 20.8 mt-10 -58.46 -172.43 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.128 -1.219 . . . . 2.1299999999999999 109.354 179.925 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 327' ' ' TYR . . . . . 0.588 ' CE1' ' HG2' ' C' ' 333' ' ' ARG . 48.0 m-85 -148.54 111.36 4.81 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.303 -0.873 . . . . 0.47999999999999998 109.338 179.978 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 328' ' ' PHE . . . . . . . . . . . . . 94.5 m-85 -113.3 -169.88 1.58 Allowed 'General case' 0 N--CA 1.488 1.467 0 O-C-N 121.114 -0.991 . . . . 0.31 109.466 -179.706 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 329' ' ' THR . . . . . 0.502 ' HA ' ' O ' ' C' ' 330' ' ' LEU . 29.4 p -152.16 166.31 32.1 Favored 'General case' 0 C--N 1.303 -1.424 0 O-C-N 121.298 -0.876 . . . . 0.22 109.022 179.879 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 330' ' ' LEU . . . . . . . . . . . . . 49.2 tp -149.71 128.32 12.35 Favored 'General case' 0 C--N 1.303 -1.444 0 O-C-N 121.107 -0.996 . . . . 0.28000000000000003 109.972 -179.396 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 331' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -86.74 109.92 19.55 Favored 'General case' 0 N--CA 1.488 1.471 0 O-C-N 121.321 -0.862 . . . . 0.91000000000000003 109.184 179.681 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 332' ' ' ILE . . . . . 0.63 HD12 ' HD1' ' A' ' 338' ' ' PHE . 10.6 mt -103.65 108.44 24.54 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.536 0 O-C-N 121.203 -0.936 . . . . 0.26000000000000001 109.766 -179.716 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 333' ' ' ARG . . . . . 0.52 ' HG2' ' CE1' ' C' ' 327' ' ' TYR . 37.8 mtm-85 -71.95 151.86 42.95 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.192 -0.942 . . . . 2.9199999999999999 109.337 179.804 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 334' ' ' GLY . . . . . . . . . . . . . . . 79.8 129.85 0.77 Allowed Glycine 0 N--CA 1.491 2.335 0 N-CA-C 109.703 -1.359 . . . . 0.40000000000000002 109.703 179.746 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 335' ' ' ARG . . . . . . . . . . . . . 9.6 ttm180 -79.92 -37.47 34.54 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.275 -1.132 . . . . 3.0099999999999998 109.579 179.919 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 336' ' ' GLU . . . . . . . . . . . . . 4.2 mm-40 -57.15 -63.48 1.2 Allowed 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.325 -0.859 . . . . 2.29 109.807 -179.744 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 337' ' ' ARG . . . . . 0.442 ' HG2' HH11 ' A' ' 337' ' ' ARG . 5.0 mmt-85 -60.39 -30.44 69.59 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.266 -0.896 . . . . 2.9300000000000002 109.788 -179.737 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 338' ' ' PHE . . . . . 0.63 ' HD1' HD12 ' A' ' 332' ' ' ILE . 25.8 t80 -55.26 -56.89 14.82 Favored 'General case' 0 N--CA 1.489 1.487 0 O-C-N 121.063 -1.023 . . . . 0.38 109.122 179.716 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 339' ' ' GLU . . . . . . . . . . . . . 32.1 mt-10 -51.32 -30.6 18.82 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.428 -0.795 . . . . 1.97 109.574 -179.755 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 340' ' ' MET . . . . . . . . . . . . . 41.5 ttp -63.66 -50.57 68.74 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.286 -0.884 . . . . 0.31 109.593 -179.834 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 341' ' ' PHE . . . . . 0.416 ' CZ ' ' HA ' ' C' ' 345' ' ' ASN . 75.7 m-85 -62.74 -46.49 87.81 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.205 -0.934 . . . . 0.17999999999999999 109.718 -179.873 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 342' ' ' ARG . . . . . 0.453 HH11 ' HG3' ' A' ' 342' ' ' ARG . 0.3 OUTLIER -49.03 -42.69 39.11 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.257 -0.902 . . . . 2.4199999999999999 109.987 -179.578 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 343' ' ' GLU . . . . . . . . . . . . . 25.1 tt0 -59.82 -44.62 93.94 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.38 -0.825 . . . . 2.3500000000000001 109.846 -179.72 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 344' ' ' LEU . . . . . . . . . . . . . 41.1 mt -62.49 -36.01 81.17 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.1 -1.0 . . . . 0.17999999999999999 109.933 -179.661 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 345' ' ' ASN . . . . . . . . . . . . . 63.8 t-20 -57.41 -54.66 44.34 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.298 -0.876 . . . . 1.0900000000000001 109.906 -179.626 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 346' ' ' GLU . . . . . . . . . . . . . 83.5 tt0 -60.92 -30.33 70.13 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.139 -0.976 . . . . 1.6499999999999999 109.946 -179.59 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 347' ' ' ALA . . . . . 0.876 ' HB1' ' HB1' ' B' ' 347' ' ' ALA . . . -60.58 -56.34 22.5 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.176 -0.953 . . . . 0.17999999999999999 110.014 -179.616 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 348' ' ' LEU . . . . . 0.575 HD22 ' N ' ' A' ' 348' ' ' LEU . 3.9 mm? -61.33 -48.93 79.08 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.16 -0.962 . . . . 0.29999999999999999 110.073 -179.398 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 349' ' ' GLU . . . . . . . . . . . . . 80.6 mm-40 -57.13 -30.27 64.26 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.24 -0.912 . . . . 1.9399999999999999 110.127 -179.453 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 350' ' ' LEU . . . . . 0.73 HD23 ' O ' ' A' ' 350' ' ' LEU . 4.2 tt -64.28 -48.0 77.38 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.127 -0.983 . . . . 0.46000000000000002 109.419 -179.984 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 351' ' ' LYS . . . . . . . . . . . . . 68.0 tttt -59.17 -48.83 80.15 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.277 -0.889 . . . . 1.3999999999999999 109.538 -179.964 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 352' ' ' ASP . . . . . . . . . . . . . 3.4 m-20 -54.82 -29.36 54.62 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.251 -0.905 . . . . 1.1599999999999999 109.478 -179.995 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 353' ' ' ALA . . . . . 0.436 ' O ' ' HB2' ' A' ' 357' ' ' LYS . . . -67.2 -37.98 84.56 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.276 -0.89 . . . . 0.63 109.512 179.945 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 354' ' ' GLN . . . . . . . . . . . . . 90.5 mt-30 -80.92 -2.42 47.53 Favored 'General case' 0 N--CA 1.488 1.461 0 O-C-N 121.252 -0.905 . . . . 1.47 109.475 -179.999 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 355' ' ' ALA . . . . . 0.411 ' O ' ' HG3' ' A' ' 358' ' ' GLU . . . -71.93 -71.65 0.27 Allowed 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.251 -0.906 . . . . 1.01 109.794 179.873 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 356' ' ' GLY . . . . . . . . . . . . . . . -73.54 0.9 47.08 Favored Glycine 0 N--CA 1.491 2.306 0 N-CA-C 110.315 -1.114 . . . . 1.3 110.315 -179.513 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 357' ' ' LYS . . . . . 0.436 ' HB2' ' O ' ' A' ' 353' ' ' ALA . 4.9 tptp -86.03 12.09 10.25 Favored 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.067 -1.255 . . . . 4.0999999999999996 109.558 -180.0 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 358' ' ' GLU . . . . . 0.411 ' HG3' ' O ' ' A' ' 355' ' ' ALA . 23.6 mt-10 -49.86 149.17 4.87 Favored Pre-proline 0 N--CA 1.491 1.597 0 O-C-N 121.2 -0.938 . . . . 5.75 109.366 179.936 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 359' ' ' PRO . . . . . . . . . . . . . 1.2 Cg_endo -68.1 -5.01 13.68 Favored 'Trans proline' 0 C--N 1.309 -1.51 0 C-N-CA 122.202 1.934 . . . . 5.0 110.292 -179.868 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 360' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.286 0 CA-C-O 118.027 -1.43 . . . . 6.9699999999999998 109.597 -179.903 . . . . . . . . 0 0 . 1 . 015 nuclear build full ' B' B ' 319' ' ' LYS . . . . . . . . . . . . . 21.6 mttt . . . . . 0 N--CA 1.49 1.546 0 CA-C-O 121.251 0.548 . . . . 7.5499999999999998 109.532 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' B' B ' 320' ' ' LYS . . . . . . . . . . . . . 4.6 tttm 53.73 49.86 18.32 Favored 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.216 -0.927 . . . . 6.4400000000000004 109.265 179.954 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 321' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -156.3 85.02 3.17 Favored Pre-proline 0 N--CA 1.489 1.522 0 O-C-N 121.28 -0.887 . . . . 6.1299999999999999 109.531 -179.748 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 322' ' ' PRO . . . . . . . . . . . . . 1.9 Cg_endo -68.55 -1.04 6.75 Favored 'Trans proline' 0 C--N 1.311 -1.397 0 C-N-CA 122.29 1.993 . . . . 2.8199999999999998 110.695 179.879 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 323' ' ' LEU . . . . . . . . . . . . . 23.1 mt -84.35 47.14 1.3 Allowed 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.082 -1.011 . . . . 2.8399999999999999 109.428 -179.931 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 324' ' ' ASP . . . . . . . . . . . . . 47.2 m-20 -77.93 -176.67 4.59 Favored 'General case' 0 N--CA 1.489 1.493 0 O-C-N 121.317 -0.864 . . . . 1.53 109.461 -179.807 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 325' ' ' GLY . . . . . . . . . . . . . . . -67.56 -179.27 13.86 Favored Glycine 0 N--CA 1.489 2.185 0 N-CA-C 109.417 -1.473 . . . . 0.58999999999999997 109.417 179.935 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 326' ' ' GLU . . . . . . . . . . . . . 20.0 mt-10 -58.33 -172.47 0.01 OUTLIER 'General case' 0 N--CA 1.488 1.475 0 O-C-N 121.174 -1.192 . . . . 2.1299999999999999 109.449 179.836 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 327' ' ' TYR . . . . . 0.473 ' CE1' ' HG2' ' D' ' 333' ' ' ARG . 48.7 m-85 -148.86 112.04 4.93 Favored 'General case' 0 N--CA 1.488 1.454 0 O-C-N 121.286 -0.884 . . . . 0.47999999999999998 109.322 179.891 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 328' ' ' PHE . . . . . 0.4 ' CE1' ' HB2' ' D' ' 335' ' ' ARG . 94.0 m-85 -113.5 -169.45 1.5 Allowed 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.246 -0.908 . . . . 0.32000000000000001 109.514 -179.865 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 329' ' ' THR . . . . . . . . . . . . . 29.6 p -152.64 166.46 32.04 Favored 'General case' 0 N--CA 1.487 1.42 0 O-C-N 121.274 -0.891 . . . . 0.23000000000000001 109.055 179.771 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 330' ' ' LEU . . . . . 0.547 HD11 HD22 ' D' ' 345' ' ' ASN . 49.3 tp -149.87 128.85 12.61 Favored 'General case' 0 C--N 1.302 -1.473 0 O-C-N 121.033 -1.042 . . . . 0.28000000000000003 109.812 -179.46 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 331' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -87.3 109.69 19.69 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.398 -0.813 . . . . 0.91000000000000003 109.184 179.773 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 332' ' ' ILE . . . . . 0.61 HD12 ' HD1' ' B' ' 338' ' ' PHE . 10.3 mt -103.61 108.67 25.03 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.499 0 O-C-N 121.16 -0.962 . . . . 0.23999999999999999 109.778 -179.686 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 333' ' ' ARG . . . . . 0.504 ' NH1' ' HG3' ' B' ' 333' ' ' ARG . 39.3 mtm-85 -71.93 152.24 42.69 Favored 'General case' 0 N--CA 1.488 1.455 0 O-C-N 121.312 -0.868 . . . . 2.9300000000000002 109.387 179.73 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 334' ' ' GLY . . . . . . . . . . . . . . . 78.46 129.83 0.57 Allowed Glycine 0 N--CA 1.49 2.236 0 N-CA-C 109.719 -1.352 . . . . 0.40000000000000002 109.719 179.811 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 335' ' ' ARG . . . . . . . . . . . . . 9.6 ttm180 -79.77 -37.99 34.15 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.29 -1.123 . . . . 3.0099999999999998 109.65 -179.938 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 336' ' ' GLU . . . . . . . . . . . . . 4.5 mm-40 -56.21 -63.68 1.11 Allowed 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.232 -0.917 . . . . 2.2799999999999998 109.783 -179.8 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 337' ' ' ARG . . . . . 0.447 ' HG2' HH11 ' B' ' 337' ' ' ARG . 4.7 mmt-85 -60.53 -30.44 69.74 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.282 -0.886 . . . . 2.9300000000000002 109.608 -179.634 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 338' ' ' PHE . . . . . 0.61 ' HD1' HD12 ' B' ' 332' ' ' ILE . 25.6 t80 -55.09 -57.49 11.51 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.185 -0.947 . . . . 0.37 109.015 179.599 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 339' ' ' GLU . . . . . . . . . . . . . 31.5 mt-10 -50.76 -30.78 14.92 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.313 -0.867 . . . . 1.98 109.695 -179.82 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 340' ' ' MET . . . . . . . . . . . . . 41.5 ttp -63.54 -50.94 67.57 Favored 'General case' 0 N--CA 1.488 1.468 0 O-C-N 121.325 -0.859 . . . . 0.32000000000000001 109.58 -179.93 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 341' ' ' PHE . . . . . . . . . . . . . 76.6 m-85 -62.35 -46.78 87.11 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.086 -1.009 . . . . 0.17999999999999999 109.685 -179.905 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 342' ' ' ARG . . . . . 0.452 HH11 ' HG3' ' B' ' 342' ' ' ARG . 0.2 OUTLIER -48.41 -43.37 34.07 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.294 -0.878 . . . . 2.4199999999999999 109.795 -179.612 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' B' B ' 343' ' ' GLU . . . . . . . . . . . . . 26.0 tt0 -59.42 -44.79 92.81 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.298 -0.876 . . . . 2.3500000000000001 109.895 -179.569 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 344' ' ' LEU . . . . . . . . . . . . . 41.2 mt -62.17 -36.47 81.97 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.197 -0.939 . . . . 0.17999999999999999 109.889 -179.618 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 345' ' ' ASN . . . . . 0.425 ' HA ' ' CZ ' ' D' ' 341' ' ' PHE . 62.7 t-20 -57.05 -54.86 41.98 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.203 -0.935 . . . . 1.0900000000000001 109.982 -179.669 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 346' ' ' GLU . . . . . . . . . . . . . 83.7 tt0 -61.06 -30.49 70.36 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.14 -0.975 . . . . 1.6599999999999999 109.842 -179.472 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 347' ' ' ALA . . . . . 0.876 ' HB1' ' HB1' ' A' ' 347' ' ' ALA . . . -60.31 -56.29 23.35 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.2 -0.937 . . . . 0.17000000000000001 110.116 -179.741 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 348' ' ' LEU . . . . . 0.585 HD22 ' N ' ' B' ' 348' ' ' LEU . 3.9 mm? -61.66 -48.4 81.02 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.087 -1.008 . . . . 0.28999999999999998 110.06 -179.366 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 349' ' ' GLU . . . . . . . . . . . . . 80.8 mm-40 -57.32 -30.66 64.95 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.158 -0.964 . . . . 1.95 110.079 -179.351 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 350' ' ' LEU . . . . . 0.731 HD23 ' O ' ' B' ' 350' ' ' LEU . 4.2 tt -63.95 -47.98 78.3 Favored 'General case' 0 C--N 1.302 -1.465 0 O-C-N 121.204 -0.935 . . . . 0.45000000000000001 109.398 -179.909 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 351' ' ' LYS . . . . . . . . . . . . . 68.3 tttt -59.15 -48.35 81.92 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.331 -0.856 . . . . 1.3799999999999999 109.566 -179.973 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 352' ' ' ASP . . . . . . . . . . . . . 3.2 m-20 -55.26 -29.68 58.58 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.243 -0.911 . . . . 1.1599999999999999 109.371 179.988 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 353' ' ' ALA . . . . . 0.449 ' O ' ' HB2' ' B' ' 357' ' ' LYS . . . -66.74 -38.3 86.38 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.329 -0.857 . . . . 0.60999999999999999 109.487 -179.967 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 354' ' ' GLN . . . . . . . . . . . . . 90.3 mt-30 -80.75 -1.97 45.02 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.236 -0.915 . . . . 1.45 109.467 179.863 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 355' ' ' ALA . . . . . 0.4 ' O ' ' HG3' ' B' ' 358' ' ' GLU . . . -72.21 -71.36 0.29 Allowed 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.238 -0.914 . . . . 0.97999999999999998 109.633 179.972 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 356' ' ' GLY . . . . . . . . . . . . . . . -73.7 1.04 47.49 Favored Glycine 0 N--CA 1.494 2.546 0 N-CA-C 110.201 -1.16 . . . . 1.29 110.201 -179.561 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 357' ' ' LYS . . . . . 0.449 ' HB2' ' O ' ' B' ' 353' ' ' ALA . 4.8 tptp -86.24 12.44 9.86 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 120.931 -1.334 . . . . 4.0899999999999999 109.596 -179.984 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 358' ' ' GLU . . . . . 0.4 ' HG3' ' O ' ' B' ' 355' ' ' ALA . 21.5 mt-10 -50.19 149.23 5.35 Favored Pre-proline 0 N--CA 1.489 1.52 0 O-C-N 121.127 -0.983 . . . . 5.7199999999999998 109.423 179.888 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 359' ' ' PRO . . . . . . . . . . . . . 1.2 Cg_endo -68.08 -5.09 13.86 Favored 'Trans proline' 0 C--N 1.31 -1.5 0 C-N-CA 122.208 1.939 . . . . 4.9800000000000004 110.35 179.918 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 360' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 2.37 0 CA-C-O 118.009 -1.44 . . . . 6.9800000000000004 109.619 -179.973 . . . . . . . . 0 0 . 1 . 015 nuclear build full ' C' C ' 319' ' ' LYS . . . . . 0.473 ' O ' ' O ' ' C' ' 320' ' ' LYS . 14.2 ttpt . . . . . 0 N--CA 1.489 1.511 0 N-CA-C 109.372 -0.603 . . . . 6.8200000000000003 109.372 . . . . . . . . . 1 1 . 1 . 015 nuclear build full ' C' C ' 320' ' ' LYS . . . . . 0.516 ' O ' ' HD3' ' C' ' 322' ' ' PRO . 17.0 ttpp 59.71 120.91 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.364 -0.835 . . . . 6.4900000000000002 109.371 179.943 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' C' C ' 321' ' ' LYS . . . . . . . . . . . . . 20.5 mtmt -83.61 112.4 39.47 Favored Pre-proline 0 N--CA 1.492 1.647 0 O-C-N 121.347 -0.846 . . . . 6.4000000000000004 109.783 -179.855 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' C' C ' 322' ' ' PRO . . . . . 0.516 ' HD3' ' O ' ' C' ' 320' ' ' LYS . 3.9 Cg_endo -70.22 170.79 16.3 Favored 'Trans proline' 0 C--N 1.312 -1.375 0 C-N-CA 121.95 1.767 . . . . 3.4199999999999999 110.038 179.859 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' C' C ' 323' ' ' LEU . . . . . . . . . . . . . 35.7 mt -80.53 104.98 11.44 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.158 -0.963 . . . . 3.9500000000000002 108.845 179.323 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' C' C ' 324' ' ' ASP . . . . . 0.423 ' OD1' ' N ' ' C' ' 324' ' ' ASP . 0.7 OUTLIER -78.58 153.15 31.42 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.222 -0.924 . . . . 1.6299999999999999 109.376 -179.546 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' C' C ' 325' ' ' GLY . . . . . . . . . . . . . . . -68.51 -177.16 12.81 Favored Glycine 0 N--CA 1.489 2.198 0 N-CA-C 109.525 -1.43 . . . . 0.72999999999999998 109.525 -179.82 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' C' C ' 326' ' ' GLU . . . . . . . . . . . . . 34.3 mt-10 -58.18 -175.87 0.02 OUTLIER 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.369 -1.077 . . . . 2.1699999999999999 109.608 -179.782 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' C' C ' 327' ' ' TYR . . . . . 0.52 ' CE1' ' HG2' ' A' ' 333' ' ' ARG . 39.1 m-85 -148.11 111.41 4.93 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.387 -0.82 . . . . 0.47999999999999998 109.399 179.973 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' C' C ' 328' ' ' PHE . . . . . 0.4 ' O ' HG23 ' C' ' 329' ' ' THR . 97.8 m-85 -113.98 -168.16 1.31 Allowed 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.155 -0.966 . . . . 0.33000000000000002 109.629 -179.978 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' C' C ' 329' ' ' THR . . . . . 0.4 HG23 ' O ' ' C' ' 328' ' ' PHE . 9.4 p -153.13 165.83 34.4 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.392 -0.818 . . . . 0.23000000000000001 108.962 -179.99 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' C' C ' 330' ' ' LEU . . . . . 0.502 ' O ' ' HA ' ' A' ' 329' ' ' THR . 16.3 tp -151.94 126.31 9.36 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.202 -0.936 . . . . 0.28000000000000003 109.858 -179.521 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' C' C ' 331' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -85.89 118.65 25.51 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.298 -0.876 . . . . 1.48 109.044 179.433 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' C' C ' 332' ' ' ILE . . . . . . . . . . . . . 83.1 mt -103.45 109.86 28.24 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.508 0 O-C-N 121.163 -0.961 . . . . 0.23999999999999999 110.111 -179.452 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' C' C ' 333' ' ' ARG . . . . . 0.588 ' HG2' ' CE1' ' A' ' 327' ' ' TYR . 10.9 mtt180 -72.8 128.74 36.41 Favored 'General case' 0 N--CA 1.489 1.479 0 O-C-N 121.284 -0.885 . . . . 2.7400000000000002 109.289 179.674 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' C' C ' 334' ' ' GLY . . . . . . . . . . . . . . . 101.46 131.56 7.43 Favored Glycine 0 N--CA 1.489 2.212 0 N-CA-C 109.426 -1.47 . . . . 0.34999999999999998 109.426 -179.913 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' C' C ' 335' ' ' ARG . . . . . 0.484 ' O ' ' HB3' ' C' ' 338' ' ' PHE . 12.1 ttt180 -80.42 -37.28 32.4 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.239 -1.154 . . . . 2.5299999999999998 109.991 -179.653 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' C' C ' 336' ' ' GLU . . . . . . . . . . . . . 6.2 mm-40 -58.51 -57.15 14.22 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.052 -1.03 . . . . 2.6200000000000001 109.943 -179.586 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' C' C ' 337' ' ' ARG . . . . . . . . . . . . . 2.0 mtp180 -59.96 -24.61 64.55 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.235 -0.916 . . . . 2.8100000000000001 109.629 -179.603 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' C' C ' 338' ' ' PHE . . . . . 0.484 ' HB3' ' O ' ' C' ' 335' ' ' ARG . 85.3 t80 -54.95 -63.08 1.27 Allowed 'General case' 0 N--CA 1.489 1.489 0 O-C-N 121.289 -0.882 . . . . 0.40000000000000002 109.387 -179.973 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' C' C ' 339' ' ' GLU . . . . . . . . . . . . . 42.5 mt-10 -50.03 -30.17 10.18 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.287 -0.883 . . . . 2.0499999999999998 109.917 -179.68 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' C' C ' 340' ' ' MET . . . . . . . . . . . . . 27.4 ttp -64.22 -55.95 18.04 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.169 -0.957 . . . . 0.32000000000000001 110.051 -179.882 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' C' C ' 341' ' ' PHE . . . . . . . . . . . . . 52.9 m-85 -62.32 -51.4 67.8 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.157 -0.965 . . . . 0.17999999999999999 109.76 -179.51 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' C' C ' 342' ' ' ARG . . . . . . . . . . . . . 2.7 ttp180 -45.49 -40.85 8.93 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.268 -0.895 . . . . 2.9100000000000001 109.577 179.999 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' C' C ' 343' ' ' GLU . . . . . . . . . . . . . 16.9 tt0 -60.5 -48.62 80.95 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.208 -0.932 . . . . 2.1400000000000001 110.297 -179.637 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' C' C ' 344' ' ' LEU . . . . . 0.48 HD22 ' CD2' ' D' ' 344' ' ' LEU . 37.5 mt -60.51 -42.43 96.4 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 120.937 -1.102 . . . . 0.22 109.852 -179.481 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' C' C ' 345' ' ' ASN . . . . . 0.416 ' HA ' ' CZ ' ' A' ' 341' ' ' PHE . 44.4 t-20 -56.03 -47.9 76.97 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.161 -0.962 . . . . 1.0800000000000001 109.436 179.906 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' C' C ' 346' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -62.42 -37.31 85.36 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.173 -0.955 . . . . 2.21 109.785 -179.756 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' C' C ' 347' ' ' ALA . . . . . 0.775 ' HB1' ' HB1' ' D' ' 347' ' ' ALA . . . -59.04 -55.4 35.53 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.137 -0.977 . . . . 0.17999999999999999 110.251 -179.664 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' C' C ' 348' ' ' LEU . . . . . 0.604 ' N ' HD22 ' C' ' 348' ' ' LEU . 4.1 mm? -60.13 -38.62 83.61 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.109 -0.994 . . . . 0.32000000000000001 109.548 -179.578 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' C' C ' 349' ' ' GLU . . . . . . . . . . . . . 89.3 mt-10 -59.0 -41.68 88.25 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.352 -0.842 . . . . 2.1899999999999999 110.206 -179.481 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' C' C ' 350' ' ' LEU . . . . . 0.687 HD22 HD13 ' D' ' 350' ' ' LEU . 6.6 tt -63.21 -40.77 98.43 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.216 -0.928 . . . . 0.46000000000000002 110.022 -179.439 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' C' C ' 351' ' ' LYS . . . . . . . . . . . . . 2.8 tttm -59.38 -41.27 88.95 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.242 -0.911 . . . . 1.3500000000000001 109.886 -179.602 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' C' C ' 352' ' ' ASP . . . . . . . . . . . . . 3.1 m-20 -56.08 -41.11 74.62 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.171 -0.955 . . . . 1.1899999999999999 110.064 -179.774 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' C' C ' 353' ' ' ALA . . . . . . . . . . . . . . . -67.91 -25.37 65.45 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.219 -0.926 . . . . 0.56999999999999995 109.578 -179.881 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' C' C ' 354' ' ' GLN . . . . . 0.464 ' O ' ' CG ' ' C' ' 354' ' ' GLN . 43.3 tt0 -80.77 -2.3 46.46 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.348 -0.845 . . . . 1.47 109.582 179.995 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' C' C ' 355' ' ' ALA . . . . . . . . . . . . . . . -69.29 -81.0 0.04 OUTLIER 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.27 -0.893 . . . . 0.93000000000000005 109.563 179.927 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' C' C ' 356' ' ' GLY . . . . . . . . . . . . . . . -64.79 96.89 0.23 Allowed Glycine 0 N--CA 1.491 2.319 0 N-CA-C 109.998 -1.241 . . . . 1.3300000000000001 109.998 -179.64 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' C' C ' 357' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -89.7 131.43 35.68 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.319 -1.106 . . . . 4.0099999999999998 109.617 179.713 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' C' C ' 358' ' ' GLU . . . . . . . . . . . . . 4.9 mt-10 -52.17 116.52 8.55 Favored Pre-proline 0 N--CA 1.492 1.661 0 O-C-N 121.279 -0.888 . . . . 5.75 109.919 179.874 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' C' C ' 359' ' ' PRO . . . . . . . . . . . . . 2.2 Cg_endo -63.51 -153.32 0.02 OUTLIER 'Trans proline' 0 C--N 1.314 -1.286 0 C-N-CA 122.072 1.848 . . . . 4.9400000000000004 110.218 179.704 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' C' C ' 360' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.318 0 CA-C-O 118.009 -1.44 . . . . 6.5 109.584 179.904 . . . . . . . . 0 0 . 1 . 015 nuclear build full ' D' D ' 319' ' ' LYS . . . . . . . . . . . . . 21.1 mttt . . . . . 0 N--CA 1.49 1.568 0 CA-C-O 121.26 0.552 . . . . 7.5300000000000002 109.562 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' D' D ' 320' ' ' LYS . . . . . . . . . . . . . 4.5 tttm 53.34 51.08 16.12 Favored 'General case' 0 N--CA 1.488 1.449 0 O-C-N 121.262 -0.899 . . . . 6.4100000000000001 109.041 -179.969 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' D' D ' 321' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -157.24 85.21 2.85 Favored Pre-proline 0 N--CA 1.49 1.573 0 O-C-N 121.361 -0.837 . . . . 6.1100000000000003 109.598 -179.848 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' D' D ' 322' ' ' PRO . . . . . . . . . . . . . 1.8 Cg_endo -68.73 -1.08 6.98 Favored 'Trans proline' 0 C--N 1.31 -1.448 0 C-N-CA 122.438 2.092 . . . . 2.8199999999999998 110.598 179.923 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' D' D ' 323' ' ' LEU . . . . . . . . . . . . . 22.3 mt -84.15 46.73 1.23 Allowed 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.086 -1.009 . . . . 2.8300000000000001 109.496 179.865 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' D' D ' 324' ' ' ASP . . . . . . . . . . . . . 45.2 m-20 -77.64 -176.23 4.23 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.2 -0.938 . . . . 1.54 109.515 -179.811 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' D' D ' 325' ' ' GLY . . . . . . . . . . . . . . . -68.21 -178.77 15.82 Favored Glycine 0 N--CA 1.491 2.306 0 N-CA-C 109.337 -1.505 . . . . 0.58999999999999997 109.337 179.943 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' D' D ' 326' ' ' GLU . . . . . . . . . . . . . 19.7 mt-10 -58.76 -172.38 0.01 OUTLIER 'General case' 0 C--N 1.302 -1.489 0 O-C-N 121.263 -1.139 . . . . 2.1299999999999999 109.566 -179.996 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' D' D ' 327' ' ' TYR . . . . . 0.468 ' CE1' ' HG2' ' B' ' 333' ' ' ARG . 49.9 m-85 -148.84 111.7 4.84 Favored 'General case' 0 N--CA 1.488 1.455 0 O-C-N 121.167 -0.958 . . . . 0.46999999999999997 109.285 179.935 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' D' D ' 328' ' ' PHE . . . . . . . . . . . . . 94.4 m-85 -113.45 -169.5 1.51 Allowed 'General case' 0 N--CA 1.487 1.405 0 O-C-N 121.337 -0.852 . . . . 0.29999999999999999 109.459 -179.859 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' D' D ' 329' ' ' THR . . . . . 0.412 ' HA ' ' O ' ' B' ' 330' ' ' LEU . 25.7 p -152.69 166.95 30.54 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.285 -0.885 . . . . 0.22 108.937 179.953 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' D' D ' 330' ' ' LEU . . . . . 0.407 HD21 ' HB2' ' B' ' 345' ' ' ASN . 49.2 tp -150.1 128.51 12.17 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.151 -0.968 . . . . 0.28000000000000003 109.737 -179.441 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' D' D ' 331' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -86.95 109.74 19.56 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.231 -0.918 . . . . 0.93000000000000005 109.134 179.632 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' D' D ' 332' ' ' ILE . . . . . 0.608 HD12 ' HD1' ' D' ' 338' ' ' PHE . 10.7 mt -103.62 108.55 24.76 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.539 0 O-C-N 121.201 -0.937 . . . . 0.25 109.765 -179.647 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' D' D ' 333' ' ' ARG . . . . . 0.52 ' NH1' ' HG3' ' D' ' 333' ' ' ARG . 39.0 mtm-85 -72.0 152.51 42.41 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.267 -0.895 . . . . 2.9300000000000002 109.375 179.736 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' D' D ' 334' ' ' GLY . . . . . . . . . . . . . . . 78.41 129.73 0.56 Allowed Glycine 0 N--CA 1.492 2.405 0 N-CA-C 109.635 -1.386 . . . . 0.40999999999999998 109.635 179.889 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' D' D ' 335' ' ' ARG . . . . . 0.4 ' HB2' ' CE1' ' B' ' 328' ' ' PHE . 9.6 ttm180 -80.1 -37.04 34.52 Favored 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.343 -1.092 . . . . 3.0299999999999998 109.421 -179.937 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' D' D ' 336' ' ' GLU . . . . . . . . . . . . . 4.7 mm-40 -56.76 -63.88 1.06 Allowed 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.254 -0.904 . . . . 2.2599999999999998 109.726 -179.788 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' D' D ' 337' ' ' ARG . . . . . 0.443 ' HG2' HH11 ' D' ' 337' ' ' ARG . 5.5 mmt-85 -60.34 -29.93 69.2 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.201 -0.937 . . . . 2.9199999999999999 109.803 -179.557 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' D' D ' 338' ' ' PHE . . . . . 0.608 ' HD1' HD12 ' D' ' 332' ' ' ILE . 25.7 t80 -55.82 -57.52 11.72 Favored 'General case' 0 N--CA 1.489 1.492 0 O-C-N 121.242 -0.911 . . . . 0.37 108.909 179.745 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' D' D ' 339' ' ' GLU . . . . . . . . . . . . . 31.0 mt-10 -50.48 -30.93 13.93 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.25 -0.906 . . . . 1.99 109.665 -179.961 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' D' D ' 340' ' ' MET . . . . . . . . . . . . . 41.8 ttp -63.26 -50.96 68.13 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.2 -0.937 . . . . 0.31 109.696 -179.811 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' D' D ' 341' ' ' PHE . . . . . 0.425 ' CZ ' ' HA ' ' B' ' 345' ' ' ASN . 76.8 m-85 -62.35 -46.67 87.63 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.258 -0.901 . . . . 0.17999999999999999 109.661 -179.887 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' D' D ' 342' ' ' ARG . . . . . 0.446 ' HG3' HH11 ' D' ' 342' ' ' ARG . 0.2 OUTLIER -48.43 -43.63 34.52 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.348 -0.845 . . . . 2.4100000000000001 109.871 -179.611 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' D' D ' 343' ' ' GLU . . . . . . . . . . . . . 26.2 tt0 -59.24 -44.56 92.34 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.223 -0.923 . . . . 2.3500000000000001 109.976 -179.595 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' D' D ' 344' ' ' LEU . . . . . 0.48 ' CD2' HD22 ' C' ' 344' ' ' LEU . 42.2 mt -62.41 -36.38 82.16 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.239 -0.913 . . . . 0.19 109.879 -179.654 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' D' D ' 345' ' ' ASN . . . . . 0.547 HD22 HD11 ' B' ' 330' ' ' LEU . 62.3 t-20 -57.53 -54.71 43.78 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.221 -0.925 . . . . 1.0900000000000001 109.923 -179.614 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' D' D ' 346' ' ' GLU . . . . . . . . . . . . . 84.3 tt0 -61.1 -30.33 70.29 Favored 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.127 -0.983 . . . . 1.6899999999999999 109.815 -179.605 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' D' D ' 347' ' ' ALA . . . . . 0.775 ' HB1' ' HB1' ' C' ' 347' ' ' ALA . . . -60.6 -56.22 23.93 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.117 -0.989 . . . . 0.17999999999999999 110.056 -179.652 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' D' D ' 348' ' ' LEU . . . . . 0.596 HD22 ' N ' ' D' ' 348' ' ' LEU . 3.9 mm? -61.54 -48.73 79.69 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.235 -0.915 . . . . 0.31 109.979 -179.491 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' D' D ' 349' ' ' GLU . . . . . . . . . . . . . 80.8 mm-40 -57.2 -30.21 64.36 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.114 -0.991 . . . . 1.95 110.068 -179.317 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' D' D ' 350' ' ' LEU . . . . . 0.722 HD23 ' O ' ' D' ' 350' ' ' LEU . 4.2 tt -64.09 -48.19 77.14 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.03 -1.044 . . . . 0.42999999999999999 109.34 179.945 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' D' D ' 351' ' ' LYS . . . . . . . . . . . . . 68.5 tttt -58.95 -48.43 81.53 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.287 -0.883 . . . . 1.3999999999999999 109.551 -179.899 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' D' D ' 352' ' ' ASP . . . . . . . . . . . . . 3.1 m-20 -55.15 -29.24 57.38 Favored 'General case' 0 N--CA 1.488 1.467 0 O-C-N 121.217 -0.927 . . . . 1.1699999999999999 109.478 179.963 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' D' D ' 353' ' ' ALA . . . . . 0.445 ' O ' ' HB2' ' D' ' 357' ' ' LYS . . . -67.33 -38.23 84.57 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.271 -0.893 . . . . 0.58999999999999997 109.47 179.968 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' D' D ' 354' ' ' GLN . . . . . 0.409 ' OE1' HD11 ' C' ' 350' ' ' LEU . 89.6 mt-30 -80.94 -1.84 45.25 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.222 -0.924 . . . . 1.4399999999999999 109.453 179.995 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' D' D ' 355' ' ' ALA . . . . . 0.404 ' O ' ' HG3' ' D' ' 358' ' ' GLU . . . -72.12 -71.58 0.27 Allowed 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.36 -0.838 . . . . 0.97999999999999998 109.62 179.837 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' D' D ' 356' ' ' GLY . . . . . . . . . . . . . . . -73.9 1.91 44.5 Favored Glycine 0 N--CA 1.492 2.39 0 N-CA-C 110.173 -1.171 . . . . 1.28 110.173 -179.504 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' D' D ' 357' ' ' LYS . . . . . 0.445 ' HB2' ' O ' ' D' ' 353' ' ' ALA . 5.0 tptp -86.96 12.32 11.49 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.03 -1.276 . . . . 4.0899999999999999 109.452 179.988 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' D' D ' 358' ' ' GLU . . . . . 0.404 ' HG3' ' O ' ' D' ' 355' ' ' ALA . 19.6 mt-10 -49.95 149.17 5.02 Favored Pre-proline 0 N--CA 1.49 1.548 0 O-C-N 121.214 -0.929 . . . . 5.71 109.378 179.967 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' D' D ' 359' ' ' PRO . . . . . . . . . . . . . 1.3 Cg_endo -68.28 -4.46 12.81 Favored 'Trans proline' 0 C--N 1.309 -1.505 0 C-N-CA 122.247 1.965 . . . . 4.9699999999999998 110.33 -179.935 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' D' D ' 360' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.182 0 CA-C-O 118.049 -1.417 . . . . 6.9699999999999998 109.601 -179.963 . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 319' ' ' LYS . . . . . 0.443 ' O ' ' HB2' ' A' ' 320' ' ' LYS . 4.8 mmtp . . . . . 0 N--CA 1.491 1.577 0 N-CA-C 109.576 -0.527 . . . . 7.5499999999999998 109.576 . . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 320' ' ' LYS . . . . . 0.443 ' HB2' ' O ' ' A' ' 319' ' ' LYS . 19.0 mttt 61.66 -168.45 0.18 Allowed 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.334 -0.854 . . . . 6.4299999999999997 109.434 -179.961 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 321' ' ' LYS . . . . . . . . . . . . . 9.5 mttt -158.51 71.14 3.82 Favored Pre-proline 0 N--CA 1.49 1.537 0 O-C-N 121.34 -0.85 . . . . 6.1299999999999999 109.516 179.954 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 322' ' ' PRO . . . . . . . . . . . . . 4.1 Cg_exo -60.26 136.93 71.63 Favored 'Trans proline' 0 C--N 1.309 -1.535 0 C-N-CA 122.083 1.855 . . . . 2.8300000000000001 110.169 179.923 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 323' ' ' LEU . . . . . . . . . . . . . 30.2 mt -80.5 115.24 19.92 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.268 -0.895 . . . . 2.8300000000000001 109.337 179.984 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 324' ' ' ASP . . . . . . . . . . . . . 4.7 m-20 -79.36 144.41 34.21 Favored 'General case' 0 C--N 1.304 -1.404 0 O-C-N 121.268 -0.895 . . . . 1.53 109.358 179.909 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 325' ' ' GLY . . . . . 0.414 ' O ' ' CE2' ' A' ' 327' ' ' TYR . . . -68.34 177.37 25.3 Favored Glycine 0 N--CA 1.487 2.093 0 N-CA-C 109.181 -1.568 . . . . 0.60999999999999999 109.181 179.941 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 326' ' ' GLU . . . . . . . . . . . . . 66.9 mm-40 -56.35 179.21 0.04 OUTLIER 'General case' 0 N--CA 1.489 1.489 0 O-C-N 121.172 -1.193 . . . . 2.1299999999999999 109.312 -179.917 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 327' ' ' TYR . . . . . 0.605 ' CE1' ' CG ' ' C' ' 333' ' ' ARG . 43.1 m-85 -148.75 95.27 2.39 Favored 'General case' 0 N--CA 1.488 1.446 0 O-C-N 121.249 -0.907 . . . . 0.47999999999999998 109.557 -179.898 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 328' ' ' PHE . . . . . . . . . . . . . 84.7 m-85 -103.35 -162.48 0.91 Allowed 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.255 -0.903 . . . . 0.31 109.62 -179.991 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 329' ' ' THR . . . . . . . . . . . . . 40.8 p -154.12 166.91 31.6 Favored 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.365 -0.834 . . . . 0.22 109.11 179.855 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 330' ' ' LEU . . . . . . . . . . . . . 18.9 tp -149.96 126.61 10.96 Favored 'General case' 0 N--CA 1.488 1.46 0 O-C-N 121.097 -1.002 . . . . 0.28000000000000003 110.064 -179.561 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 331' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -88.07 112.62 22.86 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.353 -0.842 . . . . 0.91000000000000003 108.95 179.399 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 332' ' ' ILE . . . . . 0.578 HG21 ' HA ' ' A' ' 338' ' ' PHE . 50.5 mt -103.49 109.45 27.06 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.595 0 O-C-N 121.216 -0.928 . . . . 0.26000000000000001 109.792 -179.716 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 333' ' ' ARG . . . . . 0.542 ' HG2' ' CE1' ' C' ' 327' ' ' TYR . 80.8 mtt180 -72.73 149.46 43.71 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.37 -0.831 . . . . 2.9199999999999999 109.449 179.803 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 334' ' ' GLY . . . . . . . . . . . . . . . 82.03 124.69 0.78 Allowed Glycine 0 N--CA 1.491 2.307 0 N-CA-C 109.398 -1.481 . . . . 0.40000000000000002 109.398 -179.894 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 335' ' ' ARG . . . . . . . . . . . . . 60.6 ttt180 -75.53 -33.42 60.71 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.318 -1.107 . . . . 3.0099999999999998 109.542 -179.894 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 336' ' ' GLU . . . . . . . . . . . . . 62.8 tt0 -58.32 -61.84 2.27 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.267 -0.896 . . . . 2.29 109.768 -179.886 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 337' ' ' ARG . . . . . 0.654 ' NH2' HD12 ' C' ' 348' ' ' LEU . 8.2 mmt180 -62.1 -33.18 73.95 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.122 -0.987 . . . . 2.9300000000000002 109.783 -179.739 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 338' ' ' PHE . . . . . 0.578 ' HA ' HG21 ' A' ' 332' ' ' ILE . 45.7 t80 -54.38 -57.02 12.87 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.123 -0.986 . . . . 0.38 109.753 -179.631 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 339' ' ' GLU . . . . . . . . . . . . . 41.6 mt-10 -51.09 -35.1 33.37 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.234 -0.916 . . . . 1.97 109.989 -179.699 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 340' ' ' MET . . . . . . . . . . . . . 48.5 ttp -63.61 -49.14 74.47 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.262 -0.899 . . . . 0.31 110.092 -179.56 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 341' ' ' PHE . . . . . . . . . . . . . 44.3 m-85 -61.83 -45.97 91.51 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.239 -0.913 . . . . 0.17999999999999999 109.835 -179.456 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 342' ' ' ARG . . . . . . . . . . . . . 5.7 ttt180 -49.91 -42.26 47.73 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.167 -0.958 . . . . 2.4199999999999999 110.06 -179.658 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 343' ' ' GLU . . . . . . . . . . . . . 1.2 tp10 -59.04 -49.85 76.33 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.144 -0.972 . . . . 2.3500000000000001 109.886 -179.613 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 344' ' ' LEU . . . . . 0.439 HD22 HD22 ' B' ' 344' ' ' LEU . 61.5 mt -59.94 -30.95 69.42 Favored 'General case' 0 N--CA 1.489 1.495 0 O-C-N 121.222 -0.924 . . . . 0.17999999999999999 109.403 -179.737 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 345' ' ' ASN . . . . . 0.553 ' C ' HD21 ' A' ' 345' ' ' ASN . 0.3 OUTLIER -58.41 -59.3 5.56 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.271 -0.893 . . . . 1.0900000000000001 109.74 -179.98 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 346' ' ' GLU . . . . . 0.465 ' OE1' ' NZ ' ' B' ' 351' ' ' LYS . 1.0 OUTLIER -61.48 -26.29 67.8 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.234 -0.917 . . . . 1.6499999999999999 109.884 -179.577 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 347' ' ' ALA . . . . . 0.478 ' HB1' ' HB1' ' B' ' 347' ' ' ALA . . . -60.79 -57.93 10.59 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.173 -0.954 . . . . 0.17999999999999999 110.018 -179.74 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 348' ' ' LEU . . . . . 0.592 HD22 ' N ' ' A' ' 348' ' ' LEU . 4.1 mm? -61.94 -44.5 96.63 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.211 -0.931 . . . . 0.29999999999999999 110.122 -179.38 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 349' ' ' GLU . . . . . . . . . . . . . 12.0 mm-40 -58.34 -33.34 69.43 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.123 -0.985 . . . . 1.9399999999999999 109.939 -179.462 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 350' ' ' LEU . . . . . 0.754 HD23 ' O ' ' A' ' 350' ' ' LEU . 5.1 tt -64.47 -43.51 93.98 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.225 -0.922 . . . . 0.46000000000000002 109.843 -179.761 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 351' ' ' LYS . . . . . 0.44 ' NZ ' ' OE1' ' B' ' 346' ' ' GLU . 19.8 tttp -59.15 -45.11 91.82 Favored 'General case' 0 N--CA 1.489 1.499 0 O-C-N 121.337 -0.852 . . . . 1.3999999999999999 109.961 -179.643 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 352' ' ' ASP . . . . . . . . . . . . . 36.1 m-20 -58.66 -49.03 79.04 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.233 -0.917 . . . . 1.1599999999999999 110.265 -179.584 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 353' ' ' ALA . . . . . . . . . . . . . . . -65.99 -11.05 45.11 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.087 -1.008 . . . . 0.63 109.893 -179.31 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 354' ' ' GLN . . . . . 0.675 ' OE1' HD11 ' B' ' 350' ' ' LEU . 5.6 mt-30 -83.98 -54.2 5.02 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.228 -0.92 . . . . 1.47 109.55 179.765 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 355' ' ' ALA . . . . . . . . . . . . . . . -71.41 -3.94 23.63 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.36 -0.838 . . . . 1.01 109.962 -179.731 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 356' ' ' GLY . . . . . . . . . . . . . . . -80.44 -9.03 86.97 Favored Glycine 0 N--CA 1.491 2.32 0 N-CA-C 109.763 -1.335 . . . . 1.3 109.763 -179.883 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 357' ' ' LYS . . . . . . . . . . . . . 20.0 mttt -90.35 103.32 16.02 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.237 -1.155 . . . . 4.0999999999999996 109.56 179.946 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 358' ' ' GLU . . . . . 0.56 ' CB ' ' HD3' ' A' ' 359' ' ' PRO . 1.8 tt0 -49.81 -55.45 23.49 Favored Pre-proline 0 N--CA 1.489 1.495 0 O-C-N 121.153 -0.967 . . . . 5.75 109.685 179.949 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 359' ' ' PRO . . . . . 0.56 ' HD3' ' CB ' ' A' ' 358' ' ' GLU . 2.2 Cg_endo -62.71 144.87 94.69 Favored 'Trans proline' 0 C--N 1.311 -1.427 0 C-N-CA 121.86 1.706 . . . . 5.0 110.105 179.979 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 360' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.356 0 N-CA-C 109.418 -1.473 . . . . 6.9699999999999998 109.418 179.992 . . . . . . . . 0 0 . 1 . 016 nuclear build full ' B' B ' 319' ' ' LYS . . . . . 0.429 ' O ' ' HB2' ' B' ' 320' ' ' LYS . 4.8 mmtp . . . . . 0 N--CA 1.49 1.557 0 CA-C-O 121.274 0.559 . . . . 7.5499999999999998 109.501 . . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 320' ' ' LYS . . . . . 0.429 ' HB2' ' O ' ' B' ' 319' ' ' LYS . 18.9 mttt 61.09 -168.86 0.17 Allowed 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.216 -0.927 . . . . 6.4400000000000004 109.49 -179.904 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 321' ' ' LYS . . . . . . . . . . . . . 10.0 mttt -158.22 70.5 3.94 Favored Pre-proline 0 N--CA 1.49 1.575 0 O-C-N 121.24 -0.913 . . . . 6.1299999999999999 109.521 179.99 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 322' ' ' PRO . . . . . . . . . . . . . 4.4 Cg_exo -59.86 136.74 71.99 Favored 'Trans proline' 0 C--N 1.31 -1.474 0 C-N-CA 122.163 1.909 . . . . 2.8199999999999998 110.204 179.823 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 323' ' ' LEU . . . . . . . . . . . . . 27.7 mt -80.37 115.81 20.11 Favored 'General case' 0 N--CA 1.489 1.48 0 O-C-N 121.193 -0.942 . . . . 2.8399999999999999 109.321 -179.991 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 324' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 -79.66 142.46 35.52 Favored 'General case' 0 N--CA 1.489 1.491 0 O-C-N 121.206 -0.934 . . . . 1.53 109.5 179.991 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 325' ' ' GLY . . . . . 0.411 ' O ' ' CE2' ' B' ' 327' ' ' TYR . . . -65.97 176.96 15.67 Favored Glycine 0 N--CA 1.489 2.194 0 N-CA-C 109.264 -1.534 . . . . 0.58999999999999997 109.264 179.765 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 326' ' ' GLU . . . . . . . . . . . . . 67.0 mm-40 -56.48 179.31 0.04 OUTLIER 'General case' 0 N--CA 1.489 1.5 0 O-C-N 121.16 -1.2 . . . . 2.1299999999999999 109.261 -179.973 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 327' ' ' TYR . . . . . 0.579 ' CE1' ' HG2' ' D' ' 333' ' ' ARG . 44.1 m-85 -148.63 94.97 2.36 Favored 'General case' 0 N--CA 1.488 1.425 0 O-C-N 121.011 -1.056 . . . . 0.47999999999999998 109.582 -179.956 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 328' ' ' PHE . . . . . . . . . . . . . 85.5 m-85 -103.19 -162.83 0.94 Allowed 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.265 -0.897 . . . . 0.32000000000000001 109.534 -179.91 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 329' ' ' THR . . . . . . . . . . . . . 41.1 p -153.96 166.92 31.46 Favored 'General case' 0 N--CA 1.488 1.471 0 O-C-N 121.33 -0.856 . . . . 0.23000000000000001 109.082 179.943 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 330' ' ' LEU . . . . . 0.512 HD11 HD22 ' D' ' 345' ' ' ASN . 18.6 tp -149.97 126.03 10.6 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.011 -1.056 . . . . 0.28000000000000003 109.954 -179.579 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 331' ' ' GLN . . . . . 0.453 ' OE1' ' O ' ' D' ' 328' ' ' PHE . 0.2 OUTLIER -87.38 112.66 22.35 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.273 -0.892 . . . . 0.91000000000000003 108.895 179.432 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' B' B ' 332' ' ' ILE . . . . . 0.561 HG21 ' HA ' ' B' ' 338' ' ' PHE . 50.3 mt -103.46 109.6 27.47 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.561 0 O-C-N 121.113 -0.992 . . . . 0.23999999999999999 109.746 -179.699 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 333' ' ' ARG . . . . . 0.541 ' HG2' ' CE1' ' D' ' 327' ' ' TYR . 81.6 mtt180 -72.84 149.96 43.1 Favored 'General case' 0 N--CA 1.489 1.486 0 O-C-N 121.329 -0.857 . . . . 2.9300000000000002 109.414 179.748 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 334' ' ' GLY . . . . . . . . . . . . . . . 81.4 124.81 0.7 Allowed Glycine 0 N--CA 1.491 2.36 0 N-CA-C 109.444 -1.463 . . . . 0.40000000000000002 109.444 -179.893 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 335' ' ' ARG . . . . . . . . . . . . . 58.7 ttt180 -75.42 -33.15 60.92 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.22 -1.165 . . . . 3.0099999999999998 109.644 -179.874 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 336' ' ' GLU . . . . . . . . . . . . . 61.3 tt0 -58.78 -61.77 2.37 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.241 -0.912 . . . . 2.2799999999999998 109.704 -179.793 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 337' ' ' ARG . . . . . . . . . . . . . 7.8 mmt180 -61.78 -33.1 73.48 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.161 -0.962 . . . . 2.9300000000000002 109.743 -179.762 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 338' ' ' PHE . . . . . 0.561 ' HA ' HG21 ' B' ' 332' ' ' ILE . 46.4 t80 -54.26 -57.54 10.79 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.171 -0.956 . . . . 0.37 109.794 -179.805 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 339' ' ' GLU . . . . . . . . . . . . . 41.3 mt-10 -51.02 -34.82 31.02 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.177 -0.952 . . . . 1.98 110.071 -179.686 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 340' ' ' MET . . . . . . . . . . . . . 47.8 ttp -63.91 -48.99 74.4 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.146 -0.971 . . . . 0.32000000000000001 110.094 -179.505 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 341' ' ' PHE . . . . . . . . . . . . . 44.5 m-85 -61.96 -46.17 90.47 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.151 -0.968 . . . . 0.17999999999999999 109.885 -179.56 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 342' ' ' ARG . . . . . . . . . . . . . 6.0 ttt180 -49.69 -42.36 45.52 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.213 -0.929 . . . . 2.4199999999999999 110.051 -179.631 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 343' ' ' GLU . . . . . . . . . . . . . 1.1 tp10 -58.92 -49.62 77.11 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.077 -1.014 . . . . 2.3500000000000001 109.882 -179.604 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 344' ' ' LEU . . . . . 0.439 HD22 HD22 ' A' ' 344' ' ' LEU . 60.0 mt -60.29 -30.84 69.74 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.208 -0.932 . . . . 0.17999999999999999 109.432 -179.677 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 345' ' ' ASN . . . . . 0.428 ' HA ' ' CZ ' ' D' ' 341' ' ' PHE . 64.4 t-20 -58.56 -59.05 5.99 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.354 -0.841 . . . . 1.0900000000000001 109.735 179.978 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 346' ' ' GLU . . . . . 0.44 ' OE1' ' NZ ' ' A' ' 351' ' ' LYS . 1.1 tm-20 -61.64 -26.38 67.96 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.237 -0.914 . . . . 1.6599999999999999 109.943 -179.642 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 347' ' ' ALA . . . . . 0.478 ' HB1' ' HB1' ' A' ' 347' ' ' ALA . . . -60.67 -57.7 11.6 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.187 -0.946 . . . . 0.17000000000000001 110.116 -179.817 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 348' ' ' LEU . . . . . 0.695 HD12 ' CZ ' ' D' ' 337' ' ' ARG . 4.1 mm? -62.06 -44.7 96.12 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.188 -0.945 . . . . 0.28999999999999998 110.192 -179.448 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 349' ' ' GLU . . . . . . . . . . . . . 11.3 mm-40 -58.35 -33.09 69.16 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.222 -0.924 . . . . 1.95 109.979 -179.422 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 350' ' ' LEU . . . . . 0.766 HD23 ' O ' ' B' ' 350' ' ' LEU . 5.2 tt -64.59 -43.34 94.12 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.258 -0.901 . . . . 0.45000000000000001 109.858 -179.797 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 351' ' ' LYS . . . . . 0.465 ' NZ ' ' OE1' ' A' ' 346' ' ' GLU . 19.1 tttp -59.5 -44.57 93.07 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.365 -0.834 . . . . 1.3799999999999999 109.917 -179.588 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 352' ' ' ASP . . . . . . . . . . . . . 37.2 m-20 -58.68 -49.24 78.27 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.242 -0.911 . . . . 1.1599999999999999 110.178 -179.676 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 353' ' ' ALA . . . . . . . . . . . . . . . -65.8 -11.22 44.37 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.044 -1.035 . . . . 0.60999999999999999 109.839 -179.438 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 354' ' ' GLN . . . . . 0.722 ' OE1' HD11 ' A' ' 350' ' ' LEU . 5.5 mt-30 -83.6 -54.59 4.83 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.189 -0.945 . . . . 1.45 109.464 179.962 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 355' ' ' ALA . . . . . . . . . . . . . . . -71.39 -3.68 22.17 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.366 -0.834 . . . . 0.97999999999999998 109.915 -179.744 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 356' ' ' GLY . . . . . . . . . . . . . . . -80.49 -9.16 86.8 Favored Glycine 0 N--CA 1.491 2.333 0 N-CA-C 109.721 -1.352 . . . . 1.29 109.721 -179.775 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 357' ' ' LYS . . . . . . . . . . . . . 21.3 mttt -90.27 103.38 16.06 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.119 -1.224 . . . . 4.0899999999999999 109.567 179.892 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 358' ' ' GLU . . . . . 0.56 ' N ' ' HD2' ' B' ' 359' ' ' PRO . 1.8 tt0 -50.01 -55.43 24.35 Favored Pre-proline 0 N--CA 1.489 1.499 0 O-C-N 121.25 -0.907 . . . . 5.7199999999999998 109.659 179.92 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 359' ' ' PRO . . . . . 0.56 ' HD2' ' N ' ' B' ' 358' ' ' GLU . 2.2 Cg_endo -62.47 145.56 95.57 Favored 'Trans proline' 0 C--N 1.311 -1.4 0 C-N-CA 121.832 1.688 . . . . 4.9800000000000004 110.028 -179.942 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 360' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.236 0 CA-C-O 118.03 -1.428 . . . . 6.9800000000000004 109.568 -179.959 . . . . . . . . 0 0 . 1 . 016 nuclear build full ' C' C ' 319' ' ' LYS . . . . . . . . . . . . . 12.2 mttt . . . . . 0 N--CA 1.49 1.549 0 CA-C-O 121.383 0.611 . . . . 6.8200000000000003 109.375 . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' C' C ' 320' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER 57.84 16.05 3.39 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.238 -0.914 . . . . 6.4900000000000002 109.705 179.875 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' C' C ' 321' ' ' LYS . . . . . 0.619 ' N ' ' CD ' ' C' ' 322' ' ' PRO . 13.0 mmtt -81.35 -43.8 1.14 Allowed Pre-proline 0 N--CA 1.49 1.529 0 O-C-N 121.205 -0.935 . . . . 6.4000000000000004 110.696 179.953 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' C' C ' 322' ' ' PRO . . . . . 0.619 ' CD ' ' N ' ' C' ' 321' ' ' LYS . 1.3 Cg_endo -65.89 -45.76 5.76 Favored 'Trans proline' 0 C--N 1.315 -1.205 0 C-N-CA 121.427 1.418 . . . . 3.4199999999999999 110.554 -179.548 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' C' C ' 323' ' ' LEU . . . . . . . . . . . . . 32.7 mt -83.48 78.04 9.72 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.237 -0.914 . . . . 3.9500000000000002 110.269 -179.412 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' C' C ' 324' ' ' ASP . . . . . 0.462 ' CB ' ' OH ' ' C' ' 327' ' ' TYR . 0.8 OUTLIER -83.6 177.14 8.54 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.347 -0.846 . . . . 1.6299999999999999 109.325 179.26 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' C' C ' 325' ' ' GLY . . . . . . . . . . . . . . . -69.46 -171.49 8.17 Favored Glycine 0 N--CA 1.492 2.419 0 N-CA-C 109.678 -1.369 . . . . 0.72999999999999998 109.678 179.776 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' C' C ' 326' ' ' GLU . . . . . . . . . . . . . 1.8 mm-40 -59.41 -175.06 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.193 -1.181 . . . . 2.1699999999999999 109.527 179.932 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' C' C ' 327' ' ' TYR . . . . . 0.542 ' CE1' ' HG2' ' A' ' 333' ' ' ARG . 41.2 m-85 -149.94 105.79 3.44 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.245 -0.909 . . . . 0.47999999999999998 109.76 179.847 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' C' C ' 328' ' ' PHE . . . . . 0.437 ' O ' HG23 ' C' ' 329' ' ' THR . 91.6 m-85 -111.7 -164.21 0.9 Allowed 'General case' 0 C--N 1.303 -1.436 0 O-C-N 121.42 -0.8 . . . . 0.33000000000000002 109.185 179.757 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' C' C ' 329' ' ' THR . . . . . 0.437 HG23 ' O ' ' C' ' 328' ' ' PHE . 11.3 p -153.94 160.46 42.11 Favored 'General case' 0 C--N 1.302 -1.478 0 O-C-N 121.397 -0.815 . . . . 0.23000000000000001 109.064 179.776 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' C' C ' 330' ' ' LEU . . . . . . . . . . . . . 16.7 tp -148.96 125.64 11.09 Favored 'General case' 0 N--CA 1.488 1.471 0 O-C-N 121.252 -0.905 . . . . 0.28000000000000003 109.644 -179.788 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' C' C ' 331' ' ' GLN . . . . . . . . . . . . . 1.5 tp60 -86.93 116.65 25.14 Favored 'General case' 0 N--CA 1.489 1.5 0 O-C-N 121.282 -0.887 . . . . 1.48 109.021 179.61 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' C' C ' 332' ' ' ILE . . . . . 0.407 HD13 ' CD2' ' C' ' 341' ' ' PHE . 59.6 mt -103.3 110.02 28.62 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.452 0 O-C-N 121.128 -0.983 . . . . 0.23999999999999999 109.654 -179.796 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' C' C ' 333' ' ' ARG . . . . . 0.605 ' CG ' ' CE1' ' A' ' 327' ' ' TYR . 2.1 mpt_? -71.61 149.75 45.32 Favored 'General case' 0 C--N 1.304 -1.381 0 O-C-N 121.334 -0.854 . . . . 2.7400000000000002 109.07 179.634 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' C' C ' 334' ' ' GLY . . . . . . . . . . . . . . . 80.98 130.09 0.99 Allowed Glycine 0 N--CA 1.489 2.189 0 N-CA-C 109.567 -1.413 . . . . 0.34999999999999998 109.567 -179.942 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' C' C ' 335' ' ' ARG . . . . . . . . . . . . . 57.1 ttt180 -77.92 -36.88 48.91 Favored 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.401 -1.058 . . . . 2.5299999999999998 109.52 -179.89 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' C' C ' 336' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -57.5 -58.28 8.98 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.371 -0.831 . . . . 2.6200000000000001 110.169 -179.471 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' C' C ' 337' ' ' ARG . . . . . 0.555 ' NH1' ' HG3' ' C' ' 337' ' ' ARG . 0.1 OUTLIER -59.87 -31.92 70.23 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.173 -0.954 . . . . 2.8100000000000001 109.797 -179.638 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' C' C ' 338' ' ' PHE . . . . . . . . . . . . . 79.7 t80 -54.07 -55.21 29.69 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.294 -0.879 . . . . 0.40000000000000002 109.745 -179.72 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' C' C ' 339' ' ' GLU . . . . . . . . . . . . . 34.0 mt-10 -52.01 -35.71 47.66 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.299 -0.876 . . . . 2.0499999999999998 109.977 -179.795 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' C' C ' 340' ' ' MET . . . . . . . . . . . . . 31.5 ttp -64.38 -51.2 64.47 Favored 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.307 -0.87 . . . . 0.32000000000000001 110.304 -179.454 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' C' C ' 341' ' ' PHE . . . . . 0.407 ' CD2' HD13 ' C' ' 332' ' ' ILE . 33.1 m-85 -62.06 -40.06 94.5 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.056 -1.028 . . . . 0.17999999999999999 110.365 -179.338 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' C' C ' 342' ' ' ARG . . . . . 0.522 ' NH1' ' HG3' ' C' ' 342' ' ' ARG . 0.0 OUTLIER -51.7 -48.61 63.46 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.022 -1.049 . . . . 2.9100000000000001 110.091 -179.516 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' C' C ' 343' ' ' GLU . . . . . . . . . . . . . 1.6 tp10 -59.74 -43.81 94.06 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.274 -0.891 . . . . 2.1400000000000001 110.247 -179.419 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' C' C ' 344' ' ' LEU . . . . . . . . . . . . . 53.6 mt -61.5 -34.53 75.66 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.157 -0.964 . . . . 0.22 109.839 -179.529 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' C' C ' 345' ' ' ASN . . . . . 0.406 ' O ' ' HG2' ' C' ' 349' ' ' GLU . 39.0 t-20 -58.82 -57.77 11.57 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.242 -0.911 . . . . 1.0800000000000001 109.71 -179.997 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' C' C ' 346' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -60.61 -24.87 65.84 Favored 'General case' 0 N--CA 1.489 1.486 0 O-C-N 121.205 -0.934 . . . . 2.21 109.926 -179.603 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' C' C ' 347' ' ' ALA . . . . . 0.562 ' HB1' ' HB1' ' D' ' 347' ' ' ALA . . . -62.07 -59.62 4.81 Favored 'General case' 0 N--CA 1.489 1.501 0 O-C-N 121.095 -1.003 . . . . 0.17999999999999999 109.65 -179.979 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' C' C ' 348' ' ' LEU . . . . . 0.654 HD12 ' NH2' ' A' ' 337' ' ' ARG . 3.8 mm? -64.43 -48.35 75.66 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.271 -0.893 . . . . 0.32000000000000001 110.328 -179.583 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' C' C ' 349' ' ' GLU . . . . . 0.406 ' HG2' ' O ' ' C' ' 345' ' ' ASN . 3.8 mm-40 -55.33 -34.11 63.92 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.119 -0.988 . . . . 2.1899999999999999 109.482 -179.393 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' C' C ' 350' ' ' LEU . . . . . 0.811 ' CD2' HD13 ' D' ' 350' ' ' LEU . 5.0 tt -64.87 -36.98 86.11 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.301 -0.874 . . . . 0.46000000000000002 109.073 179.695 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' C' C ' 351' ' ' LYS . . . . . . . . . . . . . 19.4 tttt -60.33 -47.57 85.47 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.494 -0.754 . . . . 1.3500000000000001 109.306 179.913 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' C' C ' 352' ' ' ASP . . . . . . . . . . . . . 15.0 m-20 -55.88 -52.96 62.26 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.385 -0.822 . . . . 1.1899999999999999 109.514 -179.988 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' C' C ' 353' ' ' ALA . . . . . . . . . . . . . . . -66.46 -14.49 62.3 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.188 -0.945 . . . . 0.56999999999999995 109.59 -179.818 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' C' C ' 354' ' ' GLN . . . . . 0.522 ' CG ' ' HG2' ' C' ' 359' ' ' PRO . 3.1 tt0 -81.9 -29.89 32.16 Favored 'General case' 0 N--CA 1.488 1.432 0 O-C-N 121.285 -0.884 . . . . 1.47 109.056 179.822 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' C' C ' 355' ' ' ALA . . . . . 0.423 ' O ' ' C ' ' C' ' 356' ' ' GLY . . . -73.91 -63.04 1.3 Allowed 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.345 -0.847 . . . . 0.93000000000000005 109.553 179.73 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' C' C ' 356' ' ' GLY . . . . . 0.423 ' C ' ' O ' ' C' ' 355' ' ' ALA . . . -41.93 -87.33 0.01 OUTLIER Glycine 0 N--CA 1.493 2.448 0 N-CA-C 109.757 -1.337 . . . . 1.3300000000000001 109.757 -179.775 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' C' C ' 357' ' ' LYS . . . . . 0.474 ' O ' ' HD3' ' C' ' 359' ' ' PRO . 1.0 OUTLIER -86.44 91.49 8.54 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.21 -1.171 . . . . 4.0099999999999998 109.265 -179.93 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' C' C ' 358' ' ' GLU . . . . . . . . . . . . . 3.3 tm-20 -45.17 103.91 0.37 Allowed Pre-proline 0 N--CA 1.492 1.634 0 O-C-N 121.388 -0.82 . . . . 5.75 109.719 -179.72 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' C' C ' 359' ' ' PRO . . . . . 0.522 ' HG2' ' CG ' ' C' ' 354' ' ' GLN . 1.4 Cg_endo -66.56 -81.06 0.01 OUTLIER 'Trans proline' 0 C--N 1.311 -1.428 0 C-N-CA 121.886 1.724 . . . . 4.9400000000000004 109.684 179.622 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' C' C ' 360' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.2 0 CA-C-O 117.961 -1.466 . . . . 6.5 109.451 179.813 . . . . . . . . 0 0 . 1 . 016 nuclear build full ' D' D ' 319' ' ' LYS . . . . . 0.411 ' O ' ' HB2' ' D' ' 320' ' ' LYS . 4.5 mmtp . . . . . 0 N--CA 1.49 1.575 0 N-CA-C 109.459 -0.571 . . . . 7.5300000000000002 109.459 . . . . . . . . . 1 1 . 1 . 016 nuclear build full ' D' D ' 320' ' ' LYS . . . . . 0.411 ' HB2' ' O ' ' D' ' 319' ' ' LYS . 19.6 mttt 60.71 -169.6 0.16 Allowed 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.341 -0.849 . . . . 6.4100000000000001 109.339 -179.994 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' D' D ' 321' ' ' LYS . . . . . . . . . . . . . 10.0 mttt -157.83 70.54 4.15 Favored Pre-proline 0 N--CA 1.488 1.449 0 O-C-N 121.225 -0.922 . . . . 6.1100000000000003 109.482 -179.946 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' D' D ' 322' ' ' PRO . . . . . . . . . . . . . 4.2 Cg_exo -60.16 136.76 70.92 Favored 'Trans proline' 0 C--N 1.31 -1.484 0 C-N-CA 122.135 1.89 . . . . 2.8199999999999998 110.227 179.914 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' D' D ' 323' ' ' LEU . . . . . . . . . . . . . 25.0 mt -80.07 115.58 19.72 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.287 -0.883 . . . . 2.8300000000000001 109.443 -179.991 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' D' D ' 324' ' ' ASP . . . . . . . . . . . . . 4.1 m-20 -79.45 143.47 34.94 Favored 'General case' 0 N--CA 1.488 1.47 0 O-C-N 121.274 -0.891 . . . . 1.54 109.312 179.999 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' D' D ' 325' ' ' GLY . . . . . 0.407 ' O ' ' CE2' ' D' ' 327' ' ' TYR . . . -67.19 176.59 22.32 Favored Glycine 0 N--CA 1.49 2.275 0 N-CA-C 109.12 -1.592 . . . . 0.58999999999999997 109.12 179.899 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' D' D ' 326' ' ' GLU . . . . . . . . . . . . . 66.1 mm-40 -56.17 179.12 0.04 OUTLIER 'General case' 0 N--CA 1.488 1.436 0 O-C-N 121.126 -1.22 . . . . 2.1299999999999999 109.222 -179.923 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' D' D ' 327' ' ' TYR . . . . . 0.541 ' CE1' ' HG2' ' B' ' 333' ' ' ARG . 43.8 m-85 -148.44 94.81 2.35 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.21 -0.931 . . . . 0.46999999999999997 109.453 -179.875 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' D' D ' 328' ' ' PHE . . . . . 0.453 ' O ' ' OE1' ' B' ' 331' ' ' GLN . 85.6 m-85 -103.03 -162.54 0.92 Allowed 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.191 -0.943 . . . . 0.29999999999999999 109.574 179.93 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' D' D ' 329' ' ' THR . . . . . 0.42 ' HA ' ' O ' ' B' ' 330' ' ' LEU . 40.3 p -154.24 166.79 32.05 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.316 -0.865 . . . . 0.22 108.951 179.895 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' D' D ' 330' ' ' LEU . . . . . . . . . . . . . 18.7 tp -149.78 125.96 10.69 Favored 'General case' 0 N--CA 1.488 1.443 0 O-C-N 121.029 -1.044 . . . . 0.28000000000000003 109.824 -179.502 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' D' D ' 331' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -87.48 112.48 22.24 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.203 -0.936 . . . . 0.93000000000000005 108.876 179.491 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' D' D ' 332' ' ' ILE . . . . . 0.542 HG21 ' HA ' ' D' ' 338' ' ' PHE . 47.2 mt -103.34 109.64 27.54 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.543 0 O-C-N 121.257 -0.902 . . . . 0.25 109.858 -179.68 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' D' D ' 333' ' ' ARG . . . . . 0.579 ' HG2' ' CE1' ' B' ' 327' ' ' TYR . 82.0 mtt180 -72.84 150.74 42.44 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.445 -0.784 . . . . 2.9300000000000002 109.358 179.838 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' D' D ' 334' ' ' GLY . . . . . . . . . . . . . . . 80.75 125.18 0.63 Allowed Glycine 0 N--CA 1.491 2.308 0 N-CA-C 109.373 -1.491 . . . . 0.40999999999999998 109.373 -179.833 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' D' D ' 335' ' ' ARG . . . . . . . . . . . . . 57.0 ttt180 -75.7 -33.65 60.35 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.366 -1.079 . . . . 3.0299999999999998 109.535 -179.978 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' D' D ' 336' ' ' GLU . . . . . . . . . . . . . 60.8 tt0 -58.29 -62.2 2.01 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.255 -0.903 . . . . 2.2599999999999998 109.77 -179.854 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' D' D ' 337' ' ' ARG . . . . . 0.695 ' CZ ' HD12 ' B' ' 348' ' ' LEU . 7.4 mmt180 -61.23 -32.85 72.64 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.247 -0.908 . . . . 2.9199999999999999 109.74 -179.771 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' D' D ' 338' ' ' PHE . . . . . 0.542 ' HA ' HG21 ' D' ' 332' ' ' ILE . 46.5 t80 -54.44 -57.64 10.54 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.289 -0.882 . . . . 0.37 109.72 -179.732 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' D' D ' 339' ' ' GLU . . . . . . . . . . . . . 41.2 mt-10 -50.99 -34.88 30.97 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.166 -0.959 . . . . 1.99 109.978 -179.666 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' D' D ' 340' ' ' MET . . . . . . . . . . . . . 46.7 ttp -63.84 -49.74 71.61 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.086 -1.009 . . . . 0.31 110.019 -179.496 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' D' D ' 341' ' ' PHE . . . . . 0.428 ' CZ ' ' HA ' ' B' ' 345' ' ' ASN . 44.7 m-85 -61.31 -46.6 89.61 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.126 -0.984 . . . . 0.17999999999999999 110.007 -179.674 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' D' D ' 342' ' ' ARG . . . . . . . . . . . . . 6.0 ttt180 -49.39 -42.58 42.76 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.168 -0.958 . . . . 2.4100000000000001 110.02 -179.625 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' D' D ' 343' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -58.65 -49.93 75.72 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.133 -0.979 . . . . 2.3500000000000001 109.844 -179.518 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' D' D ' 344' ' ' LEU . . . . . . . . . . . . . 60.2 mt -59.93 -30.89 69.36 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.175 -0.953 . . . . 0.19 109.504 -179.786 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' D' D ' 345' ' ' ASN . . . . . 0.512 HD22 HD11 ' B' ' 330' ' ' LEU . 64.3 t-20 -58.61 -59.29 5.63 Favored 'General case' 0 N--CA 1.488 1.455 0 O-C-N 121.204 -0.935 . . . . 1.0900000000000001 109.82 179.955 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' D' D ' 346' ' ' GLU . . . . . . . . . . . . . 1.2 tm-20 -61.31 -26.71 67.98 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.29 -0.881 . . . . 1.6899999999999999 109.981 -179.687 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' D' D ' 347' ' ' ALA . . . . . 0.562 ' HB1' ' HB1' ' C' ' 347' ' ' ALA . . . -60.29 -57.72 11.6 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.1 -1.0 . . . . 0.17999999999999999 110.111 -179.723 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' D' D ' 348' ' ' LEU . . . . . 0.599 HD22 ' N ' ' D' ' 348' ' ' LEU . 4.1 mm? -62.12 -44.68 96.1 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.152 -0.968 . . . . 0.31 110.092 -179.348 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' D' D ' 349' ' ' GLU . . . . . . . . . . . . . 10.2 mm-40 -58.22 -33.31 69.17 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.209 -0.932 . . . . 1.95 110.018 -179.436 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' D' D ' 350' ' ' LEU . . . . . 0.811 HD13 ' CD2' ' C' ' 350' ' ' LEU . 5.3 tt -64.44 -43.89 92.86 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.147 -0.971 . . . . 0.42999999999999999 109.716 -179.819 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' D' D ' 351' ' ' LYS . . . . . 0.433 ' O ' ' HB2' ' D' ' 354' ' ' GLN . 18.7 tttp -58.96 -44.72 91.54 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.371 -0.831 . . . . 1.3999999999999999 110.015 -179.601 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' D' D ' 352' ' ' ASP . . . . . . . . . . . . . 35.2 m-20 -58.46 -48.9 79.24 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.297 -0.877 . . . . 1.1699999999999999 110.307 -179.576 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' D' D ' 353' ' ' ALA . . . . . . . . . . . . . . . -66.43 -11.15 50.3 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.259 -0.901 . . . . 0.58999999999999997 109.784 -179.351 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' D' D ' 354' ' ' GLN . . . . . 0.546 ' HG3' HD23 ' D' ' 350' ' ' LEU . 5.1 mt-30 -83.36 -54.63 4.84 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.211 -0.93 . . . . 1.4399999999999999 109.484 179.829 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' D' D ' 355' ' ' ALA . . . . . . . . . . . . . . . -71.58 -3.58 22.23 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.288 -0.883 . . . . 0.97999999999999998 109.852 -179.869 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' D' D ' 356' ' ' GLY . . . . . . . . . . . . . . . -80.44 -8.81 87.19 Favored Glycine 0 N--CA 1.49 2.245 0 N-CA-C 109.708 -1.357 . . . . 1.28 109.708 -179.802 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' D' D ' 357' ' ' LYS . . . . . . . . . . . . . 21.6 mttt -90.3 103.03 15.76 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.28 -1.129 . . . . 4.0899999999999999 109.61 179.861 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' D' D ' 358' ' ' GLU . . . . . 0.569 ' N ' ' HD2' ' D' ' 359' ' ' PRO . 2.0 tt0 -49.76 -55.03 25.91 Favored Pre-proline 0 N--CA 1.489 1.513 0 O-C-N 121.188 -0.945 . . . . 5.71 109.681 179.979 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' D' D ' 359' ' ' PRO . . . . . 0.569 ' HD2' ' N ' ' D' ' 358' ' ' GLU . 2.3 Cg_endo -62.83 146.08 94.91 Favored 'Trans proline' 0 C--N 1.311 -1.436 0 C-N-CA 121.963 1.775 . . . . 4.9699999999999998 110.004 179.888 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' D' D ' 360' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.252 0 N-CA-C 109.426 -1.47 . . . . 6.9699999999999998 109.426 179.969 . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 319' ' ' LYS . . . . . . . . . . . . . 2.9 mmpp? . . . . . 0 N--CA 1.489 1.477 0 N-CA-C 109.467 -0.568 . . . . 7.5499999999999998 109.467 . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 320' ' ' LYS . . . . . 0.402 ' HG2' ' OD1' ' A' ' 324' ' ' ASP . 0.0 OUTLIER 61.23 157.5 0.04 OUTLIER 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.37 -0.831 . . . . 6.4299999999999997 109.381 -179.967 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 321' ' ' LYS . . . . . 0.618 ' CB ' ' HD3' ' A' ' 322' ' ' PRO . 0.1 OUTLIER -159.53 -65.5 0.02 OUTLIER Pre-proline 0 N--CA 1.49 1.538 0 O-C-N 121.154 -0.966 . . . . 6.1299999999999999 109.728 179.777 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 322' ' ' PRO . . . . . 0.618 ' HD3' ' CB ' ' A' ' 321' ' ' LYS . 4.1 Cg_exo -57.74 -160.18 0.02 OUTLIER 'Trans proline' 0 C--N 1.314 -1.255 0 C-N-CA 121.555 1.503 . . . . 2.8300000000000001 110.064 179.617 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 323' ' ' LEU . . . . . . . . . . . . . 37.4 mt -79.46 137.57 37.28 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.276 -0.89 . . . . 2.8300000000000001 109.264 179.86 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 324' ' ' ASP . . . . . 0.402 ' OD1' ' HG2' ' A' ' 320' ' ' LYS . 5.2 m-20 -78.85 -147.99 0.04 OUTLIER 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.252 -0.905 . . . . 1.53 109.203 -179.948 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 325' ' ' GLY . . . . . . . . . . . . . . . -68.33 177.51 24.91 Favored Glycine 0 N--CA 1.488 2.15 0 N-CA-C 109.267 -1.533 . . . . 0.60999999999999999 109.267 179.972 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 326' ' ' GLU . . . . . . . . . . . . . 2.9 mm-40 -57.34 -172.84 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.489 0 O-C-N 121.199 -1.177 . . . . 2.1299999999999999 109.016 -179.999 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 327' ' ' TYR . . . . . 0.577 ' CE1' ' HG2' ' C' ' 333' ' ' ARG . 48.1 m-85 -148.98 102.42 3.26 Favored 'General case' 0 N--CA 1.488 1.444 0 O-C-N 121.168 -0.958 . . . . 0.47999999999999998 109.395 179.985 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 328' ' ' PHE . . . . . . . . . . . . . 37.8 m-85 -106.87 -168.24 1.38 Allowed 'General case' 0 N--CA 1.489 1.479 0 O-C-N 121.406 -0.809 . . . . 0.31 109.282 -179.962 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 329' ' ' THR . . . . . . . . . . . . . 6.3 p -152.41 166.92 30.4 Favored 'General case' 0 N--CA 1.488 1.428 0 O-C-N 121.284 -0.885 . . . . 0.22 109.007 179.96 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 330' ' ' LEU . . . . . 0.497 HD11 HD22 ' C' ' 345' ' ' ASN . 16.9 tp -148.97 130.37 14.74 Favored 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.173 -0.954 . . . . 0.28000000000000003 109.767 -179.605 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 331' ' ' GLN . . . . . . . . . . . . . 19.1 tp60 -88.42 111.78 22.17 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.326 -0.859 . . . . 0.91000000000000003 109.53 179.785 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 332' ' ' ILE . . . . . 0.505 HG21 ' HA ' ' A' ' 338' ' ' PHE . 75.7 mt -103.96 111.41 33.51 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.702 0 O-C-N 121.121 -0.987 . . . . 0.26000000000000001 109.603 179.836 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 333' ' ' ARG . . . . . 0.534 ' HG2' ' CE1' ' C' ' 327' ' ' TYR . 67.5 mtt180 -73.94 151.27 40.41 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.289 -0.882 . . . . 2.9199999999999999 109.714 -179.983 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 334' ' ' GLY . . . . . . . . . . . . . . . 75.79 130.36 0.31 Allowed Glycine 0 N--CA 1.49 2.299 0 N-CA-C 109.545 -1.422 . . . . 0.40000000000000002 109.545 179.914 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 335' ' ' ARG . . . . . 0.446 ' HB2' ' CZ ' ' C' ' 328' ' ' PHE . 33.1 ttt180 -78.21 -31.65 49.51 Favored 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.216 -1.167 . . . . 3.0099999999999998 109.675 -179.819 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 336' ' ' GLU . . . . . . . . . . . . . 2.2 mt-10 -57.78 -62.01 2.11 Favored 'General case' 0 N--CA 1.493 1.675 0 O-C-N 121.19 -0.944 . . . . 2.29 109.776 -179.816 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 337' ' ' ARG . . . . . 0.421 ' HG2' HH11 ' A' ' 337' ' ' ARG . 1.9 mmt-85 -59.92 -32.05 70.42 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.238 -0.914 . . . . 2.9300000000000002 109.529 -179.922 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 338' ' ' PHE . . . . . 0.505 ' HA ' HG21 ' A' ' 332' ' ' ILE . 64.5 t80 -56.44 -57.65 11.4 Favored 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.262 -0.899 . . . . 0.38 109.818 -179.991 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 339' ' ' GLU . . . . . . . . . . . . . 48.2 mt-10 -51.77 -31.92 28.86 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.231 -0.918 . . . . 1.97 109.947 -179.841 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 340' ' ' MET . . . . . . . . . . . . . 37.9 ttp -63.9 -50.66 67.88 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.239 -0.913 . . . . 0.31 109.729 -179.601 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 341' ' ' PHE . . . . . . . . . . . . . 39.2 m-85 -62.66 -41.86 99.3 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.297 -0.877 . . . . 0.17999999999999999 109.949 -179.62 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 342' ' ' ARG . . . . . 0.538 ' HG2' ' NH1' ' A' ' 342' ' ' ARG . 0.1 OUTLIER -50.4 -42.43 53.63 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.093 -1.004 . . . . 2.4199999999999999 109.771 -179.818 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 343' ' ' GLU . . . . . . . . . . . . . 2.3 tp10 -57.65 -45.72 85.11 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.211 -0.931 . . . . 2.3500000000000001 109.705 -179.708 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 344' ' ' LEU . . . . . . . . . . . . . 32.3 mt -62.36 -33.4 74.66 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.108 -0.995 . . . . 0.17999999999999999 109.452 -179.973 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 345' ' ' ASN . . . . . . . . . . . . . 8.8 t-20 -56.72 -58.35 8.45 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.249 -0.907 . . . . 1.0900000000000001 109.848 -179.797 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 346' ' ' GLU . . . . . . . . . . . . . 3.2 tt0 -60.42 -28.75 68.51 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.212 -0.93 . . . . 1.6499999999999999 109.88 -179.539 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 347' ' ' ALA . . . . . 0.835 ' HB1' ' HB1' ' B' ' 347' ' ' ALA . . . -61.07 -59.84 4.72 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.122 -0.986 . . . . 0.17999999999999999 110.132 -179.996 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 348' ' ' LEU . . . . . 0.591 HD22 ' N ' ' A' ' 348' ' ' LEU . 4.0 mm? -61.8 -43.74 98.26 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.27 -0.894 . . . . 0.29999999999999999 110.058 -179.48 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 349' ' ' GLU . . . . . 0.42 ' OE2' ' NH1' ' C' ' 333' ' ' ARG . 1.8 mm-40 -56.7 -36.74 70.01 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.214 -0.929 . . . . 1.9399999999999999 109.753 -179.393 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 350' ' ' LEU . . . . . 0.915 HD22 HD13 ' B' ' 350' ' ' LEU . 5.0 tt -63.2 -42.96 99.39 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.17 -0.956 . . . . 0.46000000000000002 109.504 -179.738 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 351' ' ' LYS . . . . . . . . . . . . . 29.9 tttp -58.2 -35.55 71.8 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.142 -0.974 . . . . 1.3999999999999999 109.132 179.89 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 352' ' ' ASP . . . . . . . . . . . . . 98.4 m-20 -57.07 -40.62 77.24 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.35 -0.844 . . . . 1.1599999999999999 109.367 179.764 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 353' ' ' ALA . . . . . . . . . . . . . . . -67.74 -24.45 65.36 Favored 'General case' 0 N--CA 1.489 1.491 0 O-C-N 121.317 -0.865 . . . . 0.63 109.865 -179.838 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 354' ' ' GLN . . . . . . . . . . . . . 4.0 tt0 -81.02 -2.96 50.11 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.085 -1.009 . . . . 1.47 109.671 179.945 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 355' ' ' ALA . . . . . . . . . . . . . . . -69.3 -84.48 0.03 OUTLIER 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.186 -0.946 . . . . 1.01 109.432 -179.948 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 356' ' ' GLY . . . . . . . . . . . . . . . -61.17 99.06 0.19 Allowed Glycine 0 N--CA 1.491 2.343 0 N-CA-C 109.244 -1.542 . . . . 1.3 109.244 179.799 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 357' ' ' LYS . . . . . . . . . . . . . 6.4 mttm -86.46 157.36 19.82 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.342 -1.093 . . . . 4.0999999999999996 109.815 -179.641 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 358' ' ' GLU . . . . . 0.495 ' HB2' ' HD2' ' A' ' 359' ' ' PRO . 15.0 pt-20 -50.76 159.74 0.89 Allowed Pre-proline 0 N--CA 1.494 1.775 0 O-C-N 121.213 -0.93 . . . . 5.75 109.631 179.921 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 359' ' ' PRO . . . . . 0.495 ' HD2' ' HB2' ' A' ' 358' ' ' GLU . 1.9 Cg_endo -63.39 -79.99 0.01 OUTLIER 'Trans proline' 0 C--N 1.313 -1.328 0 C-N-CA 122.123 1.882 . . . . 5.0 109.992 179.762 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 360' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.36 0 CA-C-O 118.016 -1.436 . . . . 6.9699999999999998 109.715 -179.964 . . . . . . . . 0 0 . 1 . 017 nuclear build full ' B' B ' 319' ' ' LYS . . . . . . . . . . . . . 2.5 mmpp? . . . . . 0 N--CA 1.491 1.618 0 N-CA-C 109.075 -0.713 . . . . 7.5499999999999998 109.075 . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' B' B ' 320' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 61.37 157.27 0.04 OUTLIER 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.392 -0.818 . . . . 6.4400000000000004 109.483 -179.699 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 321' ' ' LYS . . . . . 0.617 ' CB ' ' HD3' ' B' ' 322' ' ' PRO . 0.1 OUTLIER -159.52 -65.75 0.02 OUTLIER Pre-proline 0 N--CA 1.489 1.503 0 O-C-N 121.263 -0.898 . . . . 6.1299999999999999 109.748 179.699 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' B' B ' 322' ' ' PRO . . . . . 0.617 ' HD3' ' CB ' ' B' ' 321' ' ' LYS . 3.7 Cg_exo -57.52 -159.45 0.01 OUTLIER 'Trans proline' 0 C--N 1.315 -1.209 0 C-N-CA 121.714 1.609 . . . . 2.8199999999999998 110.168 179.668 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 323' ' ' LEU . . . . . . . . . . . . . 37.4 mt -80.23 137.7 36.7 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.242 -0.911 . . . . 2.8399999999999999 109.128 179.846 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 324' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 -79.12 -148.69 0.05 OUTLIER 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.226 -0.921 . . . . 1.53 109.358 -179.871 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 325' ' ' GLY . . . . . . . . . . . . . . . -67.16 177.71 19.23 Favored Glycine 0 N--CA 1.49 2.282 0 N-CA-C 109.22 -1.552 . . . . 0.58999999999999997 109.22 179.879 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 326' ' ' GLU . . . . . . . . . . . . . 3.1 mm-40 -57.65 -172.81 0.01 OUTLIER 'General case' 0 N--CA 1.488 1.452 0 O-C-N 121.162 -1.199 . . . . 2.1299999999999999 109.125 179.771 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 327' ' ' TYR . . . . . 0.556 ' CE1' ' HG2' ' D' ' 333' ' ' ARG . 48.8 m-85 -148.84 103.51 3.37 Favored 'General case' 0 N--CA 1.488 1.463 0 O-C-N 121.28 -0.887 . . . . 0.47999999999999998 109.247 179.782 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 328' ' ' PHE . . . . . . . . . . . . . 38.4 m-85 -108.27 -168.79 1.41 Allowed 'General case' 0 N--CA 1.488 1.473 0 O-C-N 121.249 -0.907 . . . . 0.32000000000000001 109.149 -179.998 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 329' ' ' THR . . . . . . . . . . . . . 6.7 p -151.8 167.13 29.24 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.213 -0.929 . . . . 0.23000000000000001 109.27 179.985 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 330' ' ' LEU . . . . . . . . . . . . . 16.9 tp -149.08 130.65 14.89 Favored 'General case' 0 N--CA 1.488 1.437 0 O-C-N 121.15 -0.969 . . . . 0.28000000000000003 109.74 -179.648 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 331' ' ' GLN . . . . . . . . . . . . . 19.6 tp60 -88.88 111.71 22.39 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.45 -0.781 . . . . 0.91000000000000003 109.409 179.951 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 332' ' ' ILE . . . . . 0.503 HG21 ' HA ' ' B' ' 338' ' ' PHE . 75.5 mt -103.93 111.19 32.61 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.603 0 O-C-N 121.151 -0.968 . . . . 0.23999999999999999 109.637 179.91 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 333' ' ' ARG . . . . . 0.55 ' HG2' ' CE1' ' D' ' 327' ' ' TYR . 67.5 mtt180 -73.71 151.47 40.7 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.187 -0.946 . . . . 2.9300000000000002 109.648 -179.984 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 334' ' ' GLY . . . . . . . . . . . . . . . 75.79 130.17 0.3 Allowed Glycine 0 N--CA 1.491 2.316 0 N-CA-C 109.772 -1.331 . . . . 0.40000000000000002 109.772 179.827 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 335' ' ' ARG . . . . . . . . . . . . . 34.8 ttt180 -78.12 -31.32 49.85 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.291 -1.123 . . . . 3.0099999999999998 109.808 -179.924 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 336' ' ' GLU . . . . . . . . . . . . . 2.1 mt-10 -58.28 -61.71 2.37 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.058 -1.026 . . . . 2.2799999999999998 109.789 -179.736 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 337' ' ' ARG . . . . . 0.427 ' HG2' HH11 ' B' ' 337' ' ' ARG . 1.6 mmt-85 -60.2 -31.69 70.39 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.174 -0.953 . . . . 2.9300000000000002 109.601 -179.864 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 338' ' ' PHE . . . . . 0.503 ' HA ' HG21 ' B' ' 332' ' ' ILE . 64.9 t80 -56.32 -58.5 7.74 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.147 -0.97 . . . . 0.37 109.712 179.837 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 339' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -51.04 -32.07 20.55 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.172 -0.955 . . . . 1.98 109.893 -179.867 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 340' ' ' MET . . . . . . . . . . . . . 39.4 ttp -63.41 -50.95 67.83 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.095 -1.003 . . . . 0.32000000000000001 109.795 -179.743 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 341' ' ' PHE . . . . . . . . . . . . . 40.1 m-85 -62.5 -41.84 99.09 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.253 -0.904 . . . . 0.17999999999999999 109.99 -179.589 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 342' ' ' ARG . . . . . 0.547 ' NH1' ' HG2' ' B' ' 342' ' ' ARG . 0.1 OUTLIER -50.63 -41.86 55.56 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.153 -0.967 . . . . 2.4199999999999999 109.902 -179.662 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' B' B ' 343' ' ' GLU . . . . . . . . . . . . . 2.3 tp10 -58.38 -46.22 86.79 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.162 -0.961 . . . . 2.3500000000000001 109.565 -179.707 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 344' ' ' LEU . . . . . . . . . . . . . 34.5 mt -61.51 -33.79 74.4 Favored 'General case' 0 N--CA 1.489 1.477 0 O-C-N 121.277 -0.889 . . . . 0.17999999999999999 109.421 179.937 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 345' ' ' ASN . . . . . . . . . . . . . 9.0 t-20 -56.86 -57.5 12.23 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.235 -0.915 . . . . 1.0900000000000001 110.066 -179.669 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 346' ' ' GLU . . . . . . . . . . . . . 3.2 tt0 -61.12 -28.41 69.08 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.263 -0.898 . . . . 1.6599999999999999 109.697 -179.569 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 347' ' ' ALA . . . . . 0.835 ' HB1' ' HB1' ' A' ' 347' ' ' ALA . . . -61.28 -59.94 4.52 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.189 -0.945 . . . . 0.17000000000000001 110.047 -179.785 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 348' ' ' LEU . . . . . 0.593 HD22 ' N ' ' B' ' 348' ' ' LEU . 4.0 mm? -61.71 -43.74 98.28 Favored 'General case' 0 N--CA 1.494 1.743 0 O-C-N 121.356 -0.84 . . . . 0.28999999999999998 109.994 -179.49 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 349' ' ' GLU . . . . . . . . . . . . . 1.8 mm-40 -56.75 -36.61 69.96 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.24 -0.912 . . . . 1.95 109.958 -179.419 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 350' ' ' LEU . . . . . 0.915 HD13 HD22 ' A' ' 350' ' ' LEU . 5.0 tt -63.42 -42.88 98.72 Favored 'General case' 0 N--CA 1.489 1.484 0 O-C-N 121.108 -0.995 . . . . 0.45000000000000001 109.428 -179.777 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 351' ' ' LYS . . . . . . . . . . . . . 30.4 tttp -57.96 -35.92 71.83 Favored 'General case' 0 N--CA 1.489 1.481 0 O-C-N 121.07 -1.019 . . . . 1.3799999999999999 109.135 179.832 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 352' ' ' ASP . . . . . . . . . . . . . 98.4 m-20 -57.05 -40.49 76.89 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.351 -0.843 . . . . 1.1599999999999999 109.403 179.8 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 353' ' ' ALA . . . . . . . . . . . . . . . -67.71 -24.54 65.4 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.308 -0.87 . . . . 0.60999999999999999 109.71 -179.763 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 354' ' ' GLN . . . . . . . . . . . . . 10.6 tt0 -81.02 -3.04 50.42 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.222 -0.924 . . . . 1.45 109.704 -179.875 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 355' ' ' ALA . . . . . 0.401 ' O ' ' HG3' ' B' ' 357' ' ' LYS . . . -69.06 -85.04 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.241 -0.912 . . . . 0.97999999999999998 109.314 179.97 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 356' ' ' GLY . . . . . . . . . . . . . . . -60.46 99.05 0.16 Allowed Glycine 0 N--CA 1.492 2.391 0 N-CA-C 109.495 -1.442 . . . . 1.29 109.495 179.919 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 357' ' ' LYS . . . . . 0.401 ' HG3' ' O ' ' B' ' 355' ' ' ALA . 5.6 mttm -86.67 156.9 19.8 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.25 -1.147 . . . . 4.0899999999999999 109.848 -179.766 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 358' ' ' GLU . . . . . 0.508 ' HB2' ' HD2' ' B' ' 359' ' ' PRO . 15.6 pt-20 -50.28 159.7 0.8 Allowed Pre-proline 0 N--CA 1.49 1.526 0 O-C-N 121.316 -0.865 . . . . 5.7199999999999998 109.527 179.862 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 359' ' ' PRO . . . . . 0.508 ' HD2' ' HB2' ' B' ' 358' ' ' GLU . 1.9 Cg_endo -63.3 -80.98 0.01 OUTLIER 'Trans proline' 0 C--N 1.309 -1.518 0 C-N-CA 122.241 1.961 . . . . 4.9800000000000004 109.973 179.568 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 360' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.207 0 N-CA-C 109.309 -1.517 . . . . 6.9800000000000004 109.309 179.973 . . . . . . . . 0 0 . 1 . 017 nuclear build full ' C' C ' 319' ' ' LYS . . . . . . . . . . . . . 13.2 mmtt . . . . . 0 N--CA 1.49 1.528 0 CA-C-O 121.232 0.539 . . . . 6.8200000000000003 109.604 . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' C' C ' 320' ' ' LYS . . . . . . . . . . . . . 5.4 mttt 65.26 12.65 8.21 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.313 -0.867 . . . . 6.4900000000000002 109.651 179.878 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' C' C ' 321' ' ' LYS . . . . . 0.53 ' CB ' ' HD2' ' C' ' 322' ' ' PRO . 0.0 OUTLIER -80.12 173.91 6.97 Favored Pre-proline 0 N--CA 1.49 1.57 0 O-C-N 121.314 -0.866 . . . . 6.4000000000000004 109.109 179.913 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' C' C ' 322' ' ' PRO . . . . . 0.53 ' HD2' ' CB ' ' C' ' 321' ' ' LYS . 4.6 Cg_exo -56.99 -152.98 0.0 OUTLIER 'Trans proline' 0 C--N 1.309 -1.516 0 C-N-CA 121.983 1.789 . . . . 3.4199999999999999 110.128 -179.823 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' C' C ' 323' ' ' LEU . . . . . . . . . . . . . 61.0 mt -79.16 123.69 27.63 Favored 'General case' 0 N--CA 1.489 1.525 0 O-C-N 121.217 -0.927 . . . . 3.9500000000000002 109.4 -179.961 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' C' C ' 324' ' ' ASP . . . . . . . . . . . . . 11.3 m-20 -79.32 -133.41 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.327 -0.858 . . . . 1.6299999999999999 109.329 -179.8 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' C' C ' 325' ' ' GLY . . . . . . . . . . . . . . . -65.99 -174.25 5.28 Favored Glycine 0 N--CA 1.49 2.275 0 N-CA-C 109.273 -1.531 . . . . 0.72999999999999998 109.273 -179.958 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' C' C ' 326' ' ' GLU . . . . . 0.42 ' HB3' ' CE1' ' C' ' 328' ' ' PHE . 6.8 mm-40 -58.0 -179.0 0.05 OUTLIER 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.142 -1.21 . . . . 2.1699999999999999 109.561 -179.788 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' C' C ' 327' ' ' TYR . . . . . 0.534 ' CE1' ' HG2' ' A' ' 333' ' ' ARG . 46.1 m-85 -148.61 107.79 3.91 Favored 'General case' 0 N--CA 1.488 1.443 0 O-C-N 121.327 -0.858 . . . . 0.47999999999999998 109.267 -179.982 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' C' C ' 328' ' ' PHE . . . . . 0.446 ' CZ ' ' HB2' ' A' ' 335' ' ' ARG . 14.4 m-85 -113.66 -167.84 1.26 Allowed 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.345 -0.847 . . . . 0.33000000000000002 109.433 179.914 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' C' C ' 329' ' ' THR . . . . . . . . . . . . . 29.5 p -151.46 169.54 21.78 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.341 -0.849 . . . . 0.23000000000000001 109.282 -180.0 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' C' C ' 330' ' ' LEU . . . . . . . . . . . . . 28.3 tp -150.62 123.32 8.59 Favored 'General case' 0 C--N 1.304 -1.398 0 O-C-N 121.264 -0.898 . . . . 0.28000000000000003 109.509 -179.787 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' C' C ' 331' ' ' GLN . . . . . . . . . . . . . 1.2 tt0 -86.71 115.56 24.23 Favored 'General case' 0 N--CA 1.489 1.48 0 O-C-N 121.317 -0.865 . . . . 1.48 108.974 179.599 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' C' C ' 332' ' ' ILE . . . . . 0.709 HG21 ' HA ' ' C' ' 338' ' ' PHE . 84.2 mt -103.2 111.78 34.24 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.511 0 O-C-N 121.178 -0.951 . . . . 0.23999999999999999 109.62 -179.552 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' C' C ' 333' ' ' ARG . . . . . 0.577 ' HG2' ' CE1' ' A' ' 327' ' ' TYR . 5.6 mtp180 -73.35 144.38 46.51 Favored 'General case' 0 N--CA 1.487 1.422 0 O-C-N 121.274 -0.891 . . . . 2.7400000000000002 109.443 179.8 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' C' C ' 334' ' ' GLY . . . . . . . . . . . . . . . 75.99 123.76 0.17 Allowed Glycine 0 N--CA 1.49 2.293 0 N-CA-C 109.572 -1.411 . . . . 0.34999999999999998 109.572 179.864 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' C' C ' 335' ' ' ARG . . . . . 0.511 ' NH1' ' HG2' ' C' ' 335' ' ' ARG . 0.7 OUTLIER -70.59 -24.89 62.84 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.296 -1.12 . . . . 2.5299999999999998 109.858 -179.728 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' C' C ' 336' ' ' GLU . . . . . . . . . . . . . 18.4 mt-10 -56.25 -67.8 0.27 Allowed 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.169 -0.957 . . . . 2.6200000000000001 109.737 -179.553 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' C' C ' 337' ' ' ARG . . . . . 0.479 ' HD2' ' N ' ' C' ' 337' ' ' ARG . 11.4 mpt_? -60.11 -30.22 69.12 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.245 -0.91 . . . . 2.8100000000000001 109.774 -179.823 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' C' C ' 338' ' ' PHE . . . . . 0.709 ' HA ' HG21 ' C' ' 332' ' ' ILE . 57.8 t80 -54.67 -59.75 4.29 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.325 -0.859 . . . . 0.40000000000000002 109.984 -179.634 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' C' C ' 339' ' ' GLU . . . . . . . . . . . . . 14.8 mt-10 -51.14 -34.47 31.24 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.256 -0.903 . . . . 2.0499999999999998 110.306 -179.567 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' C' C ' 340' ' ' MET . . . . . . . . . . . . . 53.8 ttp -63.62 -50.45 69.32 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.089 -1.007 . . . . 0.32000000000000001 109.956 -179.611 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' C' C ' 341' ' ' PHE . . . . . . . . . . . . . 65.2 m-85 -61.56 -45.41 94.26 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.243 -0.911 . . . . 0.17999999999999999 109.948 -179.593 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' C' C ' 342' ' ' ARG . . . . . . . . . . . . . 1.9 tmt_? -48.98 -42.69 38.61 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.282 -0.886 . . . . 2.9100000000000001 110.025 -179.59 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' C' C ' 343' ' ' GLU . . . . . . . . . . . . . 28.8 tt0 -59.61 -47.04 87.13 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.153 -0.967 . . . . 2.1400000000000001 110.24 -179.373 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' C' C ' 344' ' ' LEU . . . . . 0.401 HD22 HD22 ' D' ' 344' ' ' LEU . 73.4 mt -61.78 -34.58 76.14 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.142 -0.974 . . . . 0.22 110.218 -179.44 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' C' C ' 345' ' ' ASN . . . . . 0.497 HD22 HD11 ' A' ' 330' ' ' LEU . 39.1 t30 -57.64 -55.66 31.91 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.094 -1.004 . . . . 1.0800000000000001 109.944 -179.526 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' C' C ' 346' ' ' GLU . . . . . 0.486 ' O ' ' HB2' ' C' ' 350' ' ' LEU . 3.5 tt0 -59.94 -27.34 66.69 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.164 -0.96 . . . . 2.21 109.638 -179.635 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' C' C ' 347' ' ' ALA . . . . . 0.979 ' HB1' ' HB1' ' D' ' 347' ' ' ALA . . . -62.76 -58.06 8.77 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.169 -0.957 . . . . 0.17999999999999999 110.076 -179.917 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' C' C ' 348' ' ' LEU . . . . . 0.582 ' N ' HD22 ' C' ' 348' ' ' LEU . 4.2 mm? -62.52 -50.25 72.13 Favored 'General case' 0 N--CA 1.494 1.739 0 O-C-N 121.276 -0.89 . . . . 0.32000000000000001 110.42 -179.289 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' C' C ' 349' ' ' GLU . . . . . . . . . . . . . 67.5 mm-40 -57.18 -33.42 67.44 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.124 -0.985 . . . . 2.1899999999999999 109.831 -179.242 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' C' C ' 350' ' ' LEU . . . . . 0.795 HD22 HD13 ' D' ' 350' ' ' LEU . 5.4 tt -62.81 -40.22 96.71 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.236 -0.915 . . . . 0.46000000000000002 109.383 -179.902 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' C' C ' 351' ' ' LYS . . . . . 0.4 ' HE3' ' OE1' ' D' ' 346' ' ' GLU . 1.5 tttm -62.13 -47.77 83.08 Favored 'General case' 0 N--CA 1.488 1.455 0 O-C-N 121.207 -0.933 . . . . 1.3500000000000001 110.169 -179.801 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' C' C ' 352' ' ' ASP . . . . . . . . . . . . . 77.5 m-20 -51.35 -27.18 9.06 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.199 -0.938 . . . . 1.1899999999999999 109.247 -179.6 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' C' C ' 353' ' ' ALA . . . . . . . . . . . . . . . -67.65 -42.95 81.42 Favored 'General case' 0 N--CA 1.488 1.469 0 O-C-N 121.323 -0.861 . . . . 0.56999999999999995 109.312 179.742 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' C' C ' 354' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -80.54 1.32 30.04 Favored 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.355 -0.841 . . . . 1.47 109.667 -179.978 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' C' C ' 355' ' ' ALA . . . . . . . . . . . . . . . -67.89 -83.66 0.03 OUTLIER 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.138 -0.976 . . . . 0.93000000000000005 109.096 179.842 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' C' C ' 356' ' ' GLY . . . . . . . . . . . . . . . -66.79 95.37 0.27 Allowed Glycine 0 N--CA 1.489 2.183 0 N-CA-C 109.138 -1.585 . . . . 1.3300000000000001 109.138 179.67 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' C' C ' 357' ' ' LYS . . . . . . . . . . . . . 2.1 ttpt -86.72 100.84 12.77 Favored 'General case' 0 N--CA 1.488 1.444 0 O-C-N 121.234 -1.157 . . . . 4.0099999999999998 109.495 -179.781 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' C' C ' 358' ' ' GLU . . . . . 0.572 ' N ' ' HD2' ' C' ' 359' ' ' PRO . 2.5 mm-40 -50.65 -55.6 25.37 Favored Pre-proline 0 N--CA 1.489 1.495 0 O-C-N 121.274 -0.891 . . . . 5.75 110.051 -179.907 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' C' C ' 359' ' ' PRO . . . . . 0.572 ' HD2' ' N ' ' C' ' 358' ' ' GLU . 2.2 Cg_endo -61.77 109.95 0.87 Allowed 'Trans proline' 0 C--N 1.311 -1.405 0 C-N-CA 121.98 1.786 . . . . 4.9400000000000004 110.3 -179.822 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' C' C ' 360' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.304 0 CA-C-O 118.0 -1.445 . . . . 6.5 109.531 179.856 . . . . . . . . 0 0 . 1 . 017 nuclear build full ' D' D ' 319' ' ' LYS . . . . . . . . . . . . . 2.5 mmpp? . . . . . 0 N--CA 1.49 1.562 0 N-CA-C 109.11 -0.7 . . . . 7.5300000000000002 109.11 . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' D' D ' 320' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 61.8 157.2 0.05 OUTLIER 'General case' 0 N--CA 1.489 1.478 0 O-C-N 121.303 -0.873 . . . . 6.4100000000000001 109.529 -179.805 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' D' D ' 321' ' ' LYS . . . . . 0.619 ' CB ' ' HD3' ' D' ' 322' ' ' PRO . 0.1 OUTLIER -159.61 -65.61 0.02 OUTLIER Pre-proline 0 N--CA 1.492 1.642 0 O-C-N 121.25 -0.906 . . . . 6.1100000000000003 109.686 179.666 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' D' D ' 322' ' ' PRO . . . . . 0.619 ' HD3' ' CB ' ' D' ' 321' ' ' LYS . 3.5 Cg_exo -57.82 -159.27 0.02 OUTLIER 'Trans proline' 0 C--N 1.315 -1.237 0 C-N-CA 121.539 1.492 . . . . 2.8199999999999998 110.109 179.859 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' D' D ' 323' ' ' LEU . . . . . . . . . . . . . 42.0 mt -80.35 137.56 36.58 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.25 -0.906 . . . . 2.8300000000000001 109.133 179.9 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' D' D ' 324' ' ' ASP . . . . . . . . . . . . . 3.8 m-20 -79.13 -148.52 0.04 OUTLIER 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.221 -0.925 . . . . 1.54 109.398 -179.827 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' D' D ' 325' ' ' GLY . . . . . . . . . . . . . . . -67.56 177.72 20.95 Favored Glycine 0 N--CA 1.49 2.262 0 N-CA-C 109.241 -1.543 . . . . 0.58999999999999997 109.241 -179.887 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' D' D ' 326' ' ' GLU . . . . . . . . . . . . . 3.2 mm-40 -57.57 -173.02 0.01 OUTLIER 'General case' 0 N--CA 1.488 1.473 0 O-C-N 121.223 -1.163 . . . . 2.1299999999999999 109.028 179.886 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' D' D ' 327' ' ' TYR . . . . . 0.55 ' CE1' ' HG2' ' B' ' 333' ' ' ARG . 47.2 m-85 -149.03 103.05 3.31 Favored 'General case' 0 N--CA 1.488 1.442 0 O-C-N 121.219 -0.926 . . . . 0.46999999999999997 109.357 179.815 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' D' D ' 328' ' ' PHE . . . . . . . . . . . . . 39.5 m-85 -107.61 -168.5 1.39 Allowed 'General case' 0 N--CA 1.489 1.477 0 O-C-N 121.286 -0.884 . . . . 0.29999999999999999 109.248 -179.953 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' D' D ' 329' ' ' THR . . . . . . . . . . . . . 7.1 p -152.04 166.97 29.95 Favored 'General case' 0 N--CA 1.488 1.457 0 O-C-N 121.259 -0.9 . . . . 0.22 109.144 179.942 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' D' D ' 330' ' ' LEU . . . . . . . . . . . . . 18.0 tp -148.9 130.75 15.16 Favored 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.184 -0.948 . . . . 0.28000000000000003 109.778 -179.605 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' D' D ' 331' ' ' GLN . . . . . . . . . . . . . 19.3 tp60 -89.06 111.18 21.86 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.509 -0.744 . . . . 0.93000000000000005 109.545 179.814 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' D' D ' 332' ' ' ILE . . . . . 0.51 HG21 ' HA ' ' D' ' 338' ' ' PHE . 74.0 mt -103.49 111.77 34.45 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.568 0 O-C-N 121.073 -1.017 . . . . 0.25 109.579 179.921 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' D' D ' 333' ' ' ARG . . . . . 0.556 ' HG2' ' CE1' ' B' ' 327' ' ' TYR . 68.2 mtt180 -74.07 151.56 40.14 Favored 'General case' 0 N--CA 1.488 1.451 0 O-C-N 121.221 -0.924 . . . . 2.9300000000000002 109.7 179.901 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' D' D ' 334' ' ' GLY . . . . . . . . . . . . . . . 76.03 130.8 0.35 Allowed Glycine 0 N--CA 1.491 2.338 0 N-CA-C 109.663 -1.375 . . . . 0.40999999999999998 109.663 179.798 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' D' D ' 335' ' ' ARG . . . . . . . . . . . . . 35.9 ttt180 -78.61 -31.99 47.31 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.309 -1.113 . . . . 3.0299999999999998 109.715 -179.934 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' D' D ' 336' ' ' GLU . . . . . . . . . . . . . 2.1 mt-10 -57.44 -61.86 2.19 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.173 -0.954 . . . . 2.2599999999999998 109.832 -179.732 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' D' D ' 337' ' ' ARG . . . . . 0.408 HH11 ' HG2' ' D' ' 337' ' ' ARG . 1.5 mmt-85 -60.3 -31.74 70.55 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.172 -0.955 . . . . 2.9199999999999999 109.593 -179.831 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' D' D ' 338' ' ' PHE . . . . . 0.51 ' HA ' HG21 ' D' ' 332' ' ' ILE . 63.6 t80 -56.24 -58.19 9.01 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.347 -0.845 . . . . 0.37 109.739 179.898 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' D' D ' 339' ' ' GLU . . . . . . . . . . . . . 43.1 mt-10 -51.59 -31.67 25.72 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.257 -0.902 . . . . 1.99 109.901 -179.767 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' D' D ' 340' ' ' MET . . . . . . . . . . . . . 39.8 ttp -63.8 -50.68 68.02 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.244 -0.91 . . . . 0.31 109.768 -179.695 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' D' D ' 341' ' ' PHE . . . . . . . . . . . . . 40.3 m-85 -62.55 -41.92 99.2 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.234 -0.916 . . . . 0.17999999999999999 110.086 -179.725 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' D' D ' 342' ' ' ARG . . . . . 0.558 ' NH1' ' HG2' ' D' ' 342' ' ' ARG . 0.2 OUTLIER -50.33 -42.56 53.03 Favored 'General case' 0 N--CA 1.492 1.675 0 O-C-N 121.125 -0.984 . . . . 2.4100000000000001 109.843 -179.598 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' D' D ' 343' ' ' GLU . . . . . . . . . . . . . 2.2 tp10 -57.92 -45.65 86.2 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.239 -0.913 . . . . 2.3500000000000001 109.652 -179.686 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' D' D ' 344' ' ' LEU . . . . . 0.401 HD22 HD22 ' C' ' 344' ' ' LEU . 36.0 mt -62.04 -34.13 75.66 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.223 -0.923 . . . . 0.19 109.398 -179.956 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' D' D ' 345' ' ' ASN . . . . . . . . . . . . . 9.2 t-20 -56.54 -58.13 9.35 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.277 -0.889 . . . . 1.0900000000000001 109.95 -179.876 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' D' D ' 346' ' ' GLU . . . . . 0.4 ' OE1' ' HE3' ' C' ' 351' ' ' LYS . 3.1 tt0 -60.19 -28.95 68.38 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.269 -0.894 . . . . 1.6899999999999999 109.704 -179.484 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' D' D ' 347' ' ' ALA . . . . . 0.979 ' HB1' ' HB1' ' C' ' 347' ' ' ALA . . . -61.1 -59.77 4.82 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.228 -0.92 . . . . 0.17999999999999999 110.108 -179.766 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' D' D ' 348' ' ' LEU . . . . . 0.595 HD22 ' N ' ' D' ' 348' ' ' LEU . 4.0 mm? -61.71 -44.28 97.24 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.138 -0.976 . . . . 0.31 109.959 -179.39 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' D' D ' 349' ' ' GLU . . . . . . . . . . . . . 1.8 mm-40 -56.14 -36.69 68.55 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.175 -0.953 . . . . 1.95 109.892 -179.381 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' D' D ' 350' ' ' LEU . . . . . 0.795 HD13 HD22 ' C' ' 350' ' ' LEU . 5.1 tt -63.34 -42.48 98.94 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.169 -0.957 . . . . 0.42999999999999999 109.467 -179.716 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' D' D ' 351' ' ' LYS . . . . . . . . . . . . . 30.9 tttp -58.63 -35.79 73.05 Favored 'General case' 0 N--CA 1.489 1.486 0 O-C-N 121.135 -0.978 . . . . 1.3999999999999999 109.076 179.884 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' D' D ' 352' ' ' ASP . . . . . . . . . . . . . 98.6 m-20 -56.82 -40.45 76.03 Favored 'General case' 0 N--CA 1.488 1.47 0 O-C-N 121.345 -0.847 . . . . 1.1699999999999999 109.479 179.729 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' D' D ' 353' ' ' ALA . . . . . . . . . . . . . . . -68.03 -24.54 65.11 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.334 -0.854 . . . . 0.58999999999999997 109.737 -179.756 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' D' D ' 354' ' ' GLN . . . . . . . . . . . . . 10.4 tt0 -80.95 -3.33 51.17 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.205 -0.934 . . . . 1.4399999999999999 109.544 -179.914 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' D' D ' 355' ' ' ALA . . . . . . . . . . . . . . . -68.85 -84.9 0.02 OUTLIER 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.192 -0.942 . . . . 0.97999999999999998 109.482 -179.994 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' D' D ' 356' ' ' GLY . . . . . . . . . . . . . . . -60.56 99.02 0.16 Allowed Glycine 0 N--CA 1.491 2.324 0 N-CA-C 109.292 -1.523 . . . . 1.28 109.292 -179.998 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' D' D ' 357' ' ' LYS . . . . . . . . . . . . . 4.6 mttm -87.22 156.45 19.66 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.2 -1.176 . . . . 4.0899999999999999 109.908 -179.747 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' D' D ' 358' ' ' GLU . . . . . 0.49 ' HB2' ' HD2' ' D' ' 359' ' ' PRO . 16.1 pt-20 -49.6 159.39 0.7 Allowed Pre-proline 0 N--CA 1.489 1.498 0 O-C-N 121.565 -0.71 . . . . 5.71 109.781 -179.975 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' D' D ' 359' ' ' PRO . . . . . 0.49 ' HD2' ' HB2' ' D' ' 358' ' ' GLU . 1.6 Cg_endo -63.76 -80.54 0.01 OUTLIER 'Trans proline' 0 C--N 1.309 -1.546 0 C-N-CA 122.223 1.949 . . . . 4.9699999999999998 109.846 179.705 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' D' D ' 360' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.305 0 CA-C-O 118.024 -1.431 . . . . 6.9699999999999998 109.691 179.928 . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 319' ' ' LYS . . . . . . . . . . . . . 1.4 mtmt . . . . . 0 N--CA 1.49 1.537 0 N-CA-C 109.414 -0.588 . . . . 7.5499999999999998 109.414 . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 320' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 63.01 -140.0 0.38 Allowed 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.153 -0.967 . . . . 6.4299999999999997 109.58 179.884 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 321' ' ' LYS . . . . . . . . . . . . . 2.2 ttmt -155.47 103.68 2.19 Favored Pre-proline 0 N--CA 1.49 1.565 0 O-C-N 121.001 -1.062 . . . . 6.1299999999999999 109.41 -179.79 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 322' ' ' PRO . . . . . . . . . . . . . 2.9 Cg_endo -69.18 5.93 1.3 Allowed 'Trans proline' 0 C--N 1.313 -1.318 0 C-N-CA 122.425 2.083 . . . . 2.8300000000000001 111.494 -179.905 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 323' ' ' LEU . . . . . . . . . . . . . 11.3 mt -83.5 58.55 4.61 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 120.802 -1.186 . . . . 2.8300000000000001 110.011 -179.682 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 324' ' ' ASP . . . . . . . . . . . . . 26.4 m-20 -80.83 165.5 21.8 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.061 -1.024 . . . . 1.53 109.365 179.648 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 325' ' ' GLY . . . . . . . . . . . . . . . -68.44 -179.7 19.0 Favored Glycine 0 N--CA 1.49 2.277 0 N-CA-C 109.349 -1.5 . . . . 0.60999999999999999 109.349 179.924 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 326' ' ' GLU . . . . . . . . . . . . . 1.8 mm-40 -57.3 -173.19 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.219 -1.166 . . . . 2.1299999999999999 109.241 179.969 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 327' ' ' TYR . . . . . 0.589 ' CE1' ' HG2' ' C' ' 333' ' ' ARG . 46.6 m-85 -149.14 105.31 3.5 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.129 -0.982 . . . . 0.47999999999999998 109.767 -179.769 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 328' ' ' PHE . . . . . 0.552 ' CZ ' ' HD3' ' C' ' 335' ' ' ARG . 97.3 m-85 -112.28 -163.71 0.87 Allowed 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.388 -0.82 . . . . 0.31 109.407 179.801 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 329' ' ' THR . . . . . 0.449 ' HA ' ' O ' ' C' ' 330' ' ' LEU . 74.4 p -154.58 166.34 33.65 Favored 'General case' 0 N--CA 1.489 1.487 0 O-C-N 121.278 -0.889 . . . . 0.22 109.032 179.812 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 330' ' ' LEU . . . . . 0.421 ' O ' ' HA ' ' C' ' 329' ' ' THR . 32.9 tp -151.06 131.96 14.18 Favored 'General case' 0 N--CA 1.488 1.449 0 O-C-N 121.119 -0.988 . . . . 0.28000000000000003 109.886 -179.775 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 331' ' ' GLN . . . . . . . . . . . . . 19.4 tp60 -86.87 114.84 23.85 Favored 'General case' 0 N--CA 1.488 1.449 0 O-C-N 121.318 -0.864 . . . . 0.91000000000000003 109.121 179.688 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 332' ' ' ILE . . . . . 0.554 HG21 ' HA ' ' A' ' 338' ' ' PHE . 52.1 mt -103.26 107.22 21.66 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.572 0 O-C-N 121.215 -0.928 . . . . 0.26000000000000001 109.659 -179.797 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 333' ' ' ARG . . . . . 0.532 ' HG2' ' CE1' ' C' ' 327' ' ' TYR . 9.9 mtp180 -72.49 140.04 48.0 Favored 'General case' 0 N--CA 1.488 1.447 0 O-C-N 121.252 -0.905 . . . . 2.9199999999999999 109.45 179.897 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 334' ' ' GLY . . . . . . . . . . . . . . . 88.88 127.53 2.98 Favored Glycine 0 N--CA 1.49 2.297 0 N-CA-C 109.723 -1.351 . . . . 0.40000000000000002 109.723 -179.991 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 335' ' ' ARG . . . . . 0.484 ' HB2' ' OE1' ' C' ' 326' ' ' GLU . 8.0 ttt180 -78.33 -34.62 48.48 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.265 -1.138 . . . . 3.0099999999999998 109.636 179.956 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 336' ' ' GLU . . . . . . . . . . . . . 9.3 tt0 -57.89 -62.33 1.89 Allowed 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.166 -0.959 . . . . 2.29 109.714 -179.862 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 337' ' ' ARG . . . . . 0.512 ' NH1' ' HG2' ' A' ' 337' ' ' ARG . 0.0 OUTLIER -60.97 -27.39 68.23 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.202 -0.936 . . . . 2.9300000000000002 109.717 -179.746 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 338' ' ' PHE . . . . . 0.554 ' HA ' HG21 ' A' ' 332' ' ' ILE . 52.0 t80 -54.08 -64.73 0.73 Allowed 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.239 -0.913 . . . . 0.38 109.651 -179.727 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 339' ' ' GLU . . . . . . . . . . . . . 43.2 mt-10 -50.62 -29.04 9.99 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.245 -0.909 . . . . 1.97 109.681 -179.739 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 340' ' ' MET . . . . . 0.448 ' HB3' ' O ' ' A' ' 337' ' ' ARG . 6.9 ttp -64.43 -52.29 58.81 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.17 -0.956 . . . . 0.31 109.851 -179.853 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 341' ' ' PHE . . . . . . . . . . . . . 40.4 m-85 -62.54 -44.61 95.93 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.313 -0.867 . . . . 0.17999999999999999 110.068 -179.687 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 342' ' ' ARG . . . . . . . . . . . . . 1.8 ttp180 -49.82 -41.87 45.85 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.102 -0.999 . . . . 2.4199999999999999 109.867 -179.598 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 343' ' ' GLU . . . . . . . . . . . . . 38.4 tt0 -59.06 -47.19 86.15 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.194 -0.941 . . . . 2.3500000000000001 109.882 -179.697 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 344' ' ' LEU . . . . . 0.411 HD22 HD22 ' B' ' 344' ' ' LEU . 78.6 mt -62.71 -32.56 73.68 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.213 -0.929 . . . . 0.17999999999999999 109.925 -179.65 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 345' ' ' ASN . . . . . 0.514 ' HA ' ' CZ ' ' C' ' 341' ' ' PHE . 53.8 t-20 -57.03 -56.09 26.26 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.203 -0.936 . . . . 1.0900000000000001 110.064 -179.641 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 346' ' ' GLU . . . . . . . . . . . . . 3.9 tp10 -61.48 -26.79 68.13 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.145 -0.972 . . . . 1.6499999999999999 110.089 -179.397 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 347' ' ' ALA . . . . . 0.984 ' HB1' ' HB1' ' B' ' 347' ' ' ALA . . . -61.41 -58.31 8.72 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.081 -1.012 . . . . 0.17999999999999999 110.182 -179.618 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 348' ' ' LEU . . . . . 0.58 HD22 ' N ' ' A' ' 348' ' ' LEU . 4.0 mm? -62.1 -50.72 70.8 Favored 'General case' 0 N--CA 1.494 1.773 0 O-C-N 121.183 -0.948 . . . . 0.29999999999999999 110.323 -179.287 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 349' ' ' GLU . . . . . . . . . . . . . 66.6 mt-10 -57.15 -30.87 64.81 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.184 -0.948 . . . . 1.9399999999999999 110.055 -179.149 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 350' ' ' LEU . . . . . 0.616 HD22 HD22 ' B' ' 350' ' ' LEU . 8.9 tt -65.06 -45.59 84.68 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.147 -0.971 . . . . 0.46000000000000002 109.579 -179.876 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 351' ' ' LYS . . . . . . . . . . . . . 41.1 tttm -57.35 -43.19 83.23 Favored 'General case' 0 N--CA 1.488 1.45 0 O-C-N 121.337 -0.852 . . . . 1.3999999999999999 109.541 -179.441 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 352' ' ' ASP . . . . . . . . . . . . . 14.3 m-20 -55.85 -54.86 39.43 Favored 'General case' 0 N--CA 1.488 1.46 0 O-C-N 121.214 -0.929 . . . . 1.1599999999999999 109.583 179.976 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 353' ' ' ALA . . . . . . . . . . . . . . . -68.47 -11.48 59.84 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.227 -0.921 . . . . 0.63 109.8 -179.832 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 354' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -84.89 -16.38 41.38 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.167 -0.958 . . . . 1.47 109.723 -179.771 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 355' ' ' ALA . . . . . . . . . . . . . . . -73.84 -18.22 60.97 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.191 -0.943 . . . . 1.01 109.52 179.989 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 356' ' ' GLY . . . . . . . . . . . . . . . -80.59 3.13 75.58 Favored Glycine 0 N--CA 1.491 2.354 0 N-CA-C 109.82 -1.312 . . . . 1.3 109.82 -179.987 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 357' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -91.63 -44.51 8.99 Favored 'General case' 0 N--CA 1.489 1.489 0 O-C-N 121.095 -1.238 . . . . 4.0999999999999996 109.763 -179.729 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 358' ' ' GLU . . . . . . . . . . . . . 57.2 tt0 -48.62 134.77 13.49 Favored Pre-proline 0 N--CA 1.49 1.528 0 O-C-N 121.142 -0.974 . . . . 5.75 109.258 -179.95 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 359' ' ' PRO . . . . . . . . . . . . . 2.3 Cg_endo -62.44 -175.25 0.19 Allowed 'Trans proline' 0 C--N 1.312 -1.394 0 C-N-CA 122.008 1.806 . . . . 5.0 110.233 -179.956 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 360' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.277 0 CA-C-O 117.992 -1.449 . . . . 6.9699999999999998 109.536 179.98 . . . . . . . . 0 0 . 1 . 018 nuclear build full ' B' B ' 319' ' ' LYS . . . . . . . . . . . . . 1.4 mtmt . . . . . 0 N--CA 1.489 1.501 0 N-CA-C 109.479 -0.563 . . . . 7.5499999999999998 109.479 . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' B' B ' 320' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 63.26 -139.81 0.36 Allowed 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.253 -0.904 . . . . 6.4400000000000004 109.501 179.821 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 321' ' ' LYS . . . . . . . . . . . . . 2.3 ttmt -155.68 103.64 2.15 Favored Pre-proline 0 N--CA 1.491 1.576 0 O-C-N 121.059 -1.026 . . . . 6.1299999999999999 109.393 -179.879 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 322' ' ' PRO . . . . . . . . . . . . . 3.1 Cg_endo -69.18 5.96 1.29 Allowed 'Trans proline' 0 C--N 1.314 -1.239 0 C-N-CA 122.392 2.062 . . . . 2.8199999999999998 111.572 -179.939 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 323' ' ' LEU . . . . . . . . . . . . . 11.3 mt -83.54 58.6 4.65 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 120.929 -1.107 . . . . 2.8399999999999999 110.08 -179.692 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 324' ' ' ASP . . . . . . . . . . . . . 26.5 m-20 -81.03 164.96 22.11 Favored 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.022 -1.049 . . . . 1.53 109.27 179.743 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 325' ' ' GLY . . . . . . . . . . . . . . . -67.61 -179.7 15.0 Favored Glycine 0 N--CA 1.49 2.262 0 N-CA-C 109.447 -1.461 . . . . 0.58999999999999997 109.447 179.873 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 326' ' ' GLU . . . . . . . . . . . . . 1.8 mm-40 -57.39 -173.12 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.158 -1.201 . . . . 2.1299999999999999 109.204 179.83 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 327' ' ' TYR . . . . . 0.58 ' CE1' ' HG2' ' D' ' 333' ' ' ARG . 46.2 m-85 -149.18 105.26 3.49 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.096 -1.003 . . . . 0.47999999999999998 109.812 -179.79 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 328' ' ' PHE . . . . . 0.417 ' C ' HG23 ' B' ' 329' ' ' THR . 97.2 m-85 -112.16 -163.69 0.87 Allowed 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.375 -0.828 . . . . 0.32000000000000001 109.471 179.783 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 329' ' ' THR . . . . . 0.417 HG23 ' C ' ' B' ' 328' ' ' PHE . 73.8 p -154.59 166.33 33.7 Favored 'General case' 0 N--CA 1.489 1.488 0 O-C-N 121.283 -0.886 . . . . 0.23000000000000001 108.986 179.788 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 330' ' ' LEU . . . . . . . . . . . . . 32.5 tp -151.07 131.93 14.15 Favored 'General case' 0 N--CA 1.489 1.481 0 O-C-N 121.102 -0.999 . . . . 0.28000000000000003 109.857 -179.809 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 331' ' ' GLN . . . . . . . . . . . . . 19.5 tp60 -86.89 114.97 23.97 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.358 -0.839 . . . . 0.91000000000000003 109.081 179.688 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 332' ' ' ILE . . . . . 0.552 HG21 ' HA ' ' B' ' 338' ' ' PHE . 52.2 mt -103.38 106.9 20.99 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.58 0 O-C-N 121.248 -0.908 . . . . 0.23999999999999999 109.677 -179.769 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 333' ' ' ARG . . . . . 0.489 ' HG2' ' CE1' ' D' ' 327' ' ' TYR . 9.8 mtp180 -72.22 140.05 48.49 Favored 'General case' 0 N--CA 1.489 1.497 0 O-C-N 121.259 -0.901 . . . . 2.9300000000000002 109.414 179.756 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 334' ' ' GLY . . . . . . . . . . . . . . . 88.95 127.45 2.98 Favored Glycine 0 N--CA 1.491 2.361 0 N-CA-C 109.72 -1.352 . . . . 0.40000000000000002 109.72 179.851 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 335' ' ' ARG . . . . . 0.474 ' O ' ' HB3' ' B' ' 338' ' ' PHE . 8.2 ttt180 -78.14 -34.77 49.65 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.303 -1.116 . . . . 3.0099999999999998 109.576 179.991 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 336' ' ' GLU . . . . . . . . . . . . . 9.2 tt0 -57.79 -62.36 1.86 Allowed 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.265 -0.897 . . . . 2.2799999999999998 109.771 -179.787 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 337' ' ' ARG . . . . . 0.519 ' NH1' ' HG2' ' B' ' 337' ' ' ARG . 0.0 OUTLIER -60.85 -27.55 68.19 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.258 -0.901 . . . . 2.9300000000000002 109.827 -179.801 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' B' B ' 338' ' ' PHE . . . . . 0.552 ' HA ' HG21 ' B' ' 332' ' ' ILE . 52.2 t80 -53.92 -64.87 0.69 Allowed 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.284 -0.885 . . . . 0.37 109.669 -179.772 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 339' ' ' GLU . . . . . . . . . . . . . 42.7 mt-10 -50.5 -28.94 9.36 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.256 -0.902 . . . . 1.98 109.77 -179.775 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 340' ' ' MET . . . . . 0.45 ' HB3' ' O ' ' B' ' 337' ' ' ARG . 6.9 ttp -64.54 -52.2 58.91 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.182 -0.949 . . . . 0.32000000000000001 109.79 -179.8 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 341' ' ' PHE . . . . . 0.546 ' CZ ' ' HA ' ' D' ' 345' ' ' ASN . 39.9 m-85 -62.66 -44.53 96.03 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.243 -0.911 . . . . 0.17999999999999999 110.019 -179.624 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 342' ' ' ARG . . . . . . . . . . . . . 1.8 ttp180 -49.93 -41.79 47.04 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.156 -0.965 . . . . 2.4199999999999999 109.918 -179.618 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 343' ' ' GLU . . . . . . . . . . . . . 37.4 tt0 -59.24 -47.15 86.42 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.181 -0.949 . . . . 2.3500000000000001 109.793 -179.645 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 344' ' ' LEU . . . . . 0.411 HD22 HD22 ' A' ' 344' ' ' LEU . 79.3 mt -62.71 -32.46 73.57 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.129 -0.982 . . . . 0.17999999999999999 109.825 -179.645 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 345' ' ' ASN . . . . . 0.461 ' HA ' ' CZ ' ' D' ' 341' ' ' PHE . 54.1 t-20 -57.22 -56.04 27.0 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.22 -0.925 . . . . 1.0900000000000001 110.014 -179.585 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 346' ' ' GLU . . . . . . . . . . . . . 3.9 tp10 -61.49 -26.66 68.06 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.259 -0.9 . . . . 1.6599999999999999 110.011 -179.443 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 347' ' ' ALA . . . . . 0.984 ' HB1' ' HB1' ' A' ' 347' ' ' ALA . . . -61.53 -58.34 8.53 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.124 -0.985 . . . . 0.17000000000000001 110.17 -179.623 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 348' ' ' LEU . . . . . 0.584 HD22 ' N ' ' B' ' 348' ' ' LEU . 4.0 mm? -62.11 -50.75 70.65 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.192 -0.943 . . . . 0.28999999999999998 110.327 -179.267 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 349' ' ' GLU . . . . . . . . . . . . . 66.7 mt-10 -57.09 -30.93 64.75 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.185 -0.947 . . . . 1.95 110.084 -179.15 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 350' ' ' LEU . . . . . 0.616 HD22 HD22 ' A' ' 350' ' ' LEU . 8.9 tt -65.01 -45.54 85.1 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.151 -0.968 . . . . 0.45000000000000001 109.601 -179.923 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 351' ' ' LYS . . . . . . . . . . . . . 40.8 tttm -57.33 -43.17 83.13 Favored 'General case' 0 N--CA 1.489 1.497 0 O-C-N 121.268 -0.895 . . . . 1.3799999999999999 109.618 -179.45 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 352' ' ' ASP . . . . . . . . . . . . . 14.4 m-20 -55.91 -54.88 39.32 Favored 'General case' 0 N--CA 1.489 1.478 0 O-C-N 121.208 -0.932 . . . . 1.1599999999999999 109.56 179.902 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 353' ' ' ALA . . . . . . . . . . . . . . . -68.44 -11.61 59.98 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.215 -0.928 . . . . 0.60999999999999999 109.802 -179.78 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 354' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -84.62 -16.55 41.65 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.167 -0.958 . . . . 1.45 109.727 -179.779 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 355' ' ' ALA . . . . . . . . . . . . . . . -73.79 -18.22 60.99 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.231 -0.918 . . . . 0.97999999999999998 109.571 179.99 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 356' ' ' GLY . . . . . . . . . . . . . . . -80.53 3.17 75.07 Favored Glycine 0 N--CA 1.492 2.379 0 N-CA-C 109.842 -1.303 . . . . 1.29 109.842 179.992 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 357' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -91.72 -44.4 9.02 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.114 -1.227 . . . . 4.0899999999999999 109.669 -179.667 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 358' ' ' GLU . . . . . . . . . . . . . 56.9 tt0 -48.7 134.83 13.72 Favored Pre-proline 0 N--CA 1.491 1.586 0 O-C-N 121.047 -1.033 . . . . 5.7199999999999998 109.253 -179.842 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 359' ' ' PRO . . . . . . . . . . . . . 2.2 Cg_endo -62.53 -175.25 0.19 Allowed 'Trans proline' 0 C--N 1.311 -1.437 0 C-N-CA 122.046 1.831 . . . . 4.9800000000000004 110.183 -179.946 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 360' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.214 0 CA-C-O 117.944 -1.476 . . . . 6.9800000000000004 109.595 -179.989 . . . . . . . . 0 0 . 1 . 018 nuclear build full ' C' C ' 319' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.49 1.539 0 N-CA-C 109.43 -0.582 . . . . 6.8200000000000003 109.43 . . . . . . . . . 1 1 . 1 . 018 nuclear build full ' C' C ' 320' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 54.93 79.19 0.15 Allowed 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.233 -0.917 . . . . 6.4900000000000002 109.341 -179.85 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' C' C ' 321' ' ' LYS . . . . . 0.555 ' N ' ' HD3' ' C' ' 322' ' ' PRO . 0.1 OUTLIER -156.47 57.73 1.5 Allowed Pre-proline 0 N--CA 1.49 1.541 0 O-C-N 121.377 -0.827 . . . . 6.4000000000000004 109.347 179.868 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' C' C ' 322' ' ' PRO . . . . . 0.555 ' HD3' ' N ' ' C' ' 321' ' ' LYS . 1.6 Cg_endo -62.35 153.48 70.19 Favored 'Trans proline' 0 C--N 1.311 -1.435 0 C-N-CA 122.327 2.018 . . . . 3.4199999999999999 110.264 -179.822 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' C' C ' 323' ' ' LEU . . . . . 0.41 HD23 ' HA ' ' C' ' 323' ' ' LEU . 30.4 mt -80.24 132.13 35.8 Favored 'General case' 0 N--CA 1.488 1.455 0 O-C-N 121.364 -0.835 . . . . 3.9500000000000002 109.241 179.564 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' C' C ' 324' ' ' ASP . . . . . 0.502 ' CB ' ' OH ' ' C' ' 327' ' ' TYR . 37.0 m-20 -78.64 158.63 28.37 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.214 -0.929 . . . . 1.6299999999999999 109.376 -179.917 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' C' C ' 325' ' ' GLY . . . . . . . . . . . . . . . -67.86 -172.08 6.24 Favored Glycine 0 N--CA 1.489 2.187 0 N-CA-C 109.354 -1.498 . . . . 0.72999999999999998 109.354 -179.987 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' C' C ' 326' ' ' GLU . . . . . 0.484 ' OE1' ' HB2' ' A' ' 335' ' ' ARG . 2.3 mt-10 -58.11 -172.78 0.01 OUTLIER 'General case' 0 N--CA 1.488 1.463 0 O-C-N 121.235 -1.156 . . . . 2.1699999999999999 109.415 -179.933 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' C' C ' 327' ' ' TYR . . . . . 0.532 ' CE1' ' HG2' ' A' ' 333' ' ' ARG . 42.6 m-85 -148.98 103.41 3.35 Favored 'General case' 0 N--CA 1.489 1.493 0 O-C-N 121.269 -0.894 . . . . 0.47999999999999998 109.175 179.941 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' C' C ' 328' ' ' PHE . . . . . . . . . . . . . 52.9 m-85 -107.13 -167.41 1.27 Allowed 'General case' 0 N--CA 1.488 1.469 0 O-C-N 121.292 -0.88 . . . . 0.33000000000000002 109.378 -179.944 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' C' C ' 329' ' ' THR . . . . . 0.421 ' HA ' ' O ' ' A' ' 330' ' ' LEU . 4.5 p -152.07 167.85 27.16 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.26 -0.9 . . . . 0.23000000000000001 109.043 179.907 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' C' C ' 330' ' ' LEU . . . . . 0.449 ' O ' ' HA ' ' A' ' 329' ' ' THR . 27.0 tp -151.15 129.5 12.04 Favored 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.127 -0.983 . . . . 0.28000000000000003 109.946 -179.525 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' C' C ' 331' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -89.41 114.91 26.43 Favored 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.3 -0.875 . . . . 1.48 109.438 179.724 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' C' C ' 332' ' ' ILE . . . . . 0.478 HD12 ' CD1' ' C' ' 338' ' ' PHE . 60.2 mt -103.76 113.29 40.23 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.622 0 O-C-N 121.11 -0.994 . . . . 0.23999999999999999 109.648 179.964 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' C' C ' 333' ' ' ARG . . . . . 0.589 ' HG2' ' CE1' ' A' ' 327' ' ' TYR . 34.7 mtt180 -73.44 139.91 46.15 Favored 'General case' 0 N--CA 1.489 1.478 0 O-C-N 121.171 -0.956 . . . . 2.7400000000000002 109.443 179.772 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' C' C ' 334' ' ' GLY . . . . . . . . . . . . . . . 81.43 125.64 0.75 Allowed Glycine 0 N--CA 1.491 2.325 0 N-CA-C 109.597 -1.401 . . . . 0.34999999999999998 109.597 179.946 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' C' C ' 335' ' ' ARG . . . . . 0.552 ' HD3' ' CZ ' ' A' ' 328' ' ' PHE . 0.0 OUTLIER -76.57 -25.57 54.16 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.194 -1.18 . . . . 2.5299999999999998 109.696 -179.986 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' C' C ' 336' ' ' GLU . . . . . . . . . . . . . 1.9 tt0 -55.85 -69.49 0.14 Allowed 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.135 -0.978 . . . . 2.6200000000000001 109.72 -179.716 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' C' C ' 337' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -60.72 -23.83 65.21 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.164 -0.96 . . . . 2.8100000000000001 109.566 -179.862 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' C' C ' 338' ' ' PHE . . . . . 0.478 ' CD1' HD12 ' C' ' 332' ' ' ILE . 61.2 t80 -54.67 -59.4 4.76 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.215 -0.928 . . . . 0.40000000000000002 109.491 -179.971 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' C' C ' 339' ' ' GLU . . . . . . . . . . . . . 2.1 mt-10 -52.1 -33.37 39.22 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.231 -0.918 . . . . 2.0499999999999998 109.945 -179.794 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' C' C ' 340' ' ' MET . . . . . . . . . . . . . 41.5 ttp -63.21 -50.73 69.12 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.067 -1.021 . . . . 0.32000000000000001 109.896 -179.618 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' C' C ' 341' ' ' PHE . . . . . 0.514 ' CZ ' ' HA ' ' A' ' 345' ' ' ASN . 46.9 m-85 -62.16 -50.34 72.23 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.142 -0.974 . . . . 0.17999999999999999 109.785 -179.796 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' C' C ' 342' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -48.19 -42.2 29.2 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.224 -0.923 . . . . 2.9100000000000001 110.068 -179.61 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' C' C ' 343' ' ' GLU . . . . . . . . . . . . . 10.2 tp10 -57.9 -48.1 80.85 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.251 -0.905 . . . . 2.1400000000000001 109.618 -179.673 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' C' C ' 344' ' ' LEU . . . . . . . . . . . . . 79.6 mt -62.33 -26.51 68.47 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.292 -0.88 . . . . 0.22 109.603 -179.95 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' C' C ' 345' ' ' ASN . . . . . 0.414 HD22 HD11 ' A' ' 330' ' ' LEU . 56.9 t-20 -58.5 -57.63 12.11 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.288 -0.883 . . . . 1.0800000000000001 110.019 -179.786 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' C' C ' 346' ' ' GLU . . . . . 0.469 ' O ' ' HG2' ' C' ' 346' ' ' GLU . 25.4 tt0 -60.96 -27.81 68.53 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.185 -0.947 . . . . 2.21 110.043 -179.415 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' C' C ' 347' ' ' ALA . . . . . 0.896 ' HB1' ' HB1' ' D' ' 347' ' ' ALA . . . -61.93 -58.4 8.07 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.037 -1.039 . . . . 0.17999999999999999 110.276 -179.498 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' C' C ' 348' ' ' LEU . . . . . 0.535 ' N ' HD22 ' C' ' 348' ' ' LEU . 3.7 mm? -62.09 -48.94 77.96 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.206 -0.934 . . . . 0.32000000000000001 110.538 -179.065 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' C' C ' 349' ' ' GLU . . . . . . . . . . . . . 16.5 mm-40 -57.49 -34.99 69.64 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.091 -1.005 . . . . 2.1899999999999999 110.267 -179.135 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' C' C ' 350' ' ' LEU . . . . . 0.64 HD22 HD22 ' D' ' 350' ' ' LEU . 8.5 tt -64.48 -40.46 95.73 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.056 -1.028 . . . . 0.46000000000000002 109.563 -179.794 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' C' C ' 351' ' ' LYS . . . . . 0.408 ' NZ ' ' HG3' ' D' ' 343' ' ' GLU . 7.0 ttmt -59.33 -48.97 79.62 Favored 'General case' 0 N--CA 1.489 1.477 0 O-C-N 121.293 -0.879 . . . . 1.3500000000000001 109.612 -179.837 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' C' C ' 352' ' ' ASP . . . . . . . . . . . . . 62.1 m-20 -56.94 -54.57 45.15 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.338 -0.851 . . . . 1.1899999999999999 110.232 -179.732 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' C' C ' 353' ' ' ALA . . . . . . . . . . . . . . . -67.33 -10.87 55.18 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.141 -0.975 . . . . 0.56999999999999995 110.063 -179.327 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' C' C ' 354' ' ' GLN . . . . . 0.416 ' O ' ' HG2' ' C' ' 354' ' ' GLN . 12.6 tt0 -84.13 -12.79 54.4 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.105 -0.997 . . . . 1.47 109.852 -179.845 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' C' C ' 355' ' ' ALA . . . . . . . . . . . . . . . -71.68 -9.39 58.18 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.106 -0.996 . . . . 0.93000000000000005 109.437 179.907 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' C' C ' 356' ' ' GLY . . . . . . . . . . . . . . . -81.09 11.72 41.24 Favored Glycine 0 N--CA 1.49 2.251 0 N-CA-C 110.31 -1.116 . . . . 1.3300000000000001 110.31 -179.869 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' C' C ' 357' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -85.07 98.0 10.18 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 120.897 -1.355 . . . . 4.0099999999999998 109.435 -179.849 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' C' C ' 358' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -51.86 155.69 2.89 Favored Pre-proline 0 N--CA 1.49 1.538 0 O-C-N 121.499 -0.751 . . . . 5.75 110.089 -179.773 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' C' C ' 359' ' ' PRO . . . . . . . . . . . . . 2.8 Cg_endo -69.2 -0.72 6.85 Favored 'Trans proline' 0 C--N 1.312 -1.374 0 C-N-CA 122.549 2.166 . . . . 4.9400000000000004 110.853 179.724 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' C' C ' 360' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.302 0 CA-C-O 117.945 -1.475 . . . . 6.5 109.622 -179.8 . . . . . . . . 0 0 . 1 . 018 nuclear build full ' D' D ' 319' ' ' LYS . . . . . . . . . . . . . 1.4 mtmt . . . . . 0 N--CA 1.49 1.557 0 N-CA-C 109.449 -0.574 . . . . 7.5300000000000002 109.449 . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' D' D ' 320' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 63.21 -139.82 0.37 Allowed 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.222 -0.924 . . . . 6.4100000000000001 109.562 179.793 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' D' D ' 321' ' ' LYS . . . . . . . . . . . . . 2.2 ttmt -155.68 103.6 2.15 Favored Pre-proline 0 N--CA 1.491 1.589 0 O-C-N 121.022 -1.049 . . . . 6.1100000000000003 109.416 -179.997 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' D' D ' 322' ' ' PRO . . . . . . . . . . . . . 3.2 Cg_endo -69.27 6.21 1.23 Allowed 'Trans proline' 0 C--N 1.314 -1.277 0 C-N-CA 122.368 2.045 . . . . 2.8199999999999998 111.575 -179.908 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' D' D ' 323' ' ' LEU . . . . . . . . . . . . . 11.4 mt -83.58 58.46 4.59 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 120.769 -1.207 . . . . 2.8300000000000001 110.062 -179.796 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' D' D ' 324' ' ' ASP . . . . . . . . . . . . . 26.7 m-20 -80.82 165.22 22.06 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.102 -0.999 . . . . 1.54 109.287 179.716 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' D' D ' 325' ' ' GLY . . . . . . . . . . . . . . . -68.12 -179.68 17.42 Favored Glycine 0 N--CA 1.491 2.361 0 N-CA-C 109.35 -1.5 . . . . 0.58999999999999997 109.35 179.958 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' D' D ' 326' ' ' GLU . . . . . . . . . . . . . 1.8 mm-40 -57.3 -173.06 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.213 -1.169 . . . . 2.1299999999999999 109.243 179.892 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' D' D ' 327' ' ' TYR . . . . . 0.489 ' CE1' ' HG2' ' B' ' 333' ' ' ARG . 46.7 m-85 -149.36 105.38 3.47 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.066 -1.021 . . . . 0.46999999999999997 109.924 -179.834 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' D' D ' 328' ' ' PHE . . . . . 0.423 ' C ' HG23 ' D' ' 329' ' ' THR . 97.1 m-85 -112.29 -163.57 0.86 Allowed 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.307 -0.871 . . . . 0.29999999999999999 109.451 179.838 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' D' D ' 329' ' ' THR . . . . . 0.423 HG23 ' C ' ' D' ' 328' ' ' PHE . 72.5 p -154.71 166.38 33.62 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.309 -0.869 . . . . 0.22 108.924 179.817 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' D' D ' 330' ' ' LEU . . . . . . . . . . . . . 32.5 tp -151.07 132.09 14.29 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.056 -1.028 . . . . 0.28000000000000003 109.823 -179.782 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' D' D ' 331' ' ' GLN . . . . . . . . . . . . . 19.4 tp60 -86.96 114.98 24.04 Favored 'General case' 0 N--CA 1.489 1.488 0 O-C-N 121.37 -0.832 . . . . 0.93000000000000005 109.021 179.672 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' D' D ' 332' ' ' ILE . . . . . 0.565 HG21 ' HA ' ' D' ' 338' ' ' PHE . 52.5 mt -103.43 106.87 20.96 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.542 0 O-C-N 121.209 -0.932 . . . . 0.25 109.662 -179.8 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' D' D ' 333' ' ' ARG . . . . . 0.58 ' HG2' ' CE1' ' B' ' 327' ' ' TYR . 9.9 mtp180 -72.19 140.14 48.58 Favored 'General case' 0 N--CA 1.488 1.441 0 O-C-N 121.273 -0.892 . . . . 2.9300000000000002 109.393 179.824 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' D' D ' 334' ' ' GLY . . . . . . . . . . . . . . . 88.96 127.23 2.93 Favored Glycine 0 N--CA 1.492 2.414 0 N-CA-C 109.689 -1.365 . . . . 0.40999999999999998 109.689 179.93 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' D' D ' 335' ' ' ARG . . . . . 0.476 ' O ' ' HB3' ' D' ' 338' ' ' PHE . 7.9 ttt180 -78.2 -34.52 49.39 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.258 -1.142 . . . . 3.0299999999999998 109.63 179.947 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' D' D ' 336' ' ' GLU . . . . . . . . . . . . . 9.2 tt0 -58.05 -62.19 2.0 Allowed 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.276 -0.89 . . . . 2.2599999999999998 109.659 -179.819 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' D' D ' 337' ' ' ARG . . . . . 0.516 ' NH1' ' HG2' ' D' ' 337' ' ' ARG . 0.0 OUTLIER -60.99 -27.58 68.4 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.317 -0.864 . . . . 2.9199999999999999 109.706 -179.774 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' D' D ' 338' ' ' PHE . . . . . 0.565 ' HA ' HG21 ' D' ' 332' ' ' ILE . 52.9 t80 -53.84 -64.66 0.76 Allowed 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.248 -0.907 . . . . 0.37 109.777 -179.792 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' D' D ' 339' ' ' GLU . . . . . . . . . . . . . 42.8 mt-10 -50.6 -29.17 10.24 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.25 -0.906 . . . . 1.99 109.687 -179.765 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' D' D ' 340' ' ' MET . . . . . 0.441 ' HB3' ' O ' ' D' ' 337' ' ' ARG . 7.0 ttp -64.39 -52.26 59.12 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.236 -0.915 . . . . 0.31 109.793 -179.763 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' D' D ' 341' ' ' PHE . . . . . 0.461 ' CZ ' ' HA ' ' B' ' 345' ' ' ASN . 39.8 m-85 -62.71 -44.53 95.98 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.303 -0.873 . . . . 0.17999999999999999 109.991 -179.594 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' D' D ' 342' ' ' ARG . . . . . . . . . . . . . 1.9 ttp180 -49.86 -41.93 46.42 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.158 -0.964 . . . . 2.4100000000000001 109.921 -179.656 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' D' D ' 343' ' ' GLU . . . . . 0.408 ' HG3' ' NZ ' ' C' ' 351' ' ' LYS . 38.1 tt0 -59.08 -47.19 86.16 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.133 -0.98 . . . . 2.3500000000000001 109.885 -179.701 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' D' D ' 344' ' ' LEU . . . . . . . . . . . . . 79.3 mt -62.66 -32.55 73.63 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.191 -0.943 . . . . 0.19 109.909 -179.717 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' D' D ' 345' ' ' ASN . . . . . 0.546 ' HA ' ' CZ ' ' B' ' 341' ' ' PHE . 53.7 t-20 -57.11 -56.12 25.94 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.283 -0.886 . . . . 1.0900000000000001 110.04 -179.613 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' D' D ' 346' ' ' GLU . . . . . . . . . . . . . 4.0 tp10 -61.45 -26.51 67.93 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.152 -0.968 . . . . 1.6899999999999999 110.144 -179.498 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' D' D ' 347' ' ' ALA . . . . . 0.896 ' HB1' ' HB1' ' C' ' 347' ' ' ALA . . . -61.57 -58.34 8.5 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.169 -0.957 . . . . 0.17999999999999999 110.172 -179.566 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' D' D ' 348' ' ' LEU . . . . . 0.583 HD22 ' N ' ' D' ' 348' ' ' LEU . 4.0 mm? -62.05 -50.63 71.22 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.212 -0.93 . . . . 0.31 110.294 -179.29 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' D' D ' 349' ' ' GLU . . . . . . . . . . . . . 66.9 mt-10 -57.19 -30.99 64.98 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.135 -0.978 . . . . 1.95 110.134 -179.226 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' D' D ' 350' ' ' LEU . . . . . 0.64 HD22 HD22 ' C' ' 350' ' ' LEU . 8.9 tt -65.08 -45.13 86.51 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.09 -1.006 . . . . 0.42999999999999999 109.675 -179.884 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' D' D ' 351' ' ' LYS . . . . . . . . . . . . . 40.9 tttm -57.74 -43.3 85.29 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.302 -0.874 . . . . 1.3999999999999999 109.593 -179.643 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' D' D ' 352' ' ' ASP . . . . . . . . . . . . . 14.3 m-20 -55.81 -54.92 38.59 Favored 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.253 -0.905 . . . . 1.1699999999999999 109.561 179.926 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' D' D ' 353' ' ' ALA . . . . . . . . . . . . . . . -68.45 -11.43 59.73 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.247 -0.908 . . . . 0.58999999999999997 109.779 -179.872 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' D' D ' 354' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -84.86 -16.28 41.79 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.149 -0.969 . . . . 1.4399999999999999 109.798 -179.826 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' D' D ' 355' ' ' ALA . . . . . . . . . . . . . . . -73.93 -18.07 60.94 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.129 -0.982 . . . . 0.97999999999999998 109.542 179.947 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' D' D ' 356' ' ' GLY . . . . . . . . . . . . . . . -80.8 3.19 76.55 Favored Glycine 0 N--CA 1.49 2.278 0 N-CA-C 109.734 -1.346 . . . . 1.28 109.734 -179.863 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' D' D ' 357' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -91.6 -44.4 9.07 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.16 -1.2 . . . . 4.0899999999999999 109.745 -179.746 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' D' D ' 358' ' ' GLU . . . . . . . . . . . . . 57.0 tt0 -48.6 134.68 13.45 Favored Pre-proline 0 N--CA 1.49 1.539 0 O-C-N 121.149 -0.97 . . . . 5.71 109.308 -179.928 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' D' D ' 359' ' ' PRO . . . . . . . . . . . . . 2.3 Cg_endo -62.56 -174.86 0.18 Allowed 'Trans proline' 0 C--N 1.312 -1.373 0 C-N-CA 121.879 1.72 . . . . 4.9699999999999998 110.133 -179.932 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' D' D ' 360' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.243 0 N-CA-C 109.512 -1.435 . . . . 6.9699999999999998 109.512 -179.97 . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 319' ' ' LYS . . . . . . . . . . . . . 1.9 tttp . . . . . 0 N--CA 1.49 1.543 0 N-CA-C 109.303 -0.629 . . . . 7.5499999999999998 109.303 . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 320' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 67.84 -152.27 0.18 Allowed 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.228 -0.92 . . . . 6.4299999999999997 109.739 179.577 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 321' ' ' LYS . . . . . . . . . . . . . 1.1 mttt -82.97 144.41 47.64 Favored Pre-proline 0 N--CA 1.49 1.526 0 O-C-N 121.229 -0.92 . . . . 6.1299999999999999 109.664 -179.814 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 322' ' ' PRO . . . . . . . . . . . . . 1.6 Cg_endo -66.18 -81.3 0.01 OUTLIER 'Trans proline' 0 C--N 1.312 -1.344 0 C-N-CA 122.263 1.975 . . . . 2.8300000000000001 109.937 179.843 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 323' ' ' LEU . . . . . . . . . . . . . 19.4 mt -81.8 124.13 29.39 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.189 -0.944 . . . . 2.8300000000000001 109.452 179.766 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 324' ' ' ASP . . . . . . . . . . . . . 7.3 m-20 -81.39 -146.26 0.06 Allowed 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.218 -0.926 . . . . 1.53 109.241 179.765 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 325' ' ' GLY . . . . . . . . . . . . . . . -67.61 -177.8 11.44 Favored Glycine 0 N--CA 1.49 2.257 0 N-CA-C 109.572 -1.411 . . . . 0.60999999999999999 109.572 -179.944 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 326' ' ' GLU . . . . . . . . . . . . . 3.6 mt-10 -57.62 -172.96 0.01 OUTLIER 'General case' 0 N--CA 1.488 1.47 0 O-C-N 121.294 -1.121 . . . . 2.1299999999999999 109.545 -179.687 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 327' ' ' TYR . . . . . 0.449 ' CE1' ' HG2' ' C' ' 333' ' ' ARG . 47.2 m-85 -149.85 112.76 4.83 Favored 'General case' 0 N--CA 1.489 1.491 0 O-C-N 121.377 -0.827 . . . . 0.47999999999999998 109.43 -179.9 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 328' ' ' PHE . . . . . 0.481 ' O ' ' OE1' ' C' ' 331' ' ' GLN . 77.4 m-85 -113.46 -170.18 1.64 Allowed 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.257 -0.902 . . . . 0.31 109.385 -179.934 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 329' ' ' THR . . . . . 0.424 ' HA ' ' O ' ' C' ' 330' ' ' LEU . 52.4 p -154.58 169.26 24.25 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.082 -1.012 . . . . 0.22 109.438 -179.775 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 330' ' ' LEU . . . . . 0.497 HD11 HD22 ' C' ' 345' ' ' ASN . 33.6 tp -152.12 129.09 11.01 Favored 'General case' 0 N--CA 1.488 1.474 0 O-C-N 121.081 -1.012 . . . . 0.28000000000000003 110.144 -179.927 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 331' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -87.83 109.62 19.89 Favored 'General case' 0 N--CA 1.487 1.404 0 O-C-N 121.302 -0.874 . . . . 0.91000000000000003 108.841 179.271 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 332' ' ' ILE . . . . . . . . . . . . . 18.3 mt -103.03 104.91 17.32 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.523 0 O-C-N 121.14 -0.975 . . . . 0.26000000000000001 109.682 -179.586 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 333' ' ' ARG . . . . . 0.629 ' CG ' ' CE1' ' C' ' 327' ' ' TYR . 0.0 OUTLIER -72.01 152.92 42.1 Favored 'General case' 0 C--N 1.303 -1.455 0 O-C-N 121.564 -0.71 . . . . 2.9199999999999999 109.25 179.714 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 334' ' ' GLY . . . . . . . . . . . . . . . 76.45 129.69 0.34 Allowed Glycine 0 N--CA 1.489 2.202 0 N-CA-C 109.545 -1.422 . . . . 0.40000000000000002 109.545 179.997 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 335' ' ' ARG . . . . . . . . . . . . . 9.2 ttm180 -79.15 -26.0 42.82 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.317 -1.107 . . . . 3.0099999999999998 109.785 -179.939 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 336' ' ' GLU . . . . . . . . . . . . . 16.3 mt-10 -57.42 -68.89 0.19 Allowed 'General case' 0 N--CA 1.495 1.786 0 O-C-N 121.225 -0.922 . . . . 2.29 109.83 -179.728 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 337' ' ' ARG . . . . . . . . . . . . . 6.1 mpt_? -59.41 -29.39 67.71 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.226 -0.921 . . . . 2.9300000000000002 109.586 -179.738 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 338' ' ' PHE . . . . . . . . . . . . . 72.4 t80 -53.99 -59.6 4.43 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.431 -0.793 . . . . 0.38 109.645 -179.829 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 339' ' ' GLU . . . . . . . . . . . . . 58.9 mt-10 -50.54 -34.89 27.15 Favored 'General case' 0 N--CA 1.488 1.473 0 O-C-N 121.197 -0.939 . . . . 1.97 110.181 -179.456 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 340' ' ' MET . . . . . . . . . . . . . 52.9 ttp -64.2 -50.08 69.5 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.193 -0.942 . . . . 0.31 110.408 -179.288 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 341' ' ' PHE . . . . . . . . . . . . . 55.6 m-85 -62.08 -39.95 94.17 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.238 -0.914 . . . . 0.17999999999999999 109.996 -179.344 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 342' ' ' ARG . . . . . . . . . . . . . 31.8 ttt180 -51.41 -47.59 62.91 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.182 -0.949 . . . . 2.4199999999999999 110.175 -179.5 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 343' ' ' GLU . . . . . . . . . . . . . 9.4 tp10 -60.13 -43.02 96.0 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 120.992 -1.067 . . . . 2.3500000000000001 110.201 -179.379 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 344' ' ' LEU . . . . . . . . . . . . . 52.7 mt -61.28 -37.04 81.72 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.085 -1.01 . . . . 0.17999999999999999 110.03 -179.416 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 345' ' ' ASN . . . . . 0.552 HD22 HD11 ' C' ' 330' ' ' LEU . 46.4 t-20 -58.24 -53.27 60.16 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.166 -0.959 . . . . 1.0900000000000001 109.8 -179.786 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 346' ' ' GLU . . . . . . . . . . . . . 1.2 tt0 -61.29 -30.95 70.79 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.208 -0.932 . . . . 1.6499999999999999 109.768 -179.674 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 347' ' ' ALA . . . . . 0.949 ' HB1' ' HB1' ' B' ' 347' ' ' ALA . . . -61.59 -57.59 11.47 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.236 -0.915 . . . . 0.17999999999999999 110.245 -179.501 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 348' ' ' LEU . . . . . 0.546 HD22 ' N ' ' A' ' 348' ' ' LEU . 3.8 mm? -61.56 -44.78 96.4 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.147 -0.97 . . . . 0.29999999999999999 110.04 -179.324 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 349' ' ' GLU . . . . . . . . . . . . . 76.0 mt-10 -57.99 -35.21 70.9 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.228 -0.92 . . . . 1.9399999999999999 109.95 -179.496 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 350' ' ' LEU . . . . . 0.735 HD22 HD13 ' B' ' 350' ' ' LEU . 6.8 tt -63.89 -48.39 76.82 Favored 'General case' 0 C--N 1.302 -1.474 0 O-C-N 121.098 -1.001 . . . . 0.46000000000000002 109.593 -179.623 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 351' ' ' LYS . . . . . . . . . . . . . 43.4 tttm -59.11 -42.03 89.59 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.307 -0.87 . . . . 1.3999999999999999 109.664 -179.794 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 352' ' ' ASP . . . . . 0.515 ' OD2' ' CZ ' ' C' ' 337' ' ' ARG . 1.0 OUTLIER -58.51 -38.96 78.81 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.084 -1.01 . . . . 1.1599999999999999 109.742 -179.896 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 353' ' ' ALA . . . . . . . . . . . . . . . -67.19 -21.72 65.76 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.289 -0.882 . . . . 0.63 109.94 -179.483 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 354' ' ' GLN . . . . . . . . . . . . . 9.3 mt-30 -83.06 -15.58 50.38 Favored 'General case' 0 N--CA 1.489 1.489 0 O-C-N 121.174 -0.953 . . . . 1.47 109.361 179.903 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 355' ' ' ALA . . . . . . . . . . . . . . . -74.0 -2.4 24.02 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.185 -0.947 . . . . 1.01 109.571 179.623 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 356' ' ' GLY . . . . . . . . . . . . . . . -79.29 -8.01 88.08 Favored Glycine 0 N--CA 1.49 2.286 0 N-CA-C 109.643 -1.383 . . . . 1.3 109.643 -179.767 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 357' ' ' LYS . . . . . . . . . . . . . 32.5 mttp -87.18 134.7 33.5 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.282 -1.128 . . . . 4.0999999999999996 108.709 179.487 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 358' ' ' GLU . . . . . 0.441 ' CG ' ' HD2' ' A' ' 359' ' ' PRO . 0.0 OUTLIER -48.47 157.84 0.67 Allowed Pre-proline 0 N--CA 1.49 1.535 0 O-C-N 121.104 -0.997 . . . . 5.75 109.781 -179.54 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 359' ' ' PRO . . . . . 0.441 ' HD2' ' CG ' ' A' ' 358' ' ' GLU . 2.4 Cg_endo -62.17 -177.76 0.29 Allowed 'Trans proline' 0 C--N 1.31 -1.495 0 C-N-CA 122.34 2.027 . . . . 5.0 110.043 179.662 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 360' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.312 0 CA-C-O 118.041 -1.421 . . . . 6.9699999999999998 109.724 179.958 . . . . . . . . 0 0 . 1 . 019 nuclear build full ' B' B ' 319' ' ' LYS . . . . . . . . . . . . . 2.6 tttp . . . . . 0 N--CA 1.492 1.673 0 N-CA-C 109.55 -0.537 . . . . 7.5499999999999998 109.55 . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' B' B ' 320' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 62.85 -152.1 0.34 Allowed 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.313 -0.867 . . . . 6.4400000000000004 109.914 179.867 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 321' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -82.55 145.42 51.16 Favored Pre-proline 0 N--CA 1.491 1.587 0 O-C-N 121.377 -0.827 . . . . 6.1299999999999999 109.679 -179.859 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 322' ' ' PRO . . . . . . . . . . . . . 2.6 Cg_endo -66.64 -81.25 0.01 OUTLIER 'Trans proline' 0 C--N 1.309 -1.503 0 C-N-CA 122.312 2.008 . . . . 2.8199999999999998 109.892 179.836 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 323' ' ' LEU . . . . . . . . . . . . . 20.7 mt -80.98 123.37 28.28 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.291 -0.881 . . . . 2.8399999999999999 109.685 179.905 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 324' ' ' ASP . . . . . . . . . . . . . 5.0 m-20 -81.62 -149.21 0.07 Allowed 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.282 -0.887 . . . . 1.53 109.195 179.596 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 325' ' ' GLY . . . . . . . . . . . . . . . -65.12 -177.67 6.33 Favored Glycine 0 N--CA 1.489 2.208 0 N-CA-C 109.628 -1.389 . . . . 0.58999999999999997 109.628 -179.941 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 326' ' ' GLU . . . . . . . . . . . . . 3.8 mt-10 -57.93 -173.34 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.389 -1.065 . . . . 2.1299999999999999 109.619 -179.78 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 327' ' ' TYR . . . . . 0.583 ' CE1' ' CG ' ' D' ' 333' ' ' ARG . 44.7 m-85 -149.55 112.11 4.75 Favored 'General case' 0 N--CA 1.488 1.443 0 O-C-N 121.105 -0.997 . . . . 0.47999999999999998 109.651 -179.907 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 328' ' ' PHE . . . . . . . . . . . . . 80.4 m-85 -113.02 -170.88 1.76 Allowed 'General case' 0 C--N 1.303 -1.444 0 O-C-N 121.27 -0.894 . . . . 0.32000000000000001 109.462 -179.67 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 329' ' ' THR . . . . . 0.413 ' HA ' ' O ' ' D' ' 330' ' ' LEU . 43.6 p -153.61 169.83 22.3 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.25 -0.906 . . . . 0.23000000000000001 109.381 -179.689 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 330' ' ' LEU . . . . . 0.542 HD11 HD22 ' D' ' 345' ' ' ASN . 32.8 tp -152.7 128.83 10.43 Favored 'General case' 0 N--CA 1.489 1.479 0 O-C-N 121.021 -1.049 . . . . 0.28000000000000003 110.198 -179.991 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 331' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -87.58 109.89 19.97 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.404 -0.81 . . . . 0.91000000000000003 108.863 179.131 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 332' ' ' ILE . . . . . . . . . . . . . 20.4 mt -103.24 105.23 17.9 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.488 0 O-C-N 121.157 -0.964 . . . . 0.23999999999999999 109.876 -179.63 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 333' ' ' ARG . . . . . 0.577 ' CG ' ' CE1' ' D' ' 327' ' ' TYR . 0.0 OUTLIER -72.46 151.86 42.29 Favored 'General case' 0 N--CA 1.489 1.486 0 O-C-N 121.324 -0.86 . . . . 2.9300000000000002 109.241 179.735 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' B' B ' 334' ' ' GLY . . . . . . . . . . . . . . . 77.57 128.86 0.42 Allowed Glycine 0 N--CA 1.489 2.175 0 N-CA-C 109.837 -1.305 . . . . 0.40000000000000002 109.837 179.935 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 335' ' ' ARG . . . . . . . . . . . . . 9.3 ttm180 -78.89 -27.05 43.91 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.473 -1.016 . . . . 3.0099999999999998 109.739 -179.917 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 336' ' ' GLU . . . . . . . . . . . . . 18.1 mt-10 -57.48 -68.21 0.26 Allowed 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.205 -0.935 . . . . 2.2799999999999998 109.805 -179.632 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 337' ' ' ARG . . . . . . . . . . . . . 5.7 mpt_? -60.13 -29.42 68.62 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.251 -0.906 . . . . 2.9300000000000002 109.584 -179.844 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 338' ' ' PHE . . . . . . . . . . . . . 69.1 t80 -54.03 -58.25 8.02 Favored 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.317 -0.864 . . . . 0.37 109.608 -179.774 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 339' ' ' GLU . . . . . . . . . . . . . 58.0 mt-10 -51.44 -34.43 35.12 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.381 -0.824 . . . . 1.98 110.2 -179.594 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 340' ' ' MET . . . . . . . . . . . . . 52.0 ttp -65.05 -49.74 68.9 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.204 -0.935 . . . . 0.32000000000000001 110.485 -179.258 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 341' ' ' PHE . . . . . . . . . . . . . 56.4 m-85 -62.1 -40.43 95.85 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.144 -0.972 . . . . 0.17999999999999999 109.942 -179.343 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 342' ' ' ARG . . . . . . . . . . . . . 23.8 ttt180 -50.66 -47.51 58.62 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.217 -0.927 . . . . 2.4199999999999999 110.18 -179.596 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 343' ' ' GLU . . . . . . . . . . . . . 11.8 tp10 -59.96 -42.42 94.07 Favored 'General case' 0 N--CA 1.494 1.759 0 O-C-N 121.218 -0.927 . . . . 2.3500000000000001 110.142 -179.304 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 344' ' ' LEU . . . . . . . . . . . . . 45.2 mt -62.21 -37.1 84.06 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.106 -0.996 . . . . 0.17999999999999999 110.039 -179.5 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 345' ' ' ASN . . . . . 0.54 HD22 HD11 ' D' ' 330' ' ' LEU . 50.8 t-20 -58.17 -53.58 56.61 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.155 -0.965 . . . . 1.0900000000000001 110.008 -179.618 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 346' ' ' GLU . . . . . . . . . . . . . 1.2 tt0 -61.27 -31.2 71.02 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.249 -0.907 . . . . 1.6599999999999999 109.789 -179.611 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 347' ' ' ALA . . . . . 0.949 ' HB1' ' HB1' ' A' ' 347' ' ' ALA . . . -61.14 -57.67 11.54 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.216 -0.928 . . . . 0.17000000000000001 110.308 -179.525 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 348' ' ' LEU . . . . . 0.53 HD22 ' N ' ' B' ' 348' ' ' LEU . 3.8 mm? -60.96 -45.16 95.84 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.257 -0.902 . . . . 0.28999999999999998 110.127 -179.412 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 349' ' ' GLU . . . . . . . . . . . . . 77.9 mt-10 -57.99 -35.36 71.1 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.11 -0.994 . . . . 1.95 110.056 -179.482 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 350' ' ' LEU . . . . . 0.735 HD13 HD22 ' A' ' 350' ' ' LEU . 6.9 tt -63.28 -48.29 78.74 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.145 -0.972 . . . . 0.45000000000000001 109.451 -179.828 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 351' ' ' LYS . . . . . . . . . . . . . 45.9 tttm -59.24 -42.34 90.87 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.275 -0.89 . . . . 1.3799999999999999 109.835 -179.734 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 352' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -58.63 -37.88 76.87 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.167 -0.958 . . . . 1.1599999999999999 109.668 -179.982 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 353' ' ' ALA . . . . . . . . . . . . . . . -67.84 -22.17 65.15 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.362 -0.836 . . . . 0.60999999999999999 109.728 -179.386 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 354' ' ' GLN . . . . . . . . . . . . . 8.5 mt-30 -82.99 -15.69 50.19 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.148 -0.97 . . . . 1.45 109.471 -179.844 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 355' ' ' ALA . . . . . . . . . . . . . . . -73.72 -2.52 23.66 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.213 -0.93 . . . . 0.97999999999999998 109.737 179.873 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 356' ' ' GLY . . . . . . . . . . . . . . . -79.77 -7.95 88.09 Favored Glycine 0 N--CA 1.491 2.359 0 N-CA-C 109.705 -1.358 . . . . 1.29 109.705 -179.747 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 357' ' ' LYS . . . . . . . . . . . . . 32.1 mttp -86.8 135.82 33.21 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.175 -1.191 . . . . 4.0899999999999999 109.006 179.459 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 358' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -47.78 157.37 0.61 Allowed Pre-proline 0 N--CA 1.491 1.625 0 O-C-N 121.158 -0.964 . . . . 5.7199999999999998 109.683 -179.597 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 359' ' ' PRO . . . . . . . . . . . . . 2.4 Cg_endo -62.27 -177.76 0.3 Allowed 'Trans proline' 0 C--N 1.311 -1.41 0 C-N-CA 122.316 2.01 . . . . 4.9800000000000004 109.842 179.951 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 360' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.172 0 N-CA-C 109.332 -1.507 . . . . 6.9800000000000004 109.332 179.989 . . . . . . . . 0 0 . 1 . 019 nuclear build full ' C' C ' 319' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.491 1.583 0 CA-C-O 121.345 0.593 . . . . 6.8200000000000003 109.661 . . . . . . . . . 1 1 . 1 . 019 nuclear build full ' C' C ' 320' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -81.45 168.9 17.8 Favored 'General case' 0 N--CA 1.488 1.456 0 O-C-N 121.296 -0.877 . . . . 6.4900000000000002 109.229 179.816 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' C' C ' 321' ' ' LYS . . . . . 0.405 ' O ' ' O ' ' C' ' 322' ' ' PRO . 0.0 OUTLIER -157.71 87.44 2.54 Favored Pre-proline 0 C--N 1.301 -1.53 0 O-C-N 121.416 -0.802 . . . . 6.4000000000000004 109.101 179.89 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' C' C ' 322' ' ' PRO . . . . . 0.405 ' O ' ' O ' ' C' ' 321' ' ' LYS . 5.0 Cg_exo -58.1 -151.71 0.01 OUTLIER 'Trans proline' 0 C--N 1.308 -1.553 0 C-N-CA 122.065 1.843 . . . . 3.4199999999999999 109.953 -179.995 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' C' C ' 323' ' ' LEU . . . . . . . . . . . . . 14.3 mt -78.96 141.37 37.59 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.163 -0.961 . . . . 3.9500000000000002 109.446 -179.974 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' C' C ' 324' ' ' ASP . . . . . 0.521 ' CB ' ' OH ' ' C' ' 327' ' ' TYR . 4.5 m-20 -78.73 155.49 29.35 Favored 'General case' 0 N--CA 1.489 1.495 0 O-C-N 121.279 -0.888 . . . . 1.6299999999999999 109.563 -179.662 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' C' C ' 325' ' ' GLY . . . . . 0.438 ' O ' ' O ' ' C' ' 326' ' ' GLU . . . -67.55 -177.18 10.17 Favored Glycine 0 N--CA 1.49 2.29 0 N-CA-C 109.106 -1.598 . . . . 0.72999999999999998 109.106 179.704 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' C' C ' 326' ' ' GLU . . . . . 0.438 ' O ' ' O ' ' C' ' 325' ' ' GLY . 16.7 mt-10 -55.98 -168.98 0.0 OUTLIER 'General case' 0 N--CA 1.489 1.475 0 O-C-N 121.079 -1.248 . . . . 2.1699999999999999 108.884 179.862 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' C' C ' 327' ' ' TYR . . . . . 0.629 ' CE1' ' CG ' ' A' ' 333' ' ' ARG . 43.8 m-85 -149.72 113.63 5.1 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.025 -1.047 . . . . 0.47999999999999998 109.827 -179.824 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' C' C ' 328' ' ' PHE . . . . . . . . . . . . . 97.6 m-85 -113.03 -166.53 1.09 Allowed 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.162 -0.961 . . . . 0.33000000000000002 109.726 179.718 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' C' C ' 329' ' ' THR . . . . . 0.405 ' HA ' ' O ' ' A' ' 330' ' ' LEU . 27.2 p -153.32 167.14 30.37 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.212 -0.93 . . . . 0.23000000000000001 109.564 -179.721 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' C' C ' 330' ' ' LEU . . . . . 0.552 HD11 HD22 ' A' ' 345' ' ' ASN . 18.4 tp -150.26 124.93 9.72 Favored 'General case' 0 N--CA 1.488 1.43 0 O-C-N 121.194 -0.941 . . . . 0.28000000000000003 109.707 -179.727 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' C' C ' 331' ' ' GLN . . . . . 0.481 ' OE1' ' O ' ' A' ' 328' ' ' PHE . 7.2 tp-100 -89.23 109.01 19.94 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.245 -0.91 . . . . 1.48 109.14 179.794 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' C' C ' 332' ' ' ILE . . . . . 0.433 HD13 ' CD2' ' C' ' 341' ' ' PHE . 93.9 mt -102.78 113.75 40.35 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.647 0 O-C-N 121.081 -1.012 . . . . 0.23999999999999999 109.737 -179.722 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' C' C ' 333' ' ' ARG . . . . . 0.449 ' HG2' ' CE1' ' A' ' 327' ' ' TYR . 0.6 OUTLIER -73.53 148.75 42.77 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.295 -0.878 . . . . 2.7400000000000002 109.6 179.81 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' C' C ' 334' ' ' GLY . . . . . . . . . . . . . . . 70.89 134.57 0.11 Allowed Glycine 0 N--CA 1.492 2.385 0 N-CA-C 109.677 -1.369 . . . . 0.34999999999999998 109.677 179.958 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' C' C ' 335' ' ' ARG . . . . . 0.55 ' NH1' ' HG2' ' C' ' 335' ' ' ARG . 0.0 OUTLIER -75.34 -26.33 58.51 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.329 -1.1 . . . . 2.5299999999999998 109.622 -179.985 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' C' C ' 336' ' ' GLU . . . . . . . . . . . . . 9.2 tt0 -54.2 -65.06 0.64 Allowed 'General case' 0 C--N 1.301 -1.535 0 O-C-N 121.192 -0.943 . . . . 2.6200000000000001 109.561 -179.509 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' C' C ' 337' ' ' ARG . . . . . 0.515 ' CZ ' ' OD2' ' A' ' 352' ' ' ASP . 2.0 mpt_? -59.58 -28.45 67.16 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.259 -0.9 . . . . 2.8100000000000001 109.206 179.874 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' C' C ' 338' ' ' PHE . . . . . 0.474 ' HB3' ' O ' ' C' ' 335' ' ' ARG . 84.5 t80 -56.53 -64.54 0.83 Allowed 'General case' 0 N--CA 1.489 1.5 0 O-C-N 121.451 -0.781 . . . . 0.40000000000000002 110.026 -179.813 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' C' C ' 339' ' ' GLU . . . . . 0.458 ' OE2' ' HG2' ' C' ' 335' ' ' ARG . 10.6 mt-10 -48.66 -37.0 17.24 Favored 'General case' 0 N--CA 1.495 1.802 0 O-C-N 121.132 -0.98 . . . . 2.0499999999999998 110.398 -179.45 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' C' C ' 340' ' ' MET . . . . . . . . . . . . . 30.9 ttp -61.46 -49.63 76.04 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.054 -1.029 . . . . 0.32000000000000001 109.727 -179.542 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' C' C ' 341' ' ' PHE . . . . . 0.433 ' CD2' HD13 ' C' ' 332' ' ' ILE . 44.2 m-85 -64.16 -41.1 97.29 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.207 -0.933 . . . . 0.17999999999999999 110.161 -179.79 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' C' C ' 342' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -52.47 -48.02 66.15 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.258 -0.901 . . . . 2.9100000000000001 110.032 -179.63 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' C' C ' 343' ' ' GLU . . . . . . . . . . . . . 14.4 tt0 -57.76 -45.93 85.23 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.345 -0.847 . . . . 2.1400000000000001 110.063 -179.593 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' C' C ' 344' ' ' LEU . . . . . 0.432 ' O ' HD23 ' C' ' 348' ' ' LEU . 94.6 mt -63.06 -33.69 75.98 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.09 -1.006 . . . . 0.22 109.693 -179.729 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' C' C ' 345' ' ' ASN . . . . . 0.497 HD22 HD11 ' A' ' 330' ' ' LEU . 50.5 t-20 -59.48 -56.82 17.11 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.126 -0.984 . . . . 1.0800000000000001 109.498 -179.995 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' C' C ' 346' ' ' GLU . . . . . . . . . . . . . 5.9 tp10 -61.97 -26.71 68.37 Favored 'General case' 0 C--N 1.302 -1.475 0 O-C-N 121.202 -0.936 . . . . 2.21 109.515 179.942 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' C' C ' 347' ' ' ALA . . . . . 0.96 ' HB1' ' HB1' ' D' ' 347' ' ' ALA . . . -64.07 -61.27 2.37 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.214 -0.929 . . . . 0.17999999999999999 110.041 -179.799 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' C' C ' 348' ' ' LEU . . . . . 0.585 ' N ' HD22 ' C' ' 348' ' ' LEU . 3.9 mm? -60.5 -50.53 73.18 Favored 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.319 -0.863 . . . . 0.32000000000000001 110.241 -179.051 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' C' C ' 349' ' ' GLU . . . . . . . . . . . . . 16.0 mm-40 -58.87 -34.52 71.71 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.233 -0.917 . . . . 2.1899999999999999 109.998 -179.406 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' C' C ' 350' ' ' LEU . . . . . 0.74 HD21 HD22 ' D' ' 350' ' ' LEU . 3.5 tt -64.66 -37.97 89.39 Favored 'General case' 0 C--N 1.302 -1.493 0 O-C-N 121.049 -1.032 . . . . 0.46000000000000002 109.378 -179.942 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' C' C ' 351' ' ' LYS . . . . . 0.446 ' HE2' ' OE2' ' D' ' 343' ' ' GLU . 11.3 tttp -58.55 -40.2 82.37 Favored 'General case' 0 N--CA 1.488 1.455 0 O-C-N 121.254 -0.904 . . . . 1.3500000000000001 108.884 179.752 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' C' C ' 352' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 -56.63 -43.75 80.57 Favored 'General case' 0 C--N 1.304 -1.403 0 O-C-N 121.432 -0.792 . . . . 1.1899999999999999 109.423 179.612 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' C' C ' 353' ' ' ALA . . . . . . . . . . . . . . . -69.59 -22.4 63.52 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.379 -0.825 . . . . 0.56999999999999995 110.047 -179.764 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' C' C ' 354' ' ' GLN . . . . . 0.405 ' CD ' HD11 ' D' ' 350' ' ' LEU . 50.8 tt0 -82.4 -6.5 59.32 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.108 -0.995 . . . . 1.47 109.684 -179.675 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' C' C ' 355' ' ' ALA . . . . . . . . . . . . . . . -70.04 -38.36 75.81 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.223 -0.923 . . . . 0.93000000000000005 109.398 179.977 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' C' C ' 356' ' ' GLY . . . . . . . . . . . . . . . -80.77 7.27 59.3 Favored Glycine 0 N--CA 1.492 2.39 0 N-CA-C 110.351 -1.1 . . . . 1.3300000000000001 110.351 -179.675 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' C' C ' 357' ' ' LYS . . . . . 0.435 ' O ' ' HD3' ' C' ' 359' ' ' PRO . 11.4 mmtm -84.28 -172.05 3.95 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 120.917 -1.343 . . . . 4.0099999999999998 109.571 -179.705 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' C' C ' 358' ' ' GLU . . . . . . . . . . . . . 24.3 mt-10 -47.81 106.77 0.64 Allowed Pre-proline 0 N--CA 1.49 1.53 0 O-C-N 121.296 -0.877 . . . . 5.75 109.537 -179.83 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' C' C ' 359' ' ' PRO . . . . . 0.435 ' HD3' ' O ' ' C' ' 357' ' ' LYS . 4.9 Cg_exo -60.47 -151.9 0.01 OUTLIER 'Trans proline' 0 C--N 1.31 -1.45 0 C-N-CA 122.114 1.876 . . . . 4.9400000000000004 110.085 179.927 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' C' C ' 360' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.21 0 N-CA-C 109.53 -1.428 . . . . 6.5 109.53 -179.955 . . . . . . . . 0 0 . 1 . 019 nuclear build full ' D' D ' 319' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 N--CA 1.489 1.508 0 N-CA-C 109.469 -0.567 . . . . 7.5300000000000002 109.469 . . . . . . . . . 1 1 . 1 . 019 nuclear build full ' D' D ' 320' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 62.94 -153.92 0.34 Allowed 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.096 -1.002 . . . . 6.4100000000000001 109.502 -179.999 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' D' D ' 321' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -81.01 146.51 59.24 Favored Pre-proline 0 N--CA 1.491 1.61 0 O-C-N 121.258 -0.901 . . . . 6.1100000000000003 109.504 -179.937 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' D' D ' 322' ' ' PRO . . . . . . . . . . . . . 1.8 Cg_endo -67.37 -81.04 0.01 OUTLIER 'Trans proline' 0 C--N 1.308 -1.563 0 C-N-CA 122.309 2.006 . . . . 2.8199999999999998 109.543 179.649 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' D' D ' 323' ' ' LEU . . . . . . . . . . . . . 17.1 mt -80.53 123.62 28.25 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.414 -0.804 . . . . 2.8300000000000001 109.867 -179.85 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' D' D ' 324' ' ' ASP . . . . . . . . . . . . . 4.1 m-20 -81.55 -147.43 0.07 Allowed 'General case' 0 N--CA 1.488 1.451 0 O-C-N 121.301 -0.874 . . . . 1.54 109.198 179.547 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' D' D ' 325' ' ' GLY . . . . . . . . . . . . . . . -67.67 -175.2 8.26 Favored Glycine 0 N--CA 1.49 2.257 0 N-CA-C 109.737 -1.345 . . . . 0.58999999999999997 109.737 -179.706 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' D' D ' 326' ' ' GLU . . . . . . . . . . . . . 3.4 mt-10 -58.65 -175.02 0.02 OUTLIER 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.325 -1.103 . . . . 2.1299999999999999 109.765 -179.866 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' D' D ' 327' ' ' TYR . . . . . 0.577 ' CE1' ' CG ' ' B' ' 333' ' ' ARG . 44.6 m-85 -149.03 112.26 4.94 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.446 -0.784 . . . . 0.46999999999999997 109.476 -179.937 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' D' D ' 328' ' ' PHE . . . . . . . . . . . . . 83.0 m-85 -113.49 -170.85 1.77 Allowed 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.317 -0.864 . . . . 0.29999999999999999 109.426 -179.841 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' D' D ' 329' ' ' THR . . . . . . . . . . . . . 38.6 p -153.4 169.37 23.3 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.241 -0.912 . . . . 0.22 109.598 -179.864 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' D' D ' 330' ' ' LEU . . . . . 0.54 HD11 HD22 ' B' ' 345' ' ' ASN . 33.5 tp -152.56 128.89 10.56 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.228 -0.92 . . . . 0.28000000000000003 110.267 179.968 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' D' D ' 331' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -88.27 109.21 19.77 Favored 'General case' 0 N--CA 1.491 1.602 0 N-CA-C 108.806 -0.813 . . . . 0.93000000000000005 108.806 179.125 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' D' D ' 332' ' ' ILE . . . . . . . . . . . . . 20.2 mt -102.18 104.98 17.24 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.495 0 O-C-N 121.146 -0.971 . . . . 0.25 109.817 -179.646 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' D' D ' 333' ' ' ARG . . . . . 0.583 ' CG ' ' CE1' ' B' ' 327' ' ' TYR . 0.0 OUTLIER -72.23 151.87 42.58 Favored 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.323 -0.861 . . . . 2.9300000000000002 109.141 179.553 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' D' D ' 334' ' ' GLY . . . . . . . . . . . . . . . 78.23 128.57 0.48 Allowed Glycine 0 N--CA 1.49 2.258 0 N-CA-C 109.689 -1.365 . . . . 0.40999999999999998 109.689 179.963 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' D' D ' 335' ' ' ARG . . . . . . . . . . . . . 8.8 ttm180 -78.99 -28.25 43.45 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.414 -1.05 . . . . 3.0299999999999998 109.858 -179.903 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' D' D ' 336' ' ' GLU . . . . . . . . . . . . . 12.8 mt-10 -57.08 -68.05 0.26 Allowed 'General case' 0 N--CA 1.495 1.786 0 O-C-N 121.301 -0.874 . . . . 2.2599999999999998 109.772 -179.551 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' D' D ' 337' ' ' ARG . . . . . . . . . . . . . 5.8 mpt_? -59.87 -29.98 68.69 Favored 'General case' 0 N--CA 1.488 1.446 0 O-C-N 121.271 -0.893 . . . . 2.9199999999999999 109.665 -179.81 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' D' D ' 338' ' ' PHE . . . . . . . . . . . . . 70.5 t80 -54.09 -58.59 6.76 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.256 -0.902 . . . . 0.37 109.566 -179.88 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' D' D ' 339' ' ' GLU . . . . . . . . . . . . . 55.3 mt-10 -51.05 -34.81 31.39 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.333 -0.854 . . . . 1.99 110.059 -179.721 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' D' D ' 340' ' ' MET . . . . . . . . . . . . . 51.9 ttp -64.64 -49.42 71.11 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.156 -0.965 . . . . 0.31 110.26 -179.116 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' D' D ' 341' ' ' PHE . . . . . 0.426 ' HA ' HD12 ' D' ' 344' ' ' LEU . 55.8 m-85 -62.25 -42.82 99.66 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.073 -1.017 . . . . 0.17999999999999999 110.125 -179.403 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' D' D ' 342' ' ' ARG . . . . . . . . . . . . . 23.2 ttt180 -48.8 -47.03 42.43 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.183 -0.948 . . . . 2.4100000000000001 110.166 -179.705 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' D' D ' 343' ' ' GLU . . . . . 0.446 ' OE2' ' HE2' ' C' ' 351' ' ' LYS . 13.9 tp10 -60.05 -42.8 95.26 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.04 -1.038 . . . . 2.3500000000000001 110.012 -179.447 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' D' D ' 344' ' ' LEU . . . . . 0.426 HD12 ' HA ' ' D' ' 341' ' ' PHE . 38.0 mt -61.68 -37.38 83.9 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.128 -0.982 . . . . 0.19 109.956 -179.476 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' D' D ' 345' ' ' ASN . . . . . 0.542 HD22 HD11 ' B' ' 330' ' ' LEU . 51.5 t-20 -58.17 -52.6 64.89 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.071 -1.018 . . . . 1.0900000000000001 109.935 -179.539 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' D' D ' 346' ' ' GLU . . . . . . . . . . . . . 1.3 tt0 -61.44 -32.11 72.07 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.21 -0.931 . . . . 1.6899999999999999 109.862 -179.65 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' D' D ' 347' ' ' ALA . . . . . 0.96 ' HB1' ' HB1' ' C' ' 347' ' ' ALA . . . -60.87 -57.73 11.43 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.219 -0.926 . . . . 0.17999999999999999 110.249 -179.7 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' D' D ' 348' ' ' LEU . . . . . 0.544 HD22 ' N ' ' D' ' 348' ' ' LEU . 3.7 mm? -60.99 -44.24 97.69 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.077 -1.014 . . . . 0.31 110.038 -179.301 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' D' D ' 349' ' ' GLU . . . . . . . . . . . . . 71.8 mt-10 -58.51 -35.01 71.59 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.043 -1.036 . . . . 1.95 110.075 -179.32 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' D' D ' 350' ' ' LEU . . . . . 0.74 HD22 HD21 ' C' ' 350' ' ' LEU . 6.6 tt -63.75 -48.01 78.71 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.011 -1.056 . . . . 0.42999999999999999 109.594 -179.796 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' D' D ' 351' ' ' LYS . . . . . . . . . . . . . 48.4 tttm -58.55 -42.91 88.94 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.32 -0.862 . . . . 1.3999999999999999 109.715 -179.835 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' D' D ' 352' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -58.58 -37.03 74.91 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.093 -1.004 . . . . 1.1699999999999999 109.698 -179.977 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' D' D ' 353' ' ' ALA . . . . . . . . . . . . . . . -68.1 -22.65 64.89 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.204 -0.935 . . . . 0.58999999999999997 110.003 -179.5 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' D' D ' 354' ' ' GLN . . . . . . . . . . . . . 9.5 mt-30 -83.85 -15.34 48.56 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.107 -0.996 . . . . 1.4399999999999999 109.677 -179.707 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' D' D ' 355' ' ' ALA . . . . . . . . . . . . . . . -73.49 -3.0 24.9 Favored 'General case' 0 N--CA 1.489 1.525 0 O-C-N 121.127 -0.983 . . . . 0.97999999999999998 109.494 179.707 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' D' D ' 356' ' ' GLY . . . . . . . . . . . . . . . -79.99 -7.13 88.78 Favored Glycine 0 N--CA 1.49 2.269 0 N-CA-C 109.891 -1.284 . . . . 1.28 109.891 -179.656 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' D' D ' 357' ' ' LYS . . . . . . . . . . . . . 32.2 mttp -87.65 135.72 33.25 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.005 -1.291 . . . . 4.0899999999999999 109.059 179.693 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' D' D ' 358' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -47.62 154.95 0.82 Allowed Pre-proline 0 N--CA 1.492 1.632 0 O-C-N 121.089 -1.007 . . . . 5.71 109.755 -179.492 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' D' D ' 359' ' ' PRO . . . . . . . . . . . . . 1.9 Cg_endo -62.57 178.09 1.05 Allowed 'Trans proline' 0 C--N 1.31 -1.461 0 C-N-CA 122.235 1.957 . . . . 4.9699999999999998 110.321 179.955 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' D' D ' 360' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.243 0 CA-C-O 118.058 -1.412 . . . . 6.9699999999999998 109.735 179.981 . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 319' ' ' LYS . . . . . . . . . . . . . 21.1 mttt . . . . . 0 N--CA 1.49 1.551 0 N-CA-C 109.495 -0.557 . . . . 7.5499999999999998 109.495 . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 320' ' ' LYS . . . . . . . . . . . . . 1.2 mttt 59.85 163.81 0.05 Allowed 'General case' 0 C--N 1.301 -1.524 0 O-C-N 121.416 -0.803 . . . . 6.4299999999999997 109.597 179.779 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 321' ' ' LYS . . . . . . . . . . . . . 3.1 mttt -156.87 99.22 2.02 Favored Pre-proline 0 N--CA 1.488 1.471 0 O-C-N 121.277 -0.889 . . . . 6.1299999999999999 108.932 -179.858 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 322' ' ' PRO . . . . . . . . . . . . . 1.8 Cg_endo -68.78 5.28 1.39 Allowed 'Trans proline' 0 C--N 1.311 -1.422 0 C-N-CA 122.27 1.98 . . . . 2.8300000000000001 111.44 -179.778 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 323' ' ' LEU . . . . . 0.486 HD23 ' HA ' ' A' ' 323' ' ' LEU . 19.7 mt -82.42 36.32 0.47 Allowed 'General case' 0 N--CA 1.491 1.595 0 O-C-N 120.668 -1.27 . . . . 2.8300000000000001 110.014 -179.856 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 324' ' ' ASP . . . . . . . . . . . . . 7.0 m-20 -84.91 -153.27 0.16 Allowed 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.103 -0.998 . . . . 1.53 109.588 -179.965 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 325' ' ' GLY . . . . . 0.447 ' O ' ' CE2' ' A' ' 327' ' ' TYR . . . -68.57 176.64 27.8 Favored Glycine 0 N--CA 1.486 1.968 0 N-CA-C 109.572 -1.411 . . . . 0.60999999999999999 109.572 179.611 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 326' ' ' GLU . . . . . . . . . . . . . 2.1 mm-40 -58.27 175.89 0.2 Allowed 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.341 -1.093 . . . . 2.1299999999999999 109.14 179.632 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 327' ' ' TYR . . . . . 0.607 ' CE1' ' HG3' ' C' ' 333' ' ' ARG . 51.0 m-85 -148.5 108.9 4.14 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.408 -0.808 . . . . 0.47999999999999998 109.411 -179.829 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 328' ' ' PHE . . . . . 0.443 ' O ' HG23 ' A' ' 329' ' ' THR . 83.4 m-85 -113.42 -165.97 1.05 Allowed 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.414 -0.804 . . . . 0.31 109.592 179.98 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 329' ' ' THR . . . . . 0.443 HG23 ' O ' ' A' ' 328' ' ' PHE . 22.2 p -154.75 167.68 29.38 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.295 -0.878 . . . . 0.22 109.432 -179.839 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 330' ' ' LEU . . . . . . . . . . . . . 25.0 tp -150.49 127.05 10.83 Favored 'General case' 0 C--N 1.302 -1.5 0 O-C-N 121.248 -0.907 . . . . 0.28000000000000003 109.917 -179.787 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 331' ' ' GLN . . . . . . . . . . . . . 1.2 tp60 -86.32 108.4 18.41 Favored 'General case' 0 C--N 1.303 -1.451 0 O-C-N 121.257 -0.902 . . . . 0.91000000000000003 108.854 179.144 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 332' ' ' ILE . . . . . 0.423 HG21 ' CD2' ' A' ' 341' ' ' PHE . 21.1 mt -102.83 112.94 38.04 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.516 0 O-C-N 121.311 -0.868 . . . . 0.26000000000000001 109.509 -179.802 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 333' ' ' ARG . . . . . 0.406 ' HG2' ' CE2' ' C' ' 327' ' ' TYR . 54.9 mtm180 -72.84 154.91 40.41 Favored 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.491 -0.756 . . . . 2.9199999999999999 109.535 179.845 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 334' ' ' GLY . . . . . . . . . . . . . . . 75.98 129.28 0.29 Allowed Glycine 0 N--CA 1.49 2.254 0 N-CA-C 109.728 -1.349 . . . . 0.40000000000000002 109.728 179.868 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 335' ' ' ARG . . . . . 0.568 ' HB2' ' CZ ' ' C' ' 328' ' ' PHE . 31.3 ttp180 -78.91 -32.45 45.69 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.107 -1.231 . . . . 3.0099999999999998 109.305 179.705 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 336' ' ' GLU . . . . . . . . . . . . . 1.9 tt0 -57.48 -62.99 1.39 Allowed 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.34 -0.85 . . . . 2.29 109.634 -179.799 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 337' ' ' ARG . . . . . 0.461 ' CG ' ' NH1' ' A' ' 337' ' ' ARG . 0.0 OUTLIER -59.2 -29.05 67.2 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.257 -0.902 . . . . 2.9300000000000002 109.446 -179.651 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 338' ' ' PHE . . . . . 0.444 ' HB3' ' O ' ' A' ' 335' ' ' ARG . 75.5 t80 -54.76 -57.19 12.51 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.37 -0.831 . . . . 0.38 109.833 -179.872 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 339' ' ' GLU . . . . . . . . . . . . . 3.2 mt-10 -52.27 -33.47 42.08 Favored 'General case' 0 N--CA 1.493 1.692 0 O-C-N 121.205 -0.934 . . . . 1.97 109.678 -179.757 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 340' ' ' MET . . . . . . . . . . . . . 31.0 ttp -63.27 -50.2 71.08 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.482 -0.761 . . . . 0.31 109.947 -179.753 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 341' ' ' PHE . . . . . 0.423 ' CD2' HG21 ' A' ' 332' ' ' ILE . 52.4 m-85 -62.46 -44.24 96.88 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.147 -0.97 . . . . 0.17999999999999999 109.792 -179.733 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 342' ' ' ARG . . . . . 0.446 ' CG ' HH11 ' A' ' 342' ' ' ARG . 0.1 OUTLIER -51.82 -43.16 63.01 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.319 -0.863 . . . . 2.4199999999999999 109.866 -179.885 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 343' ' ' GLU . . . . . . . . . . . . . 1.8 tt0 -59.14 -48.37 81.86 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.254 -0.904 . . . . 2.3500000000000001 110.281 -179.597 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 344' ' ' LEU . . . . . 0.403 HD23 ' HA ' ' A' ' 344' ' ' LEU . 74.4 mt -62.07 -32.85 73.43 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.121 -0.987 . . . . 0.17999999999999999 109.244 -179.75 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 345' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -59.68 -52.35 65.87 Favored 'General case' 0 C--N 1.301 -1.523 0 O-C-N 121.364 -0.835 . . . . 1.0900000000000001 109.823 -179.908 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 346' ' ' GLU . . . . . . . . . . . . . 41.9 tt0 -62.44 -27.04 68.83 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.138 -0.976 . . . . 1.6499999999999999 109.568 -179.736 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 347' ' ' ALA . . . . . 0.852 ' HB1' ' HB1' ' B' ' 347' ' ' ALA . . . -62.44 -59.7 4.6 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.441 -0.787 . . . . 0.17999999999999999 109.941 -179.808 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 348' ' ' LEU . . . . . 0.589 HD22 ' N ' ' A' ' 348' ' ' LEU . 3.5 mm? -61.13 -44.03 97.96 Favored 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.144 -0.973 . . . . 0.29999999999999999 109.849 -179.753 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 349' ' ' GLU . . . . . . . . . . . . . 3.5 mm-40 -56.75 -36.32 69.64 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.056 -1.028 . . . . 1.9399999999999999 109.683 -179.753 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 350' ' ' LEU . . . . . 0.579 HD13 HD22 ' B' ' 350' ' ' LEU . 5.9 tt -62.9 -45.05 94.33 Favored 'General case' 0 N--CA 1.489 1.488 0 O-C-N 120.942 -1.099 . . . . 0.46000000000000002 109.354 -179.904 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 351' ' ' LYS . . . . . . . . . . . . . 30.0 tttt -57.88 -48.22 80.48 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.223 -0.923 . . . . 1.3999999999999999 109.584 -179.843 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 352' ' ' ASP . . . . . . . . . . . . . 62.4 m-20 -59.88 -39.03 83.91 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.254 -0.904 . . . . 1.1599999999999999 109.818 -179.809 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 353' ' ' ALA . . . . . . . . . . . . . . . -67.48 -18.16 64.96 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.296 -0.878 . . . . 0.63 110.038 -179.372 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 354' ' ' GLN . . . . . . . . . . . . . 4.1 mt-30 -85.33 -20.35 30.1 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.268 -0.895 . . . . 1.47 109.531 -179.985 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 355' ' ' ALA . . . . . . . . . . . . . . . -73.31 -8.31 55.29 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.215 -0.928 . . . . 1.01 109.425 179.804 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 356' ' ' GLY . . . . . . . . . . . . . . . -79.21 -4.23 88.82 Favored Glycine 0 N--CA 1.493 2.439 0 N-CA-C 109.606 -1.397 . . . . 1.3 109.606 -179.776 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 357' ' ' LYS . . . . . . . . . . . . . 7.2 tttt -83.88 163.12 20.26 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.247 -1.149 . . . . 4.0999999999999996 109.344 -179.946 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 358' ' ' GLU . . . . . . . . . . . . . 8.2 pt-20 -53.29 147.61 18.36 Favored Pre-proline 0 N--CA 1.493 1.676 0 O-C-N 121.239 -0.913 . . . . 5.75 109.805 -179.988 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 359' ' ' PRO . . . . . . . . . . . . . 1.6 Cg_endo -62.9 -159.21 0.03 OUTLIER 'Trans proline' 0 C--N 1.31 -1.466 0 C-N-CA 122.328 2.019 . . . . 5.0 109.511 179.58 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 360' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.486 1.983 0 CA-C-O 117.928 -1.484 . . . . 6.9699999999999998 109.624 179.8 . . . . . . . . 0 0 . 1 . 020 nuclear build full ' B' B ' 319' ' ' LYS . . . . . . . . . . . . . 22.3 mttt . . . . . 0 N--CA 1.49 1.562 0 CA-C-O 121.344 0.592 . . . . 7.5499999999999998 109.478 . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' B' B ' 320' ' ' LYS . . . . . . . . . . . . . 1.2 mttt 59.85 165.22 0.06 Allowed 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.429 -0.794 . . . . 6.4400000000000004 109.565 179.955 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 321' ' ' LYS . . . . . . . . . . . . . 2.9 mttt -155.57 100.47 2.22 Favored Pre-proline 0 N--CA 1.489 1.484 0 O-C-N 121.271 -0.893 . . . . 6.1299999999999999 109.233 179.799 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 322' ' ' PRO . . . . . . . . . . . . . 1.8 Cg_endo -68.43 4.34 1.71 Allowed 'Trans proline' 0 C--N 1.312 -1.358 0 C-N-CA 122.419 2.079 . . . . 2.8199999999999998 111.119 -179.867 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 323' ' ' LEU . . . . . 0.476 ' HA ' HD23 ' B' ' 323' ' ' LEU . 17.2 mt -81.85 35.23 0.41 Allowed 'General case' 0 N--CA 1.49 1.552 0 O-C-N 120.772 -1.205 . . . . 2.8399999999999999 110.116 179.936 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 324' ' ' ASP . . . . . . . . . . . . . 9.0 m-20 -83.29 -154.62 0.15 Allowed 'General case' 0 C--N 1.305 -1.345 0 O-C-N 120.849 -1.157 . . . . 1.53 109.12 179.757 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 325' ' ' GLY . . . . . 0.441 ' O ' ' CE2' ' B' ' 327' ' ' TYR . . . -68.59 179.21 22.18 Favored Glycine 0 N--CA 1.491 2.327 0 N-CA-C 109.633 -1.387 . . . . 0.58999999999999997 109.633 179.711 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 326' ' ' GLU . . . . . . . . . . . . . 2.2 mm-40 -59.93 176.35 0.31 Allowed 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.318 -1.107 . . . . 2.1299999999999999 109.659 -179.888 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 327' ' ' TYR . . . . . 0.441 ' CE2' ' O ' ' B' ' 325' ' ' GLY . 51.3 m-85 -148.84 109.27 4.17 Favored 'General case' 0 C--N 1.301 -1.531 0 O-C-N 120.998 -1.064 . . . . 0.47999999999999998 109.388 -179.997 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 328' ' ' PHE . . . . . 0.439 ' CE2' ' HB2' ' D' ' 335' ' ' ARG . 79.3 m-85 -113.62 -167.89 1.27 Allowed 'General case' 0 N--CA 1.488 1.443 0 O-C-N 121.217 -0.927 . . . . 0.32000000000000001 109.451 179.898 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 329' ' ' THR . . . . . 0.409 ' HA ' ' O ' ' D' ' 330' ' ' LEU . 27.4 p -152.57 167.25 29.48 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.505 -0.747 . . . . 0.23000000000000001 109.41 179.808 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 330' ' ' LEU . . . . . 0.416 ' O ' ' HA ' ' D' ' 329' ' ' THR . 30.7 tp -149.26 126.22 11.25 Favored 'General case' 0 N--CA 1.488 1.434 0 O-C-N 121.202 -0.936 . . . . 0.28000000000000003 109.817 -179.785 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 331' ' ' GLN . . . . . . . . . . . . . 1.4 tp60 -85.75 107.93 17.83 Favored 'General case' 0 C--N 1.304 -1.41 0 O-C-N 121.211 -0.931 . . . . 0.91000000000000003 108.773 179.325 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 332' ' ' ILE . . . . . . . . . . . . . 24.7 mt -103.17 113.96 41.43 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.493 0 O-C-N 121.094 -1.004 . . . . 0.23999999999999999 109.585 -179.417 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 333' ' ' ARG . . . . . . . . . . . . . 54.7 mtm180 -73.62 153.99 39.94 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.388 -0.82 . . . . 2.9300000000000002 109.648 179.85 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 334' ' ' GLY . . . . . . . . . . . . . . . 77.5 129.47 0.44 Allowed Glycine 0 N--CA 1.488 2.109 0 N-CA-C 109.834 -1.306 . . . . 0.40000000000000002 109.834 179.577 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 335' ' ' ARG . . . . . 0.413 ' O ' ' HB3' ' B' ' 338' ' ' PHE . 32.3 ttp180 -79.82 -32.78 40.67 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.431 -1.04 . . . . 3.0099999999999998 109.303 -179.977 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 336' ' ' GLU . . . . . . . . . . . . . 2.4 tt0 -57.92 -62.2 1.98 Allowed 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.518 -0.739 . . . . 2.2799999999999998 109.795 179.884 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 337' ' ' ARG . . . . . 0.468 ' NH1' ' CG ' ' B' ' 337' ' ' ARG . 0.0 OUTLIER -59.25 -29.0 67.23 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.372 -0.83 . . . . 2.9300000000000002 109.588 179.953 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' B' B ' 338' ' ' PHE . . . . . 0.413 ' HB3' ' O ' ' B' ' 335' ' ' ARG . 73.5 t80 -55.36 -57.21 12.76 Favored 'General case' 0 N--CA 1.487 1.405 0 O-C-N 121.289 -0.882 . . . . 0.37 109.502 -179.941 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 339' ' ' GLU . . . . . . . . . . . . . 3.1 mt-10 -51.95 -33.7 38.8 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.259 -0.901 . . . . 1.98 109.777 -179.719 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 340' ' ' MET . . . . . . . . . . . . . 31.3 ttp -63.18 -50.79 68.95 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.298 -0.876 . . . . 0.32000000000000001 110.23 -179.458 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 341' ' ' PHE . . . . . . . . . . . . . 51.8 m-85 -62.49 -43.35 99.02 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.02 -1.05 . . . . 0.17999999999999999 109.551 -179.484 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 342' ' ' ARG . . . . . 0.45 ' CG ' HH11 ' B' ' 342' ' ' ARG . 0.0 OUTLIER -51.63 -43.82 62.72 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.452 -0.78 . . . . 2.4199999999999999 109.813 -179.887 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' B' B ' 343' ' ' GLU . . . . . . . . . . . . . 2.1 tt0 -59.05 -47.39 85.39 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.43 -0.794 . . . . 2.3500000000000001 110.154 -179.426 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 344' ' ' LEU . . . . . 0.418 ' HA ' HD23 ' B' ' 344' ' ' LEU . 76.3 mt -62.37 -33.38 74.63 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.094 -1.004 . . . . 0.17999999999999999 109.51 -179.913 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 345' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -59.32 -52.89 63.68 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.253 -0.905 . . . . 1.0900000000000001 109.87 -179.98 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 346' ' ' GLU . . . . . . . . . . . . . 45.3 tt0 -61.53 -28.3 69.22 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.101 -1.0 . . . . 1.6599999999999999 109.642 -179.769 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 347' ' ' ALA . . . . . 0.852 ' HB1' ' HB1' ' A' ' 347' ' ' ALA . . . -61.89 -58.59 7.34 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.354 -0.841 . . . . 0.17000000000000001 109.973 -179.829 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 348' ' ' LEU . . . . . 0.56 HD22 ' N ' ' B' ' 348' ' ' LEU . 3.5 mm? -62.38 -43.41 98.89 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.092 -1.005 . . . . 0.28999999999999998 109.715 -179.65 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 349' ' ' GLU . . . . . . . . . . . . . 3.7 mm-40 -56.78 -35.4 68.63 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.182 -0.949 . . . . 1.95 110.125 -179.424 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 350' ' ' LEU . . . . . 0.579 HD22 HD13 ' A' ' 350' ' ' LEU . 6.2 tt -64.04 -46.15 85.68 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.056 -1.028 . . . . 0.45000000000000001 109.704 -179.769 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 351' ' ' LYS . . . . . . . . . . . . . 33.6 tttt -56.77 -49.7 74.52 Favored 'General case' 0 N--CA 1.488 1.45 0 O-C-N 121.429 -0.794 . . . . 1.3799999999999999 109.388 -179.894 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 352' ' ' ASP . . . . . . . . . . . . . 60.6 m-20 -58.45 -39.67 80.52 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.278 -0.889 . . . . 1.1599999999999999 109.888 -179.895 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 353' ' ' ALA . . . . . . . . . . . . . . . -66.48 -20.48 66.05 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.341 -0.849 . . . . 0.60999999999999999 109.814 -179.545 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 354' ' ' GLN . . . . . . . . . . . . . 4.4 mt-30 -83.19 -18.96 37.48 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 120.893 -1.129 . . . . 1.45 109.424 -179.925 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 355' ' ' ALA . . . . . . . . . . . . . . . -73.45 -9.82 59.09 Favored 'General case' 0 N--CA 1.489 1.479 0 O-C-N 121.244 -0.91 . . . . 0.97999999999999998 109.482 179.731 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 356' ' ' GLY . . . . . . . . . . . . . . . -79.57 -3.25 88.82 Favored Glycine 0 N--CA 1.489 2.227 0 N-CA-C 109.536 -1.426 . . . . 1.29 109.536 179.871 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 357' ' ' LYS . . . . . . . . . . . . . 7.7 mttt -84.37 161.79 20.25 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.075 -1.25 . . . . 4.0899999999999999 109.213 -179.979 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 358' ' ' GLU . . . . . . . . . . . . . 8.8 pt-20 -52.04 148.15 11.51 Favored Pre-proline 0 N--CA 1.49 1.57 0 O-C-N 121.104 -0.997 . . . . 5.7199999999999998 109.59 179.991 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 359' ' ' PRO . . . . . . . . . . . . . 2.2 Cg_endo -62.46 -158.73 0.03 OUTLIER 'Trans proline' 0 C--N 1.313 -1.329 0 C-N-CA 122.262 1.974 . . . . 4.9800000000000004 109.529 179.456 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 360' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.192 0 CA-C-O 117.926 -1.485 . . . . 6.9800000000000004 109.537 179.796 . . . . . . . . 0 0 . 1 . 020 nuclear build full ' C' C ' 319' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.493 1.718 0 N-CA-C 109.384 -0.598 . . . . 6.8200000000000003 109.384 . . . . . . . . . 1 1 . 1 . 020 nuclear build full ' C' C ' 320' ' ' LYS . . . . . . . . . . . . . 13.1 mtpt 54.31 99.65 0.01 OUTLIER 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.349 -0.844 . . . . 6.4900000000000002 109.898 179.871 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' C' C ' 321' ' ' LYS . . . . . . . . . . . . . 19.5 mtpt -83.0 137.81 43.14 Favored Pre-proline 0 N--CA 1.496 1.837 0 O-C-N 121.147 -0.971 . . . . 6.4000000000000004 109.95 179.886 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' C' C ' 322' ' ' PRO . . . . . . . . . . . . . 1.8 Cg_endo -67.43 -2.07 7.62 Favored 'Trans proline' 0 C--N 1.316 -1.164 0 C-N-CA 122.362 2.041 . . . . 3.4199999999999999 110.957 179.662 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' C' C ' 323' ' ' LEU . . . . . . . . . . . . . 87.8 mt -83.59 32.36 0.46 Allowed 'General case' 0 N--CA 1.495 1.822 0 O-C-N 121.107 -0.996 . . . . 3.9500000000000002 110.144 -179.837 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' C' C ' 324' ' ' ASP . . . . . . . . . . . . . 54.1 m-20 -77.58 -172.26 2.49 Favored 'General case' 0 N--CA 1.488 1.461 0 O-C-N 120.98 -1.075 . . . . 1.6299999999999999 108.997 179.682 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' C' C ' 325' ' ' GLY . . . . . 0.509 ' O ' ' CE1' ' C' ' 327' ' ' TYR . . . -67.76 174.68 28.24 Favored Glycine 0 N--CA 1.488 2.151 0 N-CA-C 109.02 -1.632 . . . . 0.72999999999999998 109.02 179.689 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' C' C ' 326' ' ' GLU . . . . . . . . . . . . . 3.0 mm-40 -55.99 -178.88 0.02 OUTLIER 'General case' 0 N--CA 1.488 1.467 0 O-C-N 121.207 -1.172 . . . . 2.1699999999999999 109.099 179.943 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' C' C ' 327' ' ' TYR . . . . . 0.509 ' CE1' ' O ' ' C' ' 325' ' ' GLY . 47.4 m-85 -147.27 113.43 5.86 Favored 'General case' 0 C--N 1.3 -1.556 0 O-C-N 121.465 -0.772 . . . . 0.47999999999999998 109.003 179.822 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' C' C ' 328' ' ' PHE . . . . . 0.568 ' CZ ' ' HB2' ' A' ' 335' ' ' ARG . 86.3 m-85 -111.61 -167.95 1.25 Allowed 'General case' 0 C--N 1.303 -1.435 0 O-C-N 121.068 -1.02 . . . . 0.33000000000000002 109.578 -179.618 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' C' C ' 329' ' ' THR . . . . . . . . . . . . . 76.4 p -150.37 163.79 37.47 Favored 'General case' 0 N--CA 1.487 1.407 0 O-C-N 121.248 -0.908 . . . . 0.23000000000000001 109.387 -179.831 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' C' C ' 330' ' ' LEU . . . . . . . . . . . . . 29.6 tp -150.07 130.04 13.44 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.434 -0.791 . . . . 0.28000000000000003 109.609 -179.623 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' C' C ' 331' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -85.37 115.14 22.94 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.258 -0.901 . . . . 1.48 109.234 179.847 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' C' C ' 332' ' ' ILE . . . . . 0.911 HG21 ' HA ' ' C' ' 338' ' ' PHE . 50.8 mt -103.88 99.88 9.31 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.482 0 O-C-N 121.165 -0.959 . . . . 0.23999999999999999 109.916 -179.768 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' C' C ' 333' ' ' ARG . . . . . 0.607 ' HG3' ' CE1' ' A' ' 327' ' ' TYR . 0.0 OUTLIER -71.48 144.69 49.59 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.132 -0.98 . . . . 2.7400000000000002 109.527 179.892 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' C' C ' 334' ' ' GLY . . . . . . . . . . . . . . . 86.99 126.75 2.18 Favored Glycine 0 N--CA 1.492 2.394 0 N-CA-C 109.379 -1.488 . . . . 0.34999999999999998 109.379 -179.991 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' C' C ' 335' ' ' ARG . . . . . 0.417 ' CG ' HH11 ' C' ' 335' ' ' ARG . 0.0 OUTLIER -77.86 -32.34 51.98 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.332 -1.099 . . . . 2.5299999999999998 109.848 -179.865 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' C' C ' 336' ' ' GLU . . . . . . . . . . . . . 1.6 mt-10 -59.84 -62.58 1.77 Allowed 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.02 -1.05 . . . . 2.6200000000000001 110.062 -179.672 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' C' C ' 337' ' ' ARG . . . . . . . . . . . . . 10.5 mpt_? -62.08 -29.35 70.25 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.269 -0.895 . . . . 2.8100000000000001 110.263 -179.621 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' C' C ' 338' ' ' PHE . . . . . 0.911 ' HA ' HG21 ' C' ' 332' ' ' ILE . 68.1 t80 -52.4 -60.21 3.49 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.137 -0.977 . . . . 0.40000000000000002 109.621 -179.752 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' C' C ' 339' ' ' GLU . . . . . . . . . . . . . 3.6 mt-10 -51.89 -31.11 26.86 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.382 -0.824 . . . . 2.0499999999999998 109.882 -179.836 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' C' C ' 340' ' ' MET . . . . . . . . . . . . . 38.5 ttp -63.28 -52.72 60.83 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.232 -0.917 . . . . 0.32000000000000001 109.471 -179.847 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' C' C ' 341' ' ' PHE . . . . . . . . . . . . . 40.2 m-85 -60.69 -42.21 96.7 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.148 -0.97 . . . . 0.17999999999999999 109.735 -179.745 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' C' C ' 342' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -52.29 -43.08 64.27 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.215 -0.928 . . . . 2.9100000000000001 109.683 179.928 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' C' C ' 343' ' ' GLU . . . . . . . . . . . . . 7.5 tp10 -59.77 -45.51 92.03 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 120.912 -1.118 . . . . 2.1400000000000001 110.32 -179.49 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' C' C ' 344' ' ' LEU . . . . . . . . . . . . . 48.9 mt -62.5 -42.81 99.75 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.324 -0.86 . . . . 0.22 110.081 -179.387 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' C' C ' 345' ' ' ASN . . . . . . . . . . . . . 22.5 t-20 -54.12 -50.93 65.76 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.211 -0.931 . . . . 1.0800000000000001 109.627 -179.379 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' C' C ' 346' ' ' GLU . . . . . . . . . . . . . 1.2 tt0 -61.03 -36.36 79.35 Favored 'General case' 0 C--N 1.301 -1.514 0 O-C-N 121.521 -0.737 . . . . 2.21 109.919 -179.773 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' C' C ' 347' ' ' ALA . . . . . 0.876 ' HB1' ' HB1' ' D' ' 347' ' ' ALA . . . -58.88 -52.76 64.35 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.075 -1.016 . . . . 0.17999999999999999 110.1 -179.529 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' C' C ' 348' ' ' LEU . . . . . 0.529 ' N ' HD22 ' C' ' 348' ' ' LEU . 2.7 mm? -62.22 -40.6 96.65 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.327 -0.858 . . . . 0.32000000000000001 109.721 -179.768 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' C' C ' 349' ' ' GLU . . . . . . . . . . . . . 4.1 mt-10 -59.73 -36.77 77.26 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.138 -0.976 . . . . 2.1899999999999999 110.653 -179.247 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' C' C ' 350' ' ' LEU . . . . . 0.646 HD13 HD22 ' D' ' 350' ' ' LEU . 5.3 tt -62.61 -45.96 90.49 Favored 'General case' 0 N--CA 1.494 1.74 0 O-C-N 121.126 -0.984 . . . . 0.46000000000000002 109.726 -178.953 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' C' C ' 351' ' ' LYS . . . . . . . . . . . . . 24.2 tttm -59.65 -43.73 93.81 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.111 -0.993 . . . . 1.3500000000000001 109.903 -179.497 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' C' C ' 352' ' ' ASP . . . . . . . . . . . . . 13.2 m-20 -58.58 -32.16 68.69 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.06 -1.025 . . . . 1.1899999999999999 109.417 -179.616 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' C' C ' 353' ' ' ALA . . . . . . . . . . . . . . . -68.29 -24.58 64.88 Favored 'General case' 0 C--N 1.301 -1.504 0 O-C-N 121.234 -0.916 . . . . 0.56999999999999995 110.378 -179.37 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' C' C ' 354' ' ' GLN . . . . . . . . . . . . . 58.7 mt-30 -84.31 -19.15 34.22 Favored 'General case' 0 N--CA 1.494 1.763 0 O-C-N 121.049 -1.032 . . . . 1.47 110.122 -179.42 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' C' C ' 355' ' ' ALA . . . . . . . . . . . . . . . -73.29 -0.8 15.59 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.273 -0.892 . . . . 0.93000000000000005 109.699 179.429 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' C' C ' 356' ' ' GLY . . . . . . . . . . . . . . . -79.72 -72.94 1.17 Allowed Glycine 0 N--CA 1.492 2.386 0 N-CA-C 110.244 -1.142 . . . . 1.3300000000000001 110.244 -179.694 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' C' C ' 357' ' ' LYS . . . . . . . . . . . . . 3.4 ptmt -81.37 127.41 32.73 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 120.993 -1.298 . . . . 4.0099999999999998 109.758 -179.241 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' C' C ' 358' ' ' GLU . . . . . . . . . . . . . 1.6 mt-10 -50.55 110.22 1.62 Allowed Pre-proline 0 C--N 1.304 -1.381 0 O-C-N 121.073 -1.017 . . . . 5.75 109.07 179.794 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' C' C ' 359' ' ' PRO . . . . . . . . . . . . . 3.3 Cg_exo -60.18 -80.97 0.01 OUTLIER 'Trans proline' 0 C--N 1.312 -1.386 0 C-N-CA 122.055 1.836 . . . . 4.9400000000000004 110.488 -179.923 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' C' C ' 360' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 2.403 0 CA-C-O 118.079 -1.4 . . . . 6.5 109.661 -179.861 . . . . . . . . 0 0 . 1 . 020 nuclear build full ' D' D ' 319' ' ' LYS . . . . . . . . . . . . . 20.0 mttt . . . . . 0 N--CA 1.492 1.63 0 CA-C-O 121.492 0.663 . . . . 7.5300000000000002 109.538 . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' D' D ' 320' ' ' LYS . . . . . . . . . . . . . 1.3 mttt 60.74 165.36 0.08 Allowed 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.451 -0.78 . . . . 6.4100000000000001 109.553 179.856 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' D' D ' 321' ' ' LYS . . . . . . . . . . . . . 2.2 mttt -154.92 101.29 2.32 Favored Pre-proline 0 N--CA 1.494 1.771 0 O-C-N 121.367 -0.833 . . . . 6.1100000000000003 109.53 179.917 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' D' D ' 322' ' ' PRO . . . . . . . . . . . . . 1.5 Cg_endo -66.91 2.46 2.09 Favored 'Trans proline' 0 C--N 1.313 -1.316 0 C-N-CA 122.48 2.12 . . . . 2.8199999999999998 110.972 179.954 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' D' D ' 323' ' ' LEU . . . . . 0.447 HD23 ' HA ' ' D' ' 323' ' ' LEU . 20.2 mt -81.19 34.97 0.37 Allowed 'General case' 0 N--CA 1.494 1.728 0 O-C-N 120.76 -1.213 . . . . 2.8300000000000001 110.519 179.983 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' D' D ' 324' ' ' ASP . . . . . 0.444 ' HB2' ' OH ' ' D' ' 327' ' ' TYR . 10.8 m-20 -82.95 -154.19 0.14 Allowed 'General case' 0 C--N 1.304 -1.386 0 O-C-N 121.026 -1.046 . . . . 1.54 109.234 179.394 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' D' D ' 325' ' ' GLY . . . . . 0.486 ' O ' ' CE2' ' D' ' 327' ' ' TYR . . . -69.42 177.33 29.71 Favored Glycine 0 N--CA 1.494 2.503 0 N-CA-C 109.54 -1.424 . . . . 0.58999999999999997 109.54 -179.966 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' D' D ' 326' ' ' GLU . . . . . . . . . . . . . 1.6 mm-40 -58.65 175.57 0.25 Allowed 'General case' 0 C--N 1.302 -1.493 0 O-C-N 121.33 -1.1 . . . . 2.1299999999999999 109.162 179.921 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' D' D ' 327' ' ' TYR . . . . . 0.486 ' CE2' ' O ' ' D' ' 325' ' ' GLY . 54.7 m-85 -148.26 109.42 4.32 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.183 -0.948 . . . . 0.46999999999999997 109.659 -179.854 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' D' D ' 328' ' ' PHE . . . . . . . . . . . . . 68.8 m-85 -114.37 -168.18 1.33 Allowed 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.504 -0.747 . . . . 0.29999999999999999 109.732 -179.878 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' D' D ' 329' ' ' THR . . . . . 0.416 ' HA ' ' O ' ' B' ' 330' ' ' LEU . 32.9 p -152.87 166.25 32.9 Favored 'General case' 0 N--CA 1.489 1.49 0 O-C-N 121.179 -0.95 . . . . 0.22 109.298 -179.829 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' D' D ' 330' ' ' LEU . . . . . 0.409 ' O ' ' HA ' ' B' ' 329' ' ' THR . 24.1 tp -148.32 125.99 11.8 Favored 'General case' 0 N--CA 1.488 1.461 0 O-C-N 121.297 -0.877 . . . . 0.28000000000000003 109.723 -179.734 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' D' D ' 331' ' ' GLN . . . . . . . . . . . . . 1.4 tp60 -85.36 108.69 17.95 Favored 'General case' 0 C--N 1.302 -1.473 0 O-C-N 121.314 -0.866 . . . . 0.93000000000000005 108.75 179.591 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' D' D ' 332' ' ' ILE . . . . . . . . . . . . . 31.9 mt -103.33 114.52 43.16 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.641 0 O-C-N 121.146 -0.971 . . . . 0.25 110.003 -179.498 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' D' D ' 333' ' ' ARG . . . . . . . . . . . . . 53.4 mtm180 -73.83 151.78 40.43 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.2 -0.938 . . . . 2.9300000000000002 109.839 179.932 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' D' D ' 334' ' ' GLY . . . . . . . . . . . . . . . 79.3 128.32 0.6 Allowed Glycine 0 N--CA 1.49 2.273 0 N-CA-C 109.894 -1.282 . . . . 0.40999999999999998 109.894 179.237 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' D' D ' 335' ' ' ARG . . . . . 0.439 ' HB2' ' CE2' ' B' ' 328' ' ' PHE . 33.2 ttp180 -78.75 -32.09 46.51 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.224 -1.162 . . . . 3.0299999999999998 109.356 179.904 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' D' D ' 336' ' ' GLU . . . . . . . . . . . . . 2.1 tt0 -58.02 -62.26 1.95 Allowed 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.344 -0.847 . . . . 2.2599999999999998 109.515 -179.993 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' D' D ' 337' ' ' ARG . . . . . 0.452 ' NH1' ' CG ' ' D' ' 337' ' ' ARG . 0.0 OUTLIER -59.38 -29.62 67.83 Favored 'General case' 0 C--N 1.301 -1.502 0 O-C-N 121.229 -0.919 . . . . 2.9199999999999999 109.719 -179.608 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' D' D ' 338' ' ' PHE . . . . . 0.42 ' HB3' ' O ' ' D' ' 335' ' ' ARG . 68.0 t80 -54.22 -56.44 18.24 Favored 'General case' 0 C--N 1.3 -1.574 0 O-C-N 121.491 -0.756 . . . . 0.37 109.429 179.953 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' D' D ' 339' ' ' GLU . . . . . . . . . . . . . 3.3 mt-10 -52.49 -34.65 50.36 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.022 -1.049 . . . . 1.99 109.924 -179.893 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' D' D ' 340' ' ' MET . . . . . . . . . . . . . 32.4 ttp -62.83 -50.24 71.75 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.137 -0.977 . . . . 0.31 110.143 -179.308 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' D' D ' 341' ' ' PHE . . . . . . . . . . . . . 46.8 m-85 -62.77 -44.24 96.7 Favored 'General case' 0 C--N 1.301 -1.511 0 O-C-N 120.944 -1.097 . . . . 0.17999999999999999 109.669 -179.484 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' D' D ' 342' ' ' ARG . . . . . 0.453 ' CG ' ' NH1' ' D' ' 342' ' ' ARG . 0.0 OUTLIER -51.9 -41.65 62.11 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.236 -0.915 . . . . 2.4100000000000001 109.821 -179.478 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' D' D ' 343' ' ' GLU . . . . . . . . . . . . . 3.6 tt0 -60.4 -46.62 89.32 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.183 -0.948 . . . . 2.3500000000000001 109.84 -179.346 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' D' D ' 344' ' ' LEU . . . . . 0.451 ' HA ' HD23 ' D' ' 344' ' ' LEU . 71.6 mt -62.44 -34.68 77.28 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.283 -0.886 . . . . 0.19 109.469 -179.844 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' D' D ' 345' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -58.49 -52.19 66.68 Favored 'General case' 0 C--N 1.302 -1.492 0 O-C-N 121.319 -0.863 . . . . 1.0900000000000001 109.723 -179.741 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' D' D ' 346' ' ' GLU . . . . . . . . . . . . . 42.7 tt0 -62.27 -29.25 70.29 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.39 -0.819 . . . . 1.6899999999999999 109.678 -179.68 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' D' D ' 347' ' ' ALA . . . . . 0.876 ' HB1' ' HB1' ' C' ' 347' ' ' ALA . . . -61.88 -57.23 12.6 Favored 'General case' 0 N--CA 1.493 1.713 0 O-C-N 121.421 -0.799 . . . . 0.17999999999999999 109.966 -179.614 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' D' D ' 348' ' ' LEU . . . . . 0.552 HD22 ' N ' ' D' ' 348' ' ' LEU . 3.4 mm? -63.16 -44.06 96.55 Favored 'General case' 0 N--CA 1.488 1.472 0 O-C-N 121.186 -0.946 . . . . 0.31 109.762 -179.804 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' D' D ' 349' ' ' GLU . . . . . . . . . . . . . 3.5 mm-40 -57.22 -34.13 68.24 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.109 -0.995 . . . . 1.95 110.066 -179.232 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' D' D ' 350' ' ' LEU . . . . . 0.646 HD22 HD13 ' C' ' 350' ' ' LEU . 6.2 tt -64.08 -46.13 85.64 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.181 -0.95 . . . . 0.42999999999999999 109.413 179.885 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' D' D ' 351' ' ' LYS . . . . . . . . . . . . . 42.0 tttt -57.6 -48.43 79.42 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.252 -0.905 . . . . 1.3999999999999999 109.59 -179.939 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' D' D ' 352' ' ' ASP . . . . . . . . . . . . . 72.4 m-20 -58.66 -38.89 79.13 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.401 -0.812 . . . . 1.1699999999999999 109.462 179.458 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' D' D ' 353' ' ' ALA . . . . . . . . . . . . . . . -67.65 -20.71 65.35 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.485 -0.759 . . . . 0.58999999999999997 109.958 -179.514 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' D' D ' 354' ' ' GLN . . . . . . . . . . . . . 5.5 mt-30 -84.11 -19.2 34.64 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.365 -0.834 . . . . 1.4399999999999999 109.675 -179.887 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' D' D ' 355' ' ' ALA . . . . . . . . . . . . . . . -73.52 -10.61 59.89 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.36 -0.837 . . . . 0.97999999999999998 109.681 -179.93 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' D' D ' 356' ' ' GLY . . . . . . . . . . . . . . . -79.4 -2.71 88.06 Favored Glycine 0 N--CA 1.492 2.378 0 N-CA-C 109.282 -1.527 . . . . 1.28 109.282 179.958 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' D' D ' 357' ' ' LYS . . . . . . . . . . . . . 8.0 mttt -84.17 162.0 20.38 Favored 'General case' 0 N--CA 1.487 1.422 0 O-C-N 121.199 -1.177 . . . . 4.0899999999999999 109.213 -179.81 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' D' D ' 358' ' ' GLU . . . . . . . . . . . . . 4.4 pt-20 -52.4 147.39 14.21 Favored Pre-proline 0 N--CA 1.495 1.795 0 O-C-N 121.115 -0.991 . . . . 5.71 109.605 -179.773 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' D' D ' 359' ' ' PRO . . . . . . . . . . . . . 2.7 Cg_endo -61.74 -158.68 0.02 OUTLIER 'Trans proline' 0 C--N 1.311 -1.429 0 C-N-CA 122.212 1.941 . . . . 4.9699999999999998 110.57 -179.954 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' D' D ' 360' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.486 2.025 0 N-CA-C 109.13 -1.588 . . . . 6.9699999999999998 109.13 179.777 . . . . . . . . 0 0 . 1 . 021 nuclear build full ' A' A ' 319' ' ' LYS . . . . . . . . . . . . . 3.6 mmtm . . . . . 0 N--CA 1.491 1.588 0 N-CA-C 109.477 -0.564 . . . . 7.5499999999999998 109.477 . . . . . . . . . 0 0 . 1 . 021 nuclear build full ' A' A ' 320' ' ' LYS . . . . . . . . . . . . . 5.8 tttm 60.07 96.71 0.03 OUTLIER 'General case' 0 N--CA 1.489 1.476 0 O-C-N 121.254 -0.903 . . . . 6.4299999999999997 109.347 179.953 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 321' ' ' LYS . . . . . 0.426 ' HB2' ' HD2' ' A' ' 322' ' ' PRO . 15.7 pttt -80.86 155.78 72.84 Favored Pre-proline 0 N--CA 1.491 1.607 0 O-C-N 121.251 -0.905 . . . . 6.1299999999999999 109.232 -179.978 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 322' ' ' PRO . . . . . 0.426 ' HD2' ' HB2' ' A' ' 321' ' ' LYS . 5.4 Cg_exo -58.27 -157.04 0.01 OUTLIER 'Trans proline' 0 C--N 1.308 -1.564 0 C-N-CA 121.991 1.794 . . . . 2.8300000000000001 110.081 179.996 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 323' ' ' LEU . . . . . 0.407 HD23 ' HA ' ' A' ' 323' ' ' LEU . 34.8 mt -79.6 150.52 31.01 Favored 'General case' 0 N--CA 1.489 1.484 0 O-C-N 121.137 -0.977 . . . . 2.8300000000000001 109.39 -179.972 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 324' ' ' ASP . . . . . 0.41 ' HB2' ' OH ' ' A' ' 327' ' ' TYR . 42.5 m-20 -78.45 -165.49 0.7 Allowed 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.208 -0.932 . . . . 1.53 109.668 -179.713 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 325' ' ' GLY . . . . . . . . . . . . . . . -69.8 -160.98 2.92 Favored Glycine 0 N--CA 1.489 2.221 0 N-CA-C 109.686 -1.366 . . . . 0.60999999999999999 109.686 -179.884 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 326' ' ' GLU . . . . . . . . . . . . . 7.1 mt-10 -59.07 -169.55 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.313 -1.11 . . . . 2.1299999999999999 109.634 179.982 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 327' ' ' TYR . . . . . 0.575 ' CE1' ' HG2' ' C' ' 333' ' ' ARG . 41.4 m-85 -149.79 115.52 5.59 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.394 -0.816 . . . . 0.47999999999999998 109.628 179.975 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 328' ' ' PHE . . . . . 0.482 ' CE1' ' HA ' ' C' ' 335' ' ' ARG . 76.6 m-85 -113.51 -170.52 1.71 Allowed 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.36 -0.837 . . . . 0.31 109.385 179.928 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 329' ' ' THR . . . . . 0.405 HG23 ' O ' ' A' ' 328' ' ' PHE . 27.3 p -154.08 167.47 29.69 Favored 'General case' 0 N--CA 1.489 1.483 0 O-C-N 121.302 -0.874 . . . . 0.22 109.39 -179.849 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 330' ' ' LEU . . . . . . . . . . . . . 14.7 tp -148.51 126.9 12.27 Favored 'General case' 0 N--CA 1.489 1.487 0 O-C-N 121.251 -0.906 . . . . 0.28000000000000003 109.359 -179.944 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 331' ' ' GLN . . . . . . . . . . . . . 1.1 tp60 -86.95 111.38 20.78 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.236 -0.915 . . . . 0.91000000000000003 109.473 -179.996 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 332' ' ' ILE . . . . . . . . . . . . . 32.2 mt -103.61 110.26 29.47 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.501 0 O-C-N 121.245 -0.909 . . . . 0.26000000000000001 109.486 -179.946 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 333' ' ' ARG . . . . . 0.406 ' CG ' ' CE2' ' C' ' 327' ' ' TYR . 2.4 mpt_? -72.36 143.44 48.61 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.287 -0.883 . . . . 2.9199999999999999 109.241 179.793 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 334' ' ' GLY . . . . . . . . . . . . . . . 83.74 130.24 1.76 Allowed Glycine 0 N--CA 1.491 2.327 0 N-CA-C 109.525 -1.43 . . . . 0.40000000000000002 109.525 -179.869 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 335' ' ' ARG . . . . . 0.497 ' HB2' ' CZ ' ' C' ' 328' ' ' PHE . 6.1 ttm180 -79.07 -28.48 43.11 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.344 -1.092 . . . . 3.0099999999999998 109.622 -179.834 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 336' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -56.79 -67.16 0.34 Allowed 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.208 -0.933 . . . . 2.29 109.799 -179.701 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 337' ' ' ARG . . . . . 0.45 ' HG2' HH11 ' A' ' 337' ' ' ARG . 0.8 OUTLIER -60.38 -25.79 66.16 Favored 'General case' 0 N--CA 1.488 1.47 0 O-C-N 121.251 -0.905 . . . . 2.9300000000000002 109.68 -179.766 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 338' ' ' PHE . . . . . 0.441 ' HB3' ' O ' ' A' ' 335' ' ' ARG . 67.6 t80 -55.39 -60.59 3.2 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.3 -0.875 . . . . 0.38 109.677 179.982 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 339' ' ' GLU . . . . . . . . . . . . . 79.0 mt-10 -51.36 -31.71 23.16 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.281 -0.887 . . . . 1.97 109.998 -179.738 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 340' ' ' MET . . . . . . . . . . . . . 9.5 ttp -63.27 -52.58 61.49 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.159 -0.963 . . . . 0.31 109.954 -179.575 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 341' ' ' PHE . . . . . . . . . . . . . 48.3 m-85 -61.85 -41.68 98.12 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.226 -0.921 . . . . 0.17999999999999999 109.74 -179.587 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 342' ' ' ARG . . . . . 0.488 ' HG2' ' NH1' ' A' ' 342' ' ' ARG . 0.0 OUTLIER -50.9 -41.73 58.74 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.17 -0.956 . . . . 2.4199999999999999 109.888 -179.867 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 343' ' ' GLU . . . . . . . . . . . . . 28.3 tt0 -59.67 -50.71 72.78 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.235 -0.916 . . . . 2.3500000000000001 110.195 -179.544 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 344' ' ' LEU . . . . . 0.763 HD22 HD22 ' B' ' 344' ' ' LEU . 41.0 mt -61.29 -30.04 70.23 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.121 -0.987 . . . . 0.17999999999999999 109.92 -179.477 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 345' ' ' ASN . . . . . 0.462 ' HB2' HD21 ' C' ' 330' ' ' LEU . 29.3 t-20 -57.52 -56.96 15.18 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.235 -0.916 . . . . 1.0900000000000001 109.993 -179.659 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 346' ' ' GLU . . . . . . . . . . . . . 70.9 tt0 -61.47 -29.47 69.99 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.219 -0.926 . . . . 1.6499999999999999 110.183 -179.452 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 347' ' ' ALA . . . . . 0.896 ' HB1' ' HB1' ' B' ' 347' ' ' ALA . . . -60.07 -55.89 28.37 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.115 -0.991 . . . . 0.17999999999999999 110.066 -179.522 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 348' ' ' LEU . . . . . 0.582 HD22 ' N ' ' A' ' 348' ' ' LEU . 4.2 mm? -61.84 -44.62 96.47 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.257 -0.902 . . . . 0.29999999999999999 110.07 -179.434 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 349' ' ' GLU . . . . . 0.413 ' HG3' ' O ' ' A' ' 345' ' ' ASN . 55.8 mt-10 -57.4 -35.7 70.36 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.077 -1.015 . . . . 1.9399999999999999 109.945 -179.438 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 350' ' ' LEU . . . . . 0.602 HD22 HD22 ' B' ' 350' ' ' LEU . 6.1 tt -64.45 -40.41 95.68 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.208 -0.933 . . . . 0.46000000000000002 109.63 -179.765 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 351' ' ' LYS . . . . . . . . . . . . . 2.3 ttmt -57.67 -56.63 19.43 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.285 -0.884 . . . . 1.3999999999999999 109.895 -179.577 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 352' ' ' ASP . . . . . . . . . . . . . 11.8 m-20 -56.55 -37.54 70.66 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.155 -0.966 . . . . 1.1599999999999999 109.815 -179.842 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 353' ' ' ALA . . . . . . . . . . . . . . . -67.34 -26.35 66.45 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.228 -0.92 . . . . 0.63 110.183 -179.439 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 354' ' ' GLN . . . . . 0.498 ' OE1' HD11 ' B' ' 350' ' ' LEU . 3.3 mt-30 -83.61 -12.96 55.37 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.023 -1.048 . . . . 1.47 109.797 -179.751 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 355' ' ' ALA . . . . . . . . . . . . . . . -72.78 -21.86 60.93 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.066 -1.021 . . . . 1.01 109.269 179.836 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 356' ' ' GLY . . . . . . . . . . . . . . . -81.68 16.84 17.64 Favored Glycine 0 N--CA 1.492 2.375 0 N-CA-C 110.316 -1.114 . . . . 1.3 110.316 179.947 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 357' ' ' LYS . . . . . . . . . . . . . 41.8 tttt -85.43 111.5 20.01 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 120.989 -1.301 . . . . 4.0999999999999996 109.722 -179.619 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 358' ' ' GLU . . . . . . . . . . . . . 5.5 mt-10 -48.43 112.98 2.57 Favored Pre-proline 0 N--CA 1.489 1.495 0 O-C-N 121.256 -0.902 . . . . 5.75 109.252 179.818 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 359' ' ' PRO . . . . . . . . . . . . . 2.4 Cg_endo -61.72 137.77 70.56 Favored 'Trans proline' 0 C--N 1.312 -1.347 0 C-N-CA 121.953 1.769 . . . . 5.0 110.214 -179.82 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 360' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.245 0 CA-C-O 118.024 -1.431 . . . . 6.9699999999999998 109.538 179.972 . . . . . . . . 0 0 . 1 . 021 nuclear build full ' B' B ' 319' ' ' LYS . . . . . . . . . . . . . 3.5 mmtm . . . . . 0 N--CA 1.489 1.511 0 N-CA-C 109.41 -0.589 . . . . 7.5499999999999998 109.41 . . . . . . . . . 0 0 . 1 . 021 nuclear build full ' B' B ' 320' ' ' LYS . . . . . . . . . . . . . 5.1 tttm 59.37 97.01 0.03 OUTLIER 'General case' 0 N--CA 1.489 1.492 0 O-C-N 121.237 -0.914 . . . . 6.4400000000000004 109.423 179.99 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 321' ' ' LYS . . . . . 0.412 ' HB2' ' HD2' ' B' ' 322' ' ' PRO . 15.2 pttt -81.11 155.78 72.21 Favored Pre-proline 0 N--CA 1.489 1.499 0 O-C-N 121.201 -0.937 . . . . 6.1299999999999999 109.215 179.971 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' B' B ' 322' ' ' PRO . . . . . 0.412 ' HD2' ' HB2' ' B' ' 321' ' ' LYS . 5.5 Cg_exo -58.36 -156.9 0.01 OUTLIER 'Trans proline' 0 C--N 1.308 -1.6 0 C-N-CA 122.006 1.804 . . . . 2.8199999999999998 110.105 179.987 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' B' B ' 323' ' ' LEU . . . . . 0.43 HD23 ' HA ' ' B' ' 323' ' ' LEU . 36.6 mt -79.55 150.54 31.08 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.12 -0.987 . . . . 2.8399999999999999 109.393 -179.983 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' B' B ' 324' ' ' ASP . . . . . 0.407 ' HB2' ' OH ' ' B' ' 327' ' ' TYR . 43.7 m-20 -78.43 -165.18 0.65 Allowed 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.26 -0.9 . . . . 1.53 109.583 -179.802 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' B' B ' 325' ' ' GLY . . . . . . . . . . . . . . . -70.25 -160.94 3.27 Favored Glycine 0 N--CA 1.49 2.248 0 N-CA-C 109.731 -1.348 . . . . 0.58999999999999997 109.731 -179.819 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 326' ' ' GLU . . . . . . . . . . . . . 7.1 mt-10 -58.86 -169.41 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.341 -1.093 . . . . 2.1299999999999999 109.625 179.989 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 327' ' ' TYR . . . . . 0.534 ' CE1' ' CG ' ' D' ' 333' ' ' ARG . 41.7 m-85 -149.84 115.42 5.55 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.339 -0.851 . . . . 0.47999999999999998 109.607 179.96 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' B' B ' 328' ' ' PHE . . . . . 0.482 ' CZ ' ' HB2' ' D' ' 335' ' ' ARG . 75.9 m-85 -113.54 -170.72 1.75 Allowed 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.352 -0.843 . . . . 0.32000000000000001 109.321 179.885 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' B' B ' 329' ' ' THR . . . . . 0.482 ' HA ' ' O ' ' D' ' 330' ' ' LEU . 27.7 p -153.89 167.64 29.02 Favored 'General case' 0 N--CA 1.488 1.471 0 O-C-N 121.311 -0.868 . . . . 0.23000000000000001 109.383 -179.978 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' B' B ' 330' ' ' LEU . . . . . 0.49 ' O ' ' HA ' ' D' ' 329' ' ' THR . 14.5 tp -148.74 126.06 11.54 Favored 'General case' 0 N--CA 1.488 1.45 0 O-C-N 121.207 -0.933 . . . . 0.28000000000000003 109.491 -179.859 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' B' B ' 331' ' ' GLN . . . . . . . . . . . . . 1.1 tt0 -86.24 111.32 20.31 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.243 -0.911 . . . . 0.91000000000000003 109.624 -179.905 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 332' ' ' ILE . . . . . . . . . . . . . 31.9 mt -103.36 110.63 30.39 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.538 0 O-C-N 121.23 -0.919 . . . . 0.23999999999999999 109.564 179.922 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 333' ' ' ARG . . . . . 0.595 ' CG ' ' CE1' ' D' ' 327' ' ' TYR . 2.4 mpt_? -72.57 143.53 48.23 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.19 -0.944 . . . . 2.9300000000000002 109.261 179.822 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' B' B ' 334' ' ' GLY . . . . . . . . . . . . . . . 83.55 130.04 1.67 Allowed Glycine 0 N--CA 1.49 2.254 0 N-CA-C 109.521 -1.431 . . . . 0.40000000000000002 109.521 -179.981 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 335' ' ' ARG . . . . . 0.504 ' HB2' ' CZ ' ' D' ' 328' ' ' PHE . 6.2 ttm180 -78.68 -28.41 45.29 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.289 -1.124 . . . . 3.0099999999999998 109.737 -179.947 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' B' B ' 336' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -56.7 -67.42 0.31 Allowed 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.236 -0.915 . . . . 2.2799999999999998 109.796 -179.714 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' B' B ' 337' ' ' ARG . . . . . 0.438 ' HG2' HH11 ' B' ' 337' ' ' ARG . 0.8 OUTLIER -60.3 -25.52 65.81 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.271 -0.893 . . . . 2.9300000000000002 109.676 -179.798 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' B' B ' 338' ' ' PHE . . . . . 0.437 ' HB3' ' O ' ' B' ' 335' ' ' ARG . 66.8 t80 -55.67 -60.7 3.07 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.221 -0.924 . . . . 0.37 109.517 -179.96 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' B' B ' 339' ' ' GLU . . . . . . . . . . . . . 79.1 mt-10 -51.32 -31.77 22.89 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.365 -0.834 . . . . 1.98 109.965 -179.673 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 340' ' ' MET . . . . . . . . . . . . . 9.4 ttp -63.32 -52.52 61.54 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.149 -0.969 . . . . 0.32000000000000001 110.041 -179.597 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 341' ' ' PHE . . . . . . . . . . . . . 48.3 m-85 -61.64 -42.14 98.48 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.167 -0.958 . . . . 0.17999999999999999 109.761 -179.695 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 342' ' ' ARG . . . . . 0.494 ' NH1' ' HG2' ' B' ' 342' ' ' ARG . 0.0 OUTLIER -50.32 -42.03 52.13 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.334 -0.854 . . . . 2.4199999999999999 109.857 -179.894 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' B' B ' 343' ' ' GLU . . . . . . . . . . . . . 27.3 tt0 -59.55 -50.7 72.88 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.255 -0.903 . . . . 2.3500000000000001 110.258 -179.411 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 344' ' ' LEU . . . . . 0.763 HD22 HD22 ' A' ' 344' ' ' LEU . 40.0 mt -61.38 -29.82 70.15 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.127 -0.983 . . . . 0.17999999999999999 109.929 -179.537 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' B' B ' 345' ' ' ASN . . . . . 0.412 ' O ' ' HG3' ' B' ' 349' ' ' GLU . 29.2 t-20 -57.58 -57.0 14.67 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.245 -0.909 . . . . 1.0900000000000001 110.017 -179.688 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' B' B ' 346' ' ' GLU . . . . . . . . . . . . . 71.0 tt0 -61.5 -29.4 69.96 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.214 -0.928 . . . . 1.6599999999999999 110.246 -179.395 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 347' ' ' ALA . . . . . 0.896 ' HB1' ' HB1' ' A' ' 347' ' ' ALA . . . -60.28 -55.78 29.56 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.136 -0.978 . . . . 0.17000000000000001 110.061 -179.516 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' B' B ' 348' ' ' LEU . . . . . 0.575 HD22 ' N ' ' B' ' 348' ' ' LEU . 4.2 mm? -61.82 -44.59 96.56 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.203 -0.936 . . . . 0.28999999999999998 110.005 -179.468 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' B' B ' 349' ' ' GLU . . . . . 0.412 ' HG3' ' O ' ' B' ' 345' ' ' ASN . 56.4 mt-10 -57.38 -35.78 70.42 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.172 -0.955 . . . . 1.95 109.946 -179.471 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' B' B ' 350' ' ' LEU . . . . . 0.602 HD22 HD22 ' A' ' 350' ' ' LEU . 6.1 tt -64.4 -40.28 95.48 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.269 -0.894 . . . . 0.45000000000000001 109.791 -179.826 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' B' B ' 351' ' ' LYS . . . . . . . . . . . . . 2.3 ttmt -57.87 -56.55 20.48 Favored 'General case' 0 N--CA 1.489 1.525 0 O-C-N 121.192 -0.943 . . . . 1.3799999999999999 109.915 -179.595 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 352' ' ' ASP . . . . . . . . . . . . . 11.5 m-20 -56.69 -37.35 70.75 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.178 -0.951 . . . . 1.1599999999999999 109.791 -179.882 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 353' ' ' ALA . . . . . . . . . . . . . . . -67.33 -26.28 66.42 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.208 -0.933 . . . . 0.60999999999999999 110.049 -179.513 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 354' ' ' GLN . . . . . 0.556 ' OE1' HD11 ' A' ' 350' ' ' LEU . 3.3 mt-30 -83.84 -12.87 54.95 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.05 -1.031 . . . . 1.45 109.936 -179.59 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' B' B ' 355' ' ' ALA . . . . . . . . . . . . . . . -72.94 -21.99 60.79 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.139 -0.975 . . . . 0.97999999999999998 109.329 179.826 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 356' ' ' GLY . . . . . . . . . . . . . . . -81.38 17.03 14.85 Favored Glycine 0 N--CA 1.491 2.307 0 N-CA-C 110.342 -1.103 . . . . 1.29 110.342 179.868 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 357' ' ' LYS . . . . . . . . . . . . . 42.1 tttt -85.64 111.46 20.1 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 120.831 -1.394 . . . . 4.0899999999999999 109.747 -179.645 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 358' ' ' GLU . . . . . . . . . . . . . 5.5 mt-10 -48.36 112.61 2.38 Favored Pre-proline 0 N--CA 1.49 1.566 0 O-C-N 121.272 -0.893 . . . . 5.7199999999999998 109.323 179.805 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 359' ' ' PRO . . . . . . . . . . . . . 2.4 Cg_endo -61.53 138.44 75.79 Favored 'Trans proline' 0 C--N 1.313 -1.329 0 C-N-CA 121.996 1.797 . . . . 4.9800000000000004 110.306 -179.84 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 360' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.18 0 CA-C-O 117.925 -1.486 . . . . 6.9800000000000004 109.55 -179.956 . . . . . . . . 0 0 . 1 . 021 nuclear build full ' C' C ' 319' ' ' LYS . . . . . 0.439 ' O ' ' HB2' ' C' ' 320' ' ' LYS . 10.2 mttp . . . . . 0 N--CA 1.49 1.56 0 N-CA-C 109.43 -0.581 . . . . 6.8200000000000003 109.43 . . . . . . . . . 1 1 . 1 . 021 nuclear build full ' C' C ' 320' ' ' LYS . . . . . 0.439 ' HB2' ' O ' ' C' ' 319' ' ' LYS . 9.8 mtmt 61.14 166.27 0.09 Allowed 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.279 -0.888 . . . . 6.4900000000000002 109.678 179.899 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' C' C ' 321' ' ' LYS . . . . . . . . . . . . . 1.7 mttp -157.73 145.11 13.57 Favored Pre-proline 0 N--CA 1.49 1.542 0 O-C-N 121.23 -0.919 . . . . 6.4000000000000004 109.318 179.875 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' C' C ' 322' ' ' PRO . . . . . . . . . . . . . 3.4 Cg_exo -60.78 178.03 0.56 Allowed 'Trans proline' 0 C--N 1.31 -1.449 0 C-N-CA 122.168 1.912 . . . . 3.4199999999999999 110.317 -179.865 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' C' C ' 323' ' ' LEU . . . . . . . . . . . . . 44.8 mt -79.38 120.49 23.88 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.343 -0.848 . . . . 3.9500000000000002 109.208 179.855 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' C' C ' 324' ' ' ASP . . . . . 0.485 ' HB3' ' OH ' ' C' ' 327' ' ' TYR . 90.0 m-20 -79.61 146.08 32.73 Favored 'General case' 0 N--CA 1.489 1.495 0 O-C-N 121.304 -0.872 . . . . 1.6299999999999999 109.482 -179.779 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' C' C ' 325' ' ' GLY . . . . . . . . . . . . . . . -68.21 -168.14 4.51 Favored Glycine 0 N--CA 1.489 2.199 0 N-CA-C 109.386 -1.486 . . . . 0.72999999999999998 109.386 179.773 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' C' C ' 326' ' ' GLU . . . . . . . . . . . . . 2.3 mt-10 -58.7 -172.22 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.256 -1.144 . . . . 2.1699999999999999 109.555 -179.991 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' C' C ' 327' ' ' TYR . . . . . 0.485 ' OH ' ' HB3' ' C' ' 324' ' ' ASP . 37.2 m-85 -149.11 114.21 5.47 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.446 -0.784 . . . . 0.47999999999999998 109.463 179.809 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' C' C ' 328' ' ' PHE . . . . . 0.497 ' CZ ' ' HB2' ' A' ' 335' ' ' ARG . 77.0 m-85 -112.56 -170.54 1.68 Allowed 'General case' 0 N--CA 1.487 1.42 0 O-C-N 121.269 -0.895 . . . . 0.33000000000000002 108.951 179.677 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' C' C ' 329' ' ' THR . . . . . 0.423 HG23 ' O ' ' C' ' 328' ' ' PHE . 5.0 p -153.42 170.25 21.17 Favored 'General case' 0 C--N 1.301 -1.512 0 O-C-N 121.27 -0.894 . . . . 0.23000000000000001 109.226 179.957 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' C' C ' 330' ' ' LEU . . . . . 0.462 HD21 ' HB2' ' A' ' 345' ' ' ASN . 49.5 tp -149.12 134.49 18.44 Favored 'General case' 0 C--N 1.303 -1.454 0 O-C-N 121.213 -0.929 . . . . 0.28000000000000003 109.325 -179.77 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' C' C ' 331' ' ' GLN . . . . . . . . . . . . . 9.1 tp-100 -84.95 107.17 16.96 Favored 'General case' 0 N--CA 1.489 1.475 0 O-C-N 121.337 -0.852 . . . . 1.48 109.187 -179.994 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' C' C ' 332' ' ' ILE . . . . . 0.771 HG21 ' HA ' ' C' ' 338' ' ' PHE . 64.2 mt -103.05 100.39 10.31 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.505 0 O-C-N 121.162 -0.961 . . . . 0.23999999999999999 109.424 -179.897 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' C' C ' 333' ' ' ARG . . . . . 0.575 ' HG2' ' CE1' ' A' ' 327' ' ' TYR . 89.2 mtt180 -72.57 159.09 34.46 Favored 'General case' 0 N--CA 1.488 1.456 0 O-C-N 121.311 -0.868 . . . . 2.7400000000000002 109.289 179.725 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' C' C ' 334' ' ' GLY . . . . . . . . . . . . . . . 72.58 129.13 0.11 Allowed Glycine 0 N--CA 1.491 2.36 0 N-CA-C 109.39 -1.484 . . . . 0.34999999999999998 109.39 -179.788 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' C' C ' 335' ' ' ARG . . . . . 0.482 ' HA ' ' CE1' ' A' ' 328' ' ' PHE . 10.1 ttm180 -78.08 -30.89 49.86 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.245 -1.15 . . . . 2.5299999999999998 109.889 -179.769 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' C' C ' 336' ' ' GLU . . . . . . . . . . . . . 1.5 tt0 -58.95 -63.82 1.16 Allowed 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.227 -0.921 . . . . 2.6200000000000001 110.087 -179.591 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' C' C ' 337' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -59.09 -26.11 64.37 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.155 -0.965 . . . . 2.8100000000000001 109.802 -179.43 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' C' C ' 338' ' ' PHE . . . . . 0.771 ' HA ' HG21 ' C' ' 332' ' ' ILE . 81.3 t80 -54.78 -61.12 2.52 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.152 -0.968 . . . . 0.40000000000000002 109.662 -179.944 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' C' C ' 339' ' ' GLU . . . . . . . . . . . . . 22.9 mt-10 -50.97 -31.59 18.38 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.301 -0.874 . . . . 2.0499999999999998 109.995 -179.669 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' C' C ' 340' ' ' MET . . . . . . . . . . . . . 34.6 ttp -63.47 -52.85 59.6 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.173 -0.954 . . . . 0.32000000000000001 109.916 -179.564 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' C' C ' 341' ' ' PHE . . . . . . . . . . . . . 48.9 m-85 -62.08 -42.26 99.02 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.153 -0.967 . . . . 0.17999999999999999 109.848 -179.58 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' C' C ' 342' ' ' ARG . . . . . 0.451 HH11 ' CG ' ' C' ' 342' ' ' ARG . 0.2 OUTLIER -49.94 -45.39 51.19 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.358 -0.839 . . . . 2.9100000000000001 110.177 -179.574 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' C' C ' 343' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -57.82 -48.71 78.97 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.137 -0.977 . . . . 2.1400000000000001 110.025 -179.332 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' C' C ' 344' ' ' LEU . . . . . 0.637 HD22 HD22 ' D' ' 344' ' ' LEU . 32.3 mt -62.69 -31.94 72.93 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.2 -0.938 . . . . 0.22 110.132 -179.549 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' C' C ' 345' ' ' ASN . . . . . . . . . . . . . 20.4 t-20 -57.63 -58.62 7.5 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.213 -0.929 . . . . 1.0800000000000001 109.57 -179.665 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' C' C ' 346' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -61.36 -26.08 67.59 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.317 -0.865 . . . . 2.21 109.669 -179.875 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' C' C ' 347' ' ' ALA . . . . . 0.772 ' HB1' ' HB1' ' D' ' 347' ' ' ALA . . . -60.42 -58.63 7.7 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.173 -0.954 . . . . 0.17999999999999999 109.772 -179.984 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' C' C ' 348' ' ' LEU . . . . . 0.579 ' N ' HD22 ' C' ' 348' ' ' LEU . 4.3 mm? -62.23 -40.54 96.47 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.237 -0.915 . . . . 0.32000000000000001 109.86 -179.658 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' C' C ' 349' ' ' GLU . . . . . . . . . . . . . 68.0 mm-40 -57.46 -37.09 72.31 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.186 -0.946 . . . . 2.1899999999999999 109.726 -179.63 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' C' C ' 350' ' ' LEU . . . . . 0.675 HD13 HD22 ' D' ' 350' ' ' LEU . 5.3 tt -63.02 -38.79 92.62 Favored 'General case' 0 N--CA 1.489 1.481 0 O-C-N 121.109 -0.994 . . . . 0.46000000000000002 109.065 179.929 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' C' C ' 351' ' ' LYS . . . . . 0.468 ' HA ' ' OE1' ' C' ' 354' ' ' GLN . 20.3 tttt -60.15 -37.12 79.15 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.351 -0.843 . . . . 1.3500000000000001 109.164 179.765 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' C' C ' 352' ' ' ASP . . . . . . . . . . . . . 8.5 m-20 -56.93 -41.91 79.07 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.31 -0.869 . . . . 1.1899999999999999 109.539 179.926 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' C' C ' 353' ' ' ALA . . . . . . . . . . . . . . . -67.57 -23.15 65.38 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.272 -0.892 . . . . 0.56999999999999995 109.575 -179.897 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' C' C ' 354' ' ' GLN . . . . . 0.512 ' OE1' HD23 ' C' ' 350' ' ' LEU . 26.4 mt-30 -82.47 -6.78 59.51 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.193 -0.942 . . . . 1.47 109.621 -179.987 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' C' C ' 355' ' ' ALA . . . . . . . . . . . . . . . -70.66 -86.04 0.03 OUTLIER 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.225 -0.922 . . . . 0.93000000000000005 109.6 179.971 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' C' C ' 356' ' ' GLY . . . . . . . . . . . . . . . -81.41 66.06 3.89 Favored Glycine 0 N--CA 1.494 2.503 0 N-CA-C 109.907 -1.277 . . . . 1.3300000000000001 109.907 179.999 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' C' C ' 357' ' ' LYS . . . . . . . . . . . . . 24.0 tttt -86.23 156.26 20.36 Favored 'General case' 0 N--CA 1.488 1.431 0 O-C-N 121.145 -1.209 . . . . 4.0099999999999998 109.24 179.919 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' C' C ' 358' ' ' GLU . . . . . 0.408 ' HB3' ' HD2' ' C' ' 359' ' ' PRO . 11.9 mm-40 -48.03 156.09 0.79 Allowed Pre-proline 0 N--CA 1.49 1.555 0 O-C-N 121.168 -0.957 . . . . 5.75 109.297 -179.995 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' C' C ' 359' ' ' PRO . . . . . 0.408 ' HD2' ' HB3' ' C' ' 358' ' ' GLU . 5.0 Cg_exo -59.85 174.34 1.32 Allowed 'Trans proline' 0 C--N 1.309 -1.538 0 C-N-CA 122.177 1.918 . . . . 4.9400000000000004 110.316 -179.766 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' C' C ' 360' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.244 0 N-CA-C 109.556 -1.418 . . . . 6.5 109.556 -179.961 . . . . . . . . 0 0 . 1 . 021 nuclear build full ' D' D ' 319' ' ' LYS . . . . . . . . . . . . . 3.9 mmtm . . . . . 0 N--CA 1.49 1.537 0 N-CA-C 109.421 -0.585 . . . . 7.5300000000000002 109.421 . . . . . . . . . 0 0 . 1 . 021 nuclear build full ' D' D ' 320' ' ' LYS . . . . . . . . . . . . . 5.1 tttm 60.09 96.7 0.03 OUTLIER 'General case' 0 N--CA 1.488 1.457 0 O-C-N 121.335 -0.853 . . . . 6.4100000000000001 109.34 -179.936 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' D' D ' 321' ' ' LYS . . . . . 0.412 ' HB2' ' HD2' ' D' ' 322' ' ' PRO . 14.7 pttt -80.73 156.09 72.99 Favored Pre-proline 0 N--CA 1.488 1.447 0 O-C-N 121.202 -0.937 . . . . 6.1100000000000003 109.303 -179.972 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' D' D ' 322' ' ' PRO . . . . . 0.412 ' HD2' ' HB2' ' D' ' 321' ' ' LYS . 5.5 Cg_exo -58.52 -157.11 0.01 OUTLIER 'Trans proline' 0 C--N 1.308 -1.571 0 C-N-CA 122.053 1.835 . . . . 2.8199999999999998 110.134 179.929 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' D' D ' 323' ' ' LEU . . . . . 0.414 ' HA ' HD23 ' D' ' 323' ' ' LEU . 35.3 mt -79.37 150.62 31.34 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.181 -0.949 . . . . 2.8300000000000001 109.353 179.9 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' D' D ' 324' ' ' ASP . . . . . 0.416 ' HB2' ' OH ' ' D' ' 327' ' ' TYR . 44.2 m-20 -78.5 -165.48 0.71 Allowed 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.245 -0.91 . . . . 1.54 109.475 -179.756 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' D' D ' 325' ' ' GLY . . . . . . . . . . . . . . . -69.92 -160.81 2.96 Favored Glycine 0 N--CA 1.491 2.306 0 N-CA-C 109.744 -1.342 . . . . 0.58999999999999997 109.744 -179.919 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' D' D ' 326' ' ' GLU . . . . . . . . . . . . . 7.3 mt-10 -59.02 -169.29 0.01 OUTLIER 'General case' 0 N--CA 1.488 1.47 0 O-C-N 121.466 -1.02 . . . . 2.1299999999999999 109.655 -179.92 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' D' D ' 327' ' ' TYR . . . . . 0.595 ' CE1' ' CG ' ' B' ' 333' ' ' ARG . 41.2 m-85 -149.96 115.52 5.53 Favored 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.354 -0.841 . . . . 0.46999999999999997 109.422 -179.973 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' D' D ' 328' ' ' PHE . . . . . 0.504 ' CZ ' ' HB2' ' B' ' 335' ' ' ARG . 76.4 m-85 -113.49 -170.71 1.74 Allowed 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.317 -0.864 . . . . 0.29999999999999999 109.313 179.934 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' D' D ' 329' ' ' THR . . . . . 0.49 ' HA ' ' O ' ' B' ' 330' ' ' LEU . 26.9 p -153.74 167.79 28.44 Favored 'General case' 0 N--CA 1.489 1.499 0 O-C-N 121.221 -0.924 . . . . 0.22 109.428 179.986 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' D' D ' 330' ' ' LEU . . . . . 0.482 ' O ' ' HA ' ' B' ' 329' ' ' THR . 14.7 tp -148.95 126.12 11.41 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.193 -0.942 . . . . 0.28000000000000003 109.478 -179.946 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' D' D ' 331' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -86.28 111.52 20.52 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.218 -0.926 . . . . 0.93000000000000005 109.55 -179.976 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' D' D ' 332' ' ' ILE . . . . . . . . . . . . . 31.8 mt -103.6 110.54 30.29 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.532 0 O-C-N 121.176 -0.953 . . . . 0.25 109.573 179.827 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' D' D ' 333' ' ' ARG . . . . . 0.534 ' CG ' ' CE1' ' B' ' 327' ' ' TYR . 2.4 mpt_? -72.69 143.22 48.16 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.313 -0.867 . . . . 2.9300000000000002 109.239 179.847 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' D' D ' 334' ' ' GLY . . . . . . . . . . . . . . . 84.21 129.91 1.86 Allowed Glycine 0 N--CA 1.49 2.274 0 N-CA-C 109.539 -1.425 . . . . 0.40999999999999998 109.539 -179.856 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' D' D ' 335' ' ' ARG . . . . . 0.482 ' HB2' ' CZ ' ' B' ' 328' ' ' PHE . 6.1 ttm180 -78.79 -28.65 44.63 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.193 -1.18 . . . . 3.0299999999999998 109.6 -179.949 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' D' D ' 336' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -56.53 -67.17 0.33 Allowed 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.201 -0.937 . . . . 2.2599999999999998 109.881 -179.779 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' D' D ' 337' ' ' ARG . . . . . 0.442 ' HG2' HH11 ' D' ' 337' ' ' ARG . 0.8 OUTLIER -60.53 -25.79 66.39 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.216 -0.927 . . . . 2.9199999999999999 109.651 -179.669 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' D' D ' 338' ' ' PHE . . . . . 0.433 ' HB3' ' O ' ' D' ' 335' ' ' ARG . 67.8 t80 -55.47 -60.53 3.29 Favored 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.124 -0.985 . . . . 0.37 109.628 -179.968 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' D' D ' 339' ' ' GLU . . . . . . . . . . . . . 77.2 mt-10 -51.35 -31.84 23.51 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.305 -0.872 . . . . 1.99 109.998 -179.725 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' D' D ' 340' ' ' MET . . . . . . . . . . . . . 9.4 ttp -63.25 -52.65 61.24 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.132 -0.98 . . . . 0.31 109.959 -179.604 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' D' D ' 341' ' ' PHE . . . . . . . . . . . . . 48.6 m-85 -61.57 -41.86 98.01 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.183 -0.948 . . . . 0.17999999999999999 109.786 -179.633 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' D' D ' 342' ' ' ARG . . . . . 0.48 ' NH1' ' HG2' ' D' ' 342' ' ' ARG . 0.0 OUTLIER -50.72 -41.96 56.76 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.241 -0.912 . . . . 2.4100000000000001 109.845 -179.809 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' D' D ' 343' ' ' GLU . . . . . . . . . . . . . 28.3 tt0 -59.54 -50.56 73.44 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.258 -0.901 . . . . 2.3500000000000001 110.251 -179.478 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' D' D ' 344' ' ' LEU . . . . . 0.637 HD22 HD22 ' C' ' 344' ' ' LEU . 40.3 mt -61.47 -29.85 70.22 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.143 -0.973 . . . . 0.19 109.834 -179.463 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' D' D ' 345' ' ' ASN . . . . . 0.417 ' O ' ' HG3' ' D' ' 349' ' ' GLU . 29.3 t-20 -57.59 -57.02 14.53 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.173 -0.954 . . . . 1.0900000000000001 110.002 -179.659 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' D' D ' 346' ' ' GLU . . . . . . . . . . . . . 70.6 tt0 -61.47 -29.56 70.04 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.182 -0.949 . . . . 1.6899999999999999 110.203 -179.427 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' D' D ' 347' ' ' ALA . . . . . 0.772 ' HB1' ' HB1' ' C' ' 347' ' ' ALA . . . -60.07 -55.69 30.89 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.059 -1.026 . . . . 0.17999999999999999 110.096 -179.562 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' D' D ' 348' ' ' LEU . . . . . 0.578 HD22 ' N ' ' D' ' 348' ' ' LEU . 4.2 mm? -62.07 -44.43 96.69 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.234 -0.916 . . . . 0.31 110.074 -179.409 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' D' D ' 349' ' ' GLU . . . . . 0.417 ' HG3' ' O ' ' D' ' 345' ' ' ASN . 56.9 mt-10 -57.64 -35.65 70.79 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.209 -0.932 . . . . 1.95 109.953 -179.479 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' D' D ' 350' ' ' LEU . . . . . 0.675 HD22 HD13 ' C' ' 350' ' ' LEU . 6.1 tt -64.49 -40.07 94.98 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.211 -0.93 . . . . 0.42999999999999999 109.736 -179.847 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' D' D ' 351' ' ' LYS . . . . . . . . . . . . . 2.3 ttmt -58.02 -56.35 23.2 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.282 -0.886 . . . . 1.3999999999999999 109.829 -179.633 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' D' D ' 352' ' ' ASP . . . . . . . . . . . . . 11.9 m-20 -56.97 -37.33 71.42 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.145 -0.972 . . . . 1.1699999999999999 109.773 -179.769 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' D' D ' 353' ' ' ALA . . . . . . . . . . . . . . . -67.4 -26.26 66.35 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.226 -0.921 . . . . 0.58999999999999997 110.065 -179.493 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' D' D ' 354' ' ' GLN . . . . . 0.433 ' OE1' HD11 ' C' ' 350' ' ' LEU . 3.3 mt-30 -83.73 -12.54 55.67 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.042 -1.036 . . . . 1.4399999999999999 109.915 -179.723 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' D' D ' 355' ' ' ALA . . . . . . . . . . . . . . . -73.1 -22.08 60.64 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.035 -1.04 . . . . 0.97999999999999998 109.363 179.751 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' D' D ' 356' ' ' GLY . . . . . . . . . . . . . . . -81.6 17.0 16.33 Favored Glycine 0 N--CA 1.491 2.341 0 N-CA-C 110.275 -1.13 . . . . 1.28 110.275 -179.959 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' D' D ' 357' ' ' LYS . . . . . . . . . . . . . 41.0 tttt -85.52 111.7 20.25 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 120.941 -1.329 . . . . 4.0899999999999999 109.653 -179.675 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' D' D ' 358' ' ' GLU . . . . . . . . . . . . . 5.2 mt-10 -48.66 112.93 2.62 Favored Pre-proline 0 N--CA 1.49 1.528 0 O-C-N 121.249 -0.907 . . . . 5.71 109.347 179.826 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' D' D ' 359' ' ' PRO . . . . . . . . . . . . . 2.3 Cg_endo -61.56 137.66 70.64 Favored 'Trans proline' 0 C--N 1.312 -1.378 0 C-N-CA 121.996 1.797 . . . . 4.9699999999999998 110.25 -179.88 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' D' D ' 360' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.334 0 CA-C-O 117.963 -1.465 . . . . 6.9699999999999998 109.562 -179.972 . . . . . . . . 0 0 . 1 . 022 nuclear build full ' A' A ' 319' ' ' LYS . . . . . . . . . . . . . 1.2 mtpt . . . . . 0 N--CA 1.49 1.541 0 CA-C-O 121.234 0.54 . . . . 7.5499999999999998 109.572 . . . . . . . . . 0 0 . 1 . 022 nuclear build full ' A' A ' 320' ' ' LYS . . . . . 0.446 ' O ' ' HG2' ' A' ' 321' ' ' LYS . 4.6 mttm 62.96 168.15 0.13 Allowed 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.357 -0.839 . . . . 6.4299999999999997 109.811 179.838 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 321' ' ' LYS . . . . . 0.446 ' HG2' ' O ' ' A' ' 320' ' ' LYS . 26.2 mtmt -156.78 91.52 2.49 Favored Pre-proline 0 N--CA 1.491 1.584 0 O-C-N 121.407 -0.808 . . . . 6.1299999999999999 109.125 179.779 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 322' ' ' PRO . . . . . . . . . . . . . 2.1 Cg_endo -68.13 -1.05 6.41 Favored 'Trans proline' 0 C--N 1.31 -1.487 0 C-N-CA 122.243 1.962 . . . . 2.8300000000000001 110.954 -179.628 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 323' ' ' LEU . . . . . . . . . . . . . 25.7 mt -80.79 90.69 5.86 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 120.787 -1.195 . . . . 2.8300000000000001 109.424 179.997 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 324' ' ' ASP . . . . . . . . . . . . . 14.3 m-20 -84.29 -154.8 0.17 Allowed 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.244 -0.91 . . . . 1.53 109.485 179.922 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 325' ' ' GLY . . . . . . . . . . . . . . . -69.85 -161.46 3.17 Favored Glycine 0 N--CA 1.491 2.354 0 N-CA-C 109.709 -1.356 . . . . 0.60999999999999999 109.709 179.887 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 326' ' ' GLU . . . . . . . . . . . . . 7.1 mt-10 -59.18 -170.32 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.246 -1.149 . . . . 2.1299999999999999 109.404 179.963 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 327' ' ' TYR . . . . . 0.611 ' CE1' ' HG2' ' C' ' 333' ' ' ARG . 45.4 m-85 -149.85 112.28 4.71 Favored 'General case' 0 N--CA 1.489 1.491 0 O-C-N 121.249 -0.907 . . . . 0.47999999999999998 109.838 -179.997 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 328' ' ' PHE . . . . . 0.409 ' C ' HG23 ' A' ' 329' ' ' THR . 75.5 m-85 -113.71 -173.85 2.35 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.341 -0.85 . . . . 0.31 109.171 179.709 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 329' ' ' THR . . . . . 0.409 HG23 ' C ' ' A' ' 328' ' ' PHE . 73.2 p -153.38 164.21 38.56 Favored 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.184 -0.948 . . . . 0.22 109.268 -179.891 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 330' ' ' LEU . . . . . . . . . . . . . 15.4 tp -149.74 125.93 10.7 Favored 'General case' 0 N--CA 1.488 1.46 0 O-C-N 121.207 -0.933 . . . . 0.28000000000000003 109.666 -179.853 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 331' ' ' GLN . . . . . . . . . . . . . 1.6 tt0 -87.4 114.44 24.01 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.302 -0.874 . . . . 0.91000000000000003 109.321 179.817 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 332' ' ' ILE . . . . . 0.484 HG21 ' HA ' ' A' ' 338' ' ' PHE . 57.9 mt -103.37 104.42 16.62 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.592 0 O-C-N 121.261 -0.9 . . . . 0.26000000000000001 109.739 -179.867 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 333' ' ' ARG . . . . . . . . . . . . . 9.9 mtm180 -72.05 139.17 48.36 Favored 'General case' 0 N--CA 1.488 1.456 0 O-C-N 121.322 -0.861 . . . . 2.9199999999999999 109.246 179.64 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 334' ' ' GLY . . . . . . . . . . . . . . . 92.89 131.53 5.77 Favored Glycine 0 N--CA 1.49 2.298 0 N-CA-C 109.407 -1.477 . . . . 0.40000000000000002 109.407 -179.789 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 335' ' ' ARG . . . . . . . . . . . . . 2.0 ttt180 -78.21 -32.92 50.19 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.303 -1.116 . . . . 3.0099999999999998 109.488 -179.855 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 336' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -58.17 -61.5 2.52 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.133 -0.979 . . . . 2.29 109.696 -179.895 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 337' ' ' ARG . . . . . . . . . . . . . 5.3 mtt180 -60.45 -34.56 74.18 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.173 -0.955 . . . . 2.9300000000000002 109.705 -179.889 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 338' ' ' PHE . . . . . 0.484 ' HA ' HG21 ' A' ' 332' ' ' ILE . 78.8 t80 -54.05 -60.45 3.32 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.222 -0.924 . . . . 0.38 109.631 -179.704 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 339' ' ' GLU . . . . . . . . . . . . . 95.7 mt-10 -50.89 -33.88 25.94 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.216 -0.928 . . . . 1.97 109.999 -179.615 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 340' ' ' MET . . . . . . . . . . . . . 32.2 ttp -64.01 -50.98 66.36 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.068 -1.02 . . . . 0.31 110.063 -179.635 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 341' ' ' PHE . . . . . . . . . . . . . 37.1 m-85 -61.57 -47.56 84.94 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.128 -0.983 . . . . 0.17999999999999999 109.78 -179.497 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 342' ' ' ARG . . . . . . . . . . . . . 1.4 ttt180 -49.46 -39.4 33.3 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.173 -0.954 . . . . 2.4199999999999999 109.598 -179.913 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 343' ' ' GLU . . . . . . . . . . . . . 2.7 tt0 -58.51 -49.47 77.28 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.14 -0.975 . . . . 2.3500000000000001 109.437 -179.95 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 344' ' ' LEU . . . . . 0.722 HD22 ' CD2' ' B' ' 344' ' ' LEU . 73.9 mt -62.3 -29.7 70.62 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.278 -0.889 . . . . 0.17999999999999999 109.334 179.824 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 345' ' ' ASN . . . . . . . . . . . . . 11.2 t-20 -57.77 -54.17 49.92 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.323 -0.861 . . . . 1.0900000000000001 109.581 179.907 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 346' ' ' GLU . . . . . . . . . . . . . 1.2 tp10 -62.13 -28.68 69.81 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.279 -0.888 . . . . 1.6499999999999999 109.785 -179.768 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 347' ' ' ALA . . . . . 1.08 ' HB1' ' HB1' ' B' ' 347' ' ' ALA . . . -61.76 -62.2 1.97 Allowed 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.116 -0.99 . . . . 0.17999999999999999 110.032 -179.632 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 348' ' ' LEU . . . . . 0.546 HD22 ' N ' ' A' ' 348' ' ' LEU . 3.9 mm? -61.36 -44.61 96.87 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.259 -0.901 . . . . 0.29999999999999999 110.112 -179.369 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 349' ' ' GLU . . . . . . . . . . . . . 3.1 mt-10 -56.9 -35.77 69.36 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.188 -0.945 . . . . 1.9399999999999999 109.83 -179.388 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 350' ' ' LEU . . . . . 0.698 HD13 HD22 ' B' ' 350' ' ' LEU . 5.9 tt -64.93 -45.67 84.84 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.243 -0.91 . . . . 0.46000000000000002 109.669 -179.962 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 351' ' ' LYS . . . . . . . . . . . . . 22.0 tttt -59.06 -41.21 87.39 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.246 -0.909 . . . . 1.3999999999999999 109.303 -179.983 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 352' ' ' ASP . . . . . . . . . . . . . 11.9 m-20 -56.39 -50.22 72.22 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.33 -0.856 . . . . 1.1599999999999999 109.494 179.855 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 353' ' ' ALA . . . . . . . . . . . . . . . -68.63 -15.8 63.64 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.375 -0.828 . . . . 0.63 109.566 179.987 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 354' ' ' GLN . . . . . . . . . . . . . 2.2 mt-30 -82.75 -7.02 59.68 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.21 -0.931 . . . . 1.47 109.58 -179.968 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 355' ' ' ALA . . . . . . . . . . . . . . . -70.53 -5.0 25.79 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.215 -0.928 . . . . 1.01 109.623 179.957 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 356' ' ' GLY . . . . . . . . . . . . . . . -75.25 -83.07 0.42 Allowed Glycine 0 N--CA 1.49 2.262 0 N-CA-C 109.379 -1.488 . . . . 1.3 109.379 179.793 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 357' ' ' LYS . . . . . . . . . . . . . 2.4 tttt -86.54 136.47 33.06 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.254 -1.145 . . . . 4.0999999999999996 109.182 179.832 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 358' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -49.06 159.87 0.55 Allowed Pre-proline 0 N--CA 1.489 1.497 0 O-C-N 121.177 -0.952 . . . . 5.75 109.429 -179.859 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 359' ' ' PRO . . . . . . . . . . . . . 2.5 Cg_endo -61.56 150.33 85.86 Favored 'Trans proline' 0 C--N 1.309 -1.519 0 C-N-CA 122.301 2.001 . . . . 5.0 110.149 179.941 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 360' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.298 0 CA-C-O 117.945 -1.475 . . . . 6.9699999999999998 109.572 -179.926 . . . . . . . . 0 0 . 1 . 022 nuclear build full ' B' B ' 319' ' ' LYS . . . . . . . . . . . . . 1.3 mtpt . . . . . 0 N--CA 1.49 1.532 0 CA-C-O 121.279 0.562 . . . . 7.5499999999999998 109.509 . . . . . . . . . 0 0 . 1 . 022 nuclear build full ' B' B ' 320' ' ' LYS . . . . . 0.451 ' O ' ' HG2' ' B' ' 321' ' ' LYS . 4.7 mttm 63.22 168.52 0.14 Allowed 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.392 -0.818 . . . . 6.4400000000000004 109.831 179.854 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' B' B ' 321' ' ' LYS . . . . . 0.451 ' HG2' ' O ' ' B' ' 320' ' ' LYS . 27.1 mtmt -157.05 91.1 2.45 Favored Pre-proline 0 N--CA 1.491 1.582 0 O-C-N 121.38 -0.825 . . . . 6.1299999999999999 109.209 179.91 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' B' B ' 322' ' ' PRO . . . . . . . . . . . . . 2.3 Cg_endo -68.03 -0.93 6.16 Favored 'Trans proline' 0 C--N 1.309 -1.544 0 C-N-CA 122.267 1.978 . . . . 2.8199999999999998 111.018 -179.609 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 323' ' ' LEU . . . . . . . . . . . . . 25.8 mt -80.93 90.41 5.93 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 120.817 -1.177 . . . . 2.8399999999999999 109.535 179.9 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 324' ' ' ASP . . . . . . . . . . . . . 13.0 m-20 -84.11 -154.14 0.16 Allowed 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.235 -0.916 . . . . 1.53 109.68 179.849 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 325' ' ' GLY . . . . . . . . . . . . . . . -70.59 -161.44 3.79 Favored Glycine 0 N--CA 1.49 2.272 0 N-CA-C 109.596 -1.402 . . . . 0.58999999999999997 109.596 -179.92 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 326' ' ' GLU . . . . . . . . . . . . . 7.2 mt-10 -58.92 -170.44 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.287 -1.125 . . . . 2.1299999999999999 109.536 179.983 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 327' ' ' TYR . . . . . . . . . . . . . 44.2 m-85 -149.76 112.26 4.73 Favored 'General case' 0 N--CA 1.489 1.493 0 O-C-N 121.272 -0.893 . . . . 0.47999999999999998 109.732 -179.97 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 328' ' ' PHE . . . . . 0.481 ' HB2' ' CD1' ' D' ' 338' ' ' PHE . 75.8 m-85 -113.74 -173.72 2.33 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.323 -0.861 . . . . 0.32000000000000001 109.146 179.676 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' B' B ' 329' ' ' THR . . . . . 0.42 HG23 ' C ' ' B' ' 328' ' ' PHE . 71.6 p -153.47 164.51 38.07 Favored 'General case' 0 N--CA 1.488 1.429 0 O-C-N 121.272 -0.892 . . . . 0.23000000000000001 109.363 179.921 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' B' B ' 330' ' ' LEU . . . . . . . . . . . . . 15.8 tp -149.89 126.47 10.93 Favored 'General case' 0 C--N 1.302 -1.457 0 O-C-N 121.215 -0.928 . . . . 0.28000000000000003 109.556 -179.842 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 331' ' ' GLN . . . . . . . . . . . . . 1.6 tt0 -87.85 114.6 24.62 Favored 'General case' 0 N--CA 1.489 1.493 0 O-C-N 121.258 -0.901 . . . . 0.91000000000000003 109.276 179.829 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 332' ' ' ILE . . . . . 0.498 HG21 ' HA ' ' B' ' 338' ' ' PHE . 57.8 mt -103.41 104.59 16.9 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.493 0 O-C-N 121.217 -0.927 . . . . 0.23999999999999999 109.709 -179.878 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' B' B ' 333' ' ' ARG . . . . . . . . . . . . . 10.3 mtm180 -72.25 139.06 47.9 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.237 -0.914 . . . . 2.9300000000000002 109.12 179.717 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 334' ' ' GLY . . . . . . . . . . . . . . . 92.94 131.94 5.93 Favored Glycine 0 N--CA 1.491 2.326 0 N-CA-C 109.392 -1.483 . . . . 0.40000000000000002 109.392 -179.776 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 335' ' ' ARG . . . . . 0.454 ' HA ' ' CE1' ' D' ' 328' ' ' PHE . 2.0 ttt180 -78.53 -32.93 48.21 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.209 -1.171 . . . . 3.0099999999999998 109.587 -179.855 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' B' B ' 336' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -58.08 -61.75 2.32 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.235 -0.916 . . . . 2.2799999999999998 109.633 -179.983 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' B' B ' 337' ' ' ARG . . . . . . . . . . . . . 5.0 mtt180 -60.2 -34.79 74.11 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.242 -0.911 . . . . 2.9300000000000002 109.695 -179.756 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 338' ' ' PHE . . . . . 0.524 ' CD1' ' HB2' ' D' ' 328' ' ' PHE . 79.9 t80 -53.87 -60.55 3.18 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.319 -0.863 . . . . 0.37 109.763 -179.833 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' B' B ' 339' ' ' GLU . . . . . . . . . . . . . 95.0 mt-10 -50.94 -33.76 25.8 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.233 -0.917 . . . . 1.98 110.114 -179.632 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 340' ' ' MET . . . . . . . . . . . . . 32.7 ttp -64.34 -50.44 67.77 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.101 -0.999 . . . . 0.32000000000000001 109.975 -179.607 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 341' ' ' PHE . . . . . . . . . . . . . 37.4 m-85 -61.87 -47.2 86.06 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.174 -0.954 . . . . 0.17999999999999999 110.0 -179.69 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 342' ' ' ARG . . . . . . . . . . . . . 1.5 ttt180 -49.84 -39.3 38.53 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.155 -0.966 . . . . 2.4199999999999999 109.605 179.947 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 343' ' ' GLU . . . . . . . . . . . . . 2.7 tt0 -58.52 -49.68 76.49 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.292 -0.88 . . . . 2.3500000000000001 109.352 -179.991 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 344' ' ' LEU . . . . . 0.722 ' CD2' HD22 ' A' ' 344' ' ' LEU . 74.6 mt -62.25 -29.59 70.51 Favored 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.298 -0.876 . . . . 0.17999999999999999 109.295 179.884 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' B' B ' 345' ' ' ASN . . . . . . . . . . . . . 11.4 t-20 -57.96 -54.07 51.04 Favored 'General case' 0 N--CA 1.488 1.472 0 O-C-N 121.283 -0.886 . . . . 1.0900000000000001 109.462 -179.946 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 346' ' ' GLU . . . . . . . . . . . . . 1.2 tp10 -62.15 -28.93 69.99 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.287 -0.883 . . . . 1.6599999999999999 109.765 -179.75 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 347' ' ' ALA . . . . . 1.08 ' HB1' ' HB1' ' A' ' 347' ' ' ALA . . . -61.76 -61.85 2.21 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.191 -0.943 . . . . 0.17000000000000001 110.209 -179.625 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' B' B ' 348' ' ' LEU . . . . . 0.555 HD22 ' N ' ' B' ' 348' ' ' LEU . 3.9 mm? -61.66 -44.56 96.73 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.151 -0.968 . . . . 0.28999999999999998 110.074 -179.445 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' B' B ' 349' ' ' GLU . . . . . . . . . . . . . 3.1 mt-10 -56.7 -35.98 69.13 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.167 -0.958 . . . . 1.95 109.848 -179.444 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 350' ' ' LEU . . . . . 0.698 HD22 HD13 ' A' ' 350' ' ' LEU . 6.0 tt -64.72 -45.78 85.08 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.177 -0.952 . . . . 0.45000000000000001 109.596 -179.946 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' B' B ' 351' ' ' LYS . . . . . . . . . . . . . 22.1 tttt -58.93 -41.21 86.81 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.365 -0.834 . . . . 1.3799999999999999 109.283 -179.922 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 352' ' ' ASP . . . . . . . . . . . . . 12.1 m-20 -56.28 -50.45 71.34 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.31 -0.869 . . . . 1.1599999999999999 109.422 179.862 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 353' ' ' ALA . . . . . . . . . . . . . . . -68.68 -15.63 63.58 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.287 -0.883 . . . . 0.60999999999999999 109.501 -179.909 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 354' ' ' GLN . . . . . . . . . . . . . 2.1 mt-30 -82.91 -6.95 59.68 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.193 -0.942 . . . . 1.45 109.561 -179.957 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 355' ' ' ALA . . . . . . . . . . . . . . . -70.68 -4.88 25.8 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.223 -0.923 . . . . 0.97999999999999998 109.629 -179.923 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 356' ' ' GLY . . . . . . . . . . . . . . . -75.41 -82.98 0.44 Allowed Glycine 0 N--CA 1.49 2.291 0 N-CA-C 109.386 -1.486 . . . . 1.29 109.386 179.86 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 357' ' ' LYS . . . . . . . . . . . . . 2.3 tttt -86.66 135.96 33.21 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.275 -1.133 . . . . 4.0899999999999999 109.209 179.751 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 358' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -48.8 159.72 0.53 Allowed Pre-proline 0 N--CA 1.489 1.514 0 O-C-N 121.211 -0.931 . . . . 5.7199999999999998 109.555 -179.829 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' B' B ' 359' ' ' PRO . . . . . . . . . . . . . 2.5 Cg_endo -61.5 150.41 85.36 Favored 'Trans proline' 0 C--N 1.31 -1.495 0 C-N-CA 122.192 1.928 . . . . 4.9800000000000004 110.219 179.851 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 360' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.276 0 CA-C-O 118.015 -1.436 . . . . 6.9800000000000004 109.563 -179.992 . . . . . . . . 0 0 . 1 . 022 nuclear build full ' C' C ' 319' ' ' LYS . . . . . . . . . . . . . 2.5 ttmt . . . . . 0 N--CA 1.491 1.616 0 N-CA-C 109.407 -0.59 . . . . 6.8200000000000003 109.407 . . . . . . . . . 0 0 . 1 . 022 nuclear build full ' C' C ' 320' ' ' LYS . . . . . 0.45 ' O ' ' HG3' ' C' ' 321' ' ' LYS . 0.0 OUTLIER 68.75 -162.85 0.19 Allowed 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.254 -0.904 . . . . 6.4900000000000002 109.596 -179.939 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' C' C ' 321' ' ' LYS . . . . . 0.45 ' HG3' ' O ' ' C' ' 320' ' ' LYS . 4.5 mttt -157.11 158.78 31.27 Favored Pre-proline 0 N--CA 1.491 1.581 0 O-C-N 121.287 -0.883 . . . . 6.4000000000000004 109.49 -179.809 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' C' C ' 322' ' ' PRO . . . . . . . . . . . . . 2.7 Cg_endo -60.86 171.05 3.98 Favored 'Trans proline' 0 C--N 1.309 -1.501 0 C-N-CA 122.273 1.982 . . . . 3.4199999999999999 110.306 179.812 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' C' C ' 323' ' ' LEU . . . . . . . . . . . . . 56.2 mt -80.61 149.51 29.84 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.248 -0.908 . . . . 3.9500000000000002 109.605 179.909 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' C' C ' 324' ' ' ASP . . . . . . . . . . . . . 8.7 m-20 -78.67 165.9 23.12 Favored 'General case' 0 N--CA 1.489 1.494 0 O-C-N 121.243 -0.911 . . . . 1.6299999999999999 108.897 179.607 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' C' C ' 325' ' ' GLY . . . . . . . . . . . . . . . -66.86 167.7 37.88 Favored Glycine 0 N--CA 1.49 2.245 0 N-CA-C 109.53 -1.428 . . . . 0.72999999999999998 109.53 -179.808 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' C' C ' 326' ' ' GLU . . . . . . . . . . . . . 3.6 mp0 -58.11 -169.39 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.297 -1.12 . . . . 2.1699999999999999 109.355 -179.899 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' C' C ' 327' ' ' TYR . . . . . . . . . . . . . 38.4 m-85 -150.18 105.56 3.38 Favored 'General case' 0 N--CA 1.488 1.451 0 O-C-N 121.234 -0.916 . . . . 0.47999999999999998 110.085 179.922 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' C' C ' 328' ' ' PHE . . . . . 0.42 ' HB3' ' CE1' ' A' ' 338' ' ' PHE . 87.8 m-85 -113.97 -174.42 2.47 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.455 -0.778 . . . . 0.33000000000000002 108.94 179.531 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' C' C ' 329' ' ' THR . . . . . . . . . . . . . 19.8 p -151.55 164.41 36.89 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.108 -0.995 . . . . 0.23000000000000001 109.466 -179.942 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' C' C ' 330' ' ' LEU . . . . . . . . . . . . . 15.1 tp -150.86 130.52 13.12 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.151 -0.968 . . . . 0.28000000000000003 109.824 -179.742 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' C' C ' 331' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -88.51 112.48 23.05 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.342 -0.849 . . . . 1.48 109.394 179.691 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' C' C ' 332' ' ' ILE . . . . . 0.415 HD13 ' CD2' ' C' ' 341' ' ' PHE . 64.5 mt -103.68 102.81 14.22 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.653 0 O-C-N 121.138 -0.976 . . . . 0.23999999999999999 109.994 -179.83 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' C' C ' 333' ' ' ARG . . . . . 0.611 ' HG2' ' CE1' ' A' ' 327' ' ' TYR . 2.4 mtp180 -72.69 156.32 39.07 Favored 'General case' 0 N--CA 1.488 1.47 0 O-C-N 121.262 -0.899 . . . . 2.7400000000000002 109.201 179.518 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' C' C ' 334' ' ' GLY . . . . . . . . . . . . . . . 80.06 128.92 0.75 Allowed Glycine 0 N--CA 1.491 2.329 0 N-CA-C 109.66 -1.376 . . . . 0.34999999999999998 109.66 179.856 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' C' C ' 335' ' ' ARG . . . . . . . . . . . . . 20.8 ttt180 -79.28 -33.03 43.76 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.401 -1.058 . . . . 2.5299999999999998 109.508 -179.999 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' C' C ' 336' ' ' GLU . . . . . 0.469 ' HA ' ' OE1' ' C' ' 339' ' ' GLU . 0.0 OUTLIER -58.08 -62.05 2.1 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.189 -0.944 . . . . 2.6200000000000001 109.773 -179.781 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' C' C ' 337' ' ' ARG . . . . . 0.551 ' HG2' ' NH1' ' C' ' 337' ' ' ARG . 0.1 OUTLIER -59.85 -30.88 69.26 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.235 -0.916 . . . . 2.8100000000000001 109.843 -179.672 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' C' C ' 338' ' ' PHE . . . . . . . . . . . . . 72.4 t80 -55.53 -54.87 38.59 Favored 'General case' 0 N--CA 1.488 1.457 0 O-C-N 121.158 -0.963 . . . . 0.40000000000000002 109.681 -179.911 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' C' C ' 339' ' ' GLU . . . . . 0.469 ' OE1' ' HA ' ' C' ' 336' ' ' GLU . 3.0 mt-10 -52.58 -39.24 61.37 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.204 -0.935 . . . . 2.0499999999999998 110.325 -179.582 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' C' C ' 340' ' ' MET . . . . . . . . . . . . . 36.3 ttp -62.35 -46.25 89.53 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.157 -0.965 . . . . 0.32000000000000001 110.0 -179.334 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' C' C ' 341' ' ' PHE . . . . . 0.415 ' CD2' HD13 ' C' ' 332' ' ' ILE . 32.7 m-85 -63.14 -43.22 98.95 Favored 'General case' 0 N--CA 1.489 1.5 0 O-C-N 121.174 -0.954 . . . . 0.17999999999999999 110.021 -179.609 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' C' C ' 342' ' ' ARG . . . . . . . . . . . . . 39.7 ttt180 -51.96 -42.92 63.26 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.216 -0.927 . . . . 2.9100000000000001 110.028 -179.773 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' C' C ' 343' ' ' GLU . . . . . . . . . . . . . 2.5 tt0 -57.32 -48.27 79.4 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.145 -0.972 . . . . 2.1400000000000001 109.461 -179.649 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' C' C ' 344' ' ' LEU . . . . . 0.471 ' CD2' HD22 ' D' ' 344' ' ' LEU . 37.0 mt -62.96 -30.55 71.66 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.205 -0.935 . . . . 0.22 109.357 179.866 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' C' C ' 345' ' ' ASN . . . . . 0.444 ' O ' ' HG3' ' C' ' 349' ' ' GLU . 18.1 t-20 -59.07 -61.35 2.7 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.311 -0.868 . . . . 1.0800000000000001 109.687 -179.829 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' C' C ' 346' ' ' GLU . . . . . . . . . . . . . 17.0 tp10 -61.22 -25.69 67.23 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.317 -0.864 . . . . 2.21 109.866 -179.608 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' C' C ' 347' ' ' ALA . . . . . 0.982 ' HB1' ' HB1' ' D' ' 347' ' ' ALA . . . -61.39 -58.34 8.6 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.215 -0.928 . . . . 0.17999999999999999 109.987 -179.697 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' C' C ' 348' ' ' LEU . . . . . 0.535 ' N ' HD22 ' C' ' 348' ' ' LEU . 3.8 mm? -62.4 -44.39 96.56 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.208 -0.932 . . . . 0.32000000000000001 110.147 -179.288 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' C' C ' 349' ' ' GLU . . . . . 0.444 ' HG3' ' O ' ' C' ' 345' ' ' ASN . 22.0 mt-10 -56.08 -38.6 70.91 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.141 -0.974 . . . . 2.1899999999999999 109.887 -179.32 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' C' C ' 350' ' ' LEU . . . . . 0.689 HD22 HD13 ' D' ' 350' ' ' LEU . 6.1 tt -62.78 -40.37 97.11 Favored 'General case' 0 N--CA 1.489 1.493 0 O-C-N 121.156 -0.965 . . . . 0.46000000000000002 109.537 -179.739 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' C' C ' 351' ' ' LYS . . . . . 0.511 ' HA ' ' OE1' ' C' ' 354' ' ' GLN . 11.3 tttt -60.19 -39.98 88.4 Favored 'General case' 0 N--CA 1.489 1.482 0 O-C-N 121.235 -0.915 . . . . 1.3500000000000001 109.585 179.999 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' C' C ' 352' ' ' ASP . . . . . 0.456 ' N ' ' OD1' ' C' ' 352' ' ' ASP . 4.6 m-20 -59.25 -42.36 90.95 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.249 -0.907 . . . . 1.1899999999999999 109.763 -179.99 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' C' C ' 353' ' ' ALA . . . . . . . . . . . . . . . -67.82 -14.78 63.23 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.251 -0.906 . . . . 0.56999999999999995 110.081 -179.358 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' C' C ' 354' ' ' GLN . . . . . 0.541 ' OE1' ' CD1' ' D' ' 350' ' ' LEU . 36.6 mt-30 -82.37 -16.32 49.58 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.004 -1.06 . . . . 1.47 109.436 -179.943 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' C' C ' 355' ' ' ALA . . . . . . . . . . . . . . . -74.1 -3.04 27.12 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.232 -0.917 . . . . 0.93000000000000005 109.803 179.628 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' C' C ' 356' ' ' GLY . . . . . . . . . . . . . . . -78.16 -43.46 13.41 Favored Glycine 0 N--CA 1.491 2.361 0 N-CA-C 109.901 -1.28 . . . . 1.3300000000000001 109.901 -179.639 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' C' C ' 357' ' ' LYS . . . . . 0.404 ' O ' ' HG3' ' C' ' 357' ' ' LYS . 23.0 pttt -85.45 128.07 34.61 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.12 -1.224 . . . . 4.0099999999999998 109.273 -179.963 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' C' C ' 358' ' ' GLU . . . . . 0.434 ' OE2' ' HA3' ' C' ' 360' ' ' GLY . 0.2 OUTLIER -47.04 155.79 0.61 Allowed Pre-proline 0 N--CA 1.489 1.509 0 O-C-N 121.214 -0.928 . . . . 5.75 109.464 -179.775 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' C' C ' 359' ' ' PRO . . . . . . . . . . . . . 6.0 Cg_exo -58.01 86.33 0.05 OUTLIER 'Trans proline' 0 C--N 1.31 -1.488 0 C-N-CA 122.169 1.913 . . . . 4.9400000000000004 110.336 -179.927 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' C' C ' 360' ' ' GLY . . . . . 0.434 ' HA3' ' OE2' ' C' ' 358' ' ' GLU . . . . . . . . 0 N--CA 1.49 2.287 0 N-CA-C 109.433 -1.467 . . . . 6.5 109.433 -179.964 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' D' D ' 319' ' ' LYS . . . . . . . . . . . . . 1.4 mtpt . . . . . 0 N--CA 1.491 1.576 0 CA-C-O 121.298 0.57 . . . . 7.5300000000000002 109.517 . . . . . . . . . 0 0 . 1 . 022 nuclear build full ' D' D ' 320' ' ' LYS . . . . . 0.441 ' O ' ' CG ' ' D' ' 321' ' ' LYS . 4.6 mttm 63.39 168.15 0.14 Allowed 'General case' 0 N--CA 1.489 1.492 0 O-C-N 121.333 -0.855 . . . . 6.4100000000000001 109.878 179.894 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' D' D ' 321' ' ' LYS . . . . . 0.441 ' CG ' ' O ' ' D' ' 320' ' ' LYS . 27.3 mtmt -156.79 91.37 2.5 Favored Pre-proline 0 N--CA 1.491 1.593 0 O-C-N 121.486 -0.759 . . . . 6.1100000000000003 109.212 179.897 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' D' D ' 322' ' ' PRO . . . . . . . . . . . . . 2.2 Cg_endo -68.14 -1.25 6.78 Favored 'Trans proline' 0 C--N 1.31 -1.478 0 C-N-CA 122.227 1.951 . . . . 2.8199999999999998 111.037 -179.73 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' D' D ' 323' ' ' LEU . . . . . . . . . . . . . 27.3 mt -80.67 90.4 5.77 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 120.928 -1.107 . . . . 2.8300000000000001 109.503 179.945 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' D' D ' 324' ' ' ASP . . . . . . . . . . . . . 13.8 m-20 -84.09 -154.23 0.16 Allowed 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.274 -0.891 . . . . 1.54 109.601 179.891 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' D' D ' 325' ' ' GLY . . . . . . . . . . . . . . . -70.24 -161.33 3.44 Favored Glycine 0 N--CA 1.49 2.281 0 N-CA-C 109.693 -1.363 . . . . 0.58999999999999997 109.693 179.942 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' D' D ' 326' ' ' GLU . . . . . . . . . . . . . 6.9 mt-10 -59.38 -170.3 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.339 -1.094 . . . . 2.1299999999999999 109.485 179.919 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' D' D ' 327' ' ' TYR . . . . . . . . . . . . . 44.5 m-85 -150.0 112.45 4.71 Favored 'General case' 0 N--CA 1.489 1.485 0 O-C-N 121.23 -0.919 . . . . 0.46999999999999997 109.737 -179.935 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' D' D ' 328' ' ' PHE . . . . . 0.524 ' HB2' ' CD1' ' B' ' 338' ' ' PHE . 75.3 m-85 -113.78 -173.55 2.3 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.377 -0.827 . . . . 0.29999999999999999 109.173 179.673 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' D' D ' 329' ' ' THR . . . . . 0.41 HG23 ' C ' ' D' ' 328' ' ' PHE . 67.3 p -153.41 164.4 38.23 Favored 'General case' 0 N--CA 1.488 1.445 0 O-C-N 121.249 -0.907 . . . . 0.22 109.28 179.987 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' D' D ' 330' ' ' LEU . . . . . . . . . . . . . 15.4 tp -150.04 125.96 10.5 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.218 -0.926 . . . . 0.28000000000000003 109.551 -179.837 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' D' D ' 331' ' ' GLN . . . . . . . . . . . . . 1.5 tt0 -87.24 114.7 24.08 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.367 -0.833 . . . . 0.93000000000000005 109.327 179.799 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' D' D ' 332' ' ' ILE . . . . . 0.506 HG21 ' HA ' ' D' ' 338' ' ' PHE . 58.2 mt -103.3 104.55 16.82 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.514 0 O-C-N 121.089 -1.007 . . . . 0.25 109.741 -179.912 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' D' D ' 333' ' ' ARG . . . . . . . . . . . . . 10.4 mtm180 -72.34 138.67 47.46 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.176 -0.953 . . . . 2.9300000000000002 109.243 179.728 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' D' D ' 334' ' ' GLY . . . . . . . . . . . . . . . 92.93 131.1 5.63 Favored Glycine 0 N--CA 1.49 2.3 0 N-CA-C 109.482 -1.447 . . . . 0.40999999999999998 109.482 -179.78 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' D' D ' 335' ' ' ARG . . . . . 0.441 ' HA ' ' CE1' ' B' ' 328' ' ' PHE . 2.0 ttt180 -77.33 -33.15 55.55 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.225 -1.162 . . . . 3.0299999999999998 109.675 -179.858 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' D' D ' 336' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -58.13 -61.13 2.78 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.129 -0.982 . . . . 2.2599999999999998 109.722 -179.79 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' D' D ' 337' ' ' ARG . . . . . . . . . . . . . 5.4 mtt180 -60.97 -34.11 74.25 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.296 -0.878 . . . . 2.9199999999999999 109.61 -179.812 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' D' D ' 338' ' ' PHE . . . . . 0.506 ' HA ' HG21 ' D' ' 332' ' ' ILE . 80.3 t80 -54.3 -60.41 3.37 Favored 'General case' 0 N--CA 1.488 1.453 0 O-C-N 121.221 -0.925 . . . . 0.37 109.725 -179.777 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' D' D ' 339' ' ' GLU . . . . . . . . . . . . . 94.2 mt-10 -51.15 -33.47 27.06 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.3 -0.875 . . . . 1.99 110.039 -179.673 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' D' D ' 340' ' ' MET . . . . . . . . . . . . . 33.1 ttp -64.45 -50.76 66.26 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.082 -1.011 . . . . 0.31 109.931 -179.587 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' D' D ' 341' ' ' PHE . . . . . . . . . . . . . 36.9 m-85 -61.56 -47.23 86.47 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.168 -0.957 . . . . 0.17999999999999999 109.868 -179.525 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' D' D ' 342' ' ' ARG . . . . . . . . . . . . . 1.5 ttt180 -49.92 -39.49 40.33 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.157 -0.964 . . . . 2.4100000000000001 109.558 -179.902 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' D' D ' 343' ' ' GLU . . . . . . . . . . . . . 2.8 tt0 -58.28 -49.8 75.87 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.294 -0.879 . . . . 2.3500000000000001 109.398 -179.998 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' D' D ' 344' ' ' LEU . . . . . 0.471 HD22 ' CD2' ' C' ' 344' ' ' LEU . 75.9 mt -62.25 -29.5 70.44 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.184 -0.948 . . . . 0.19 109.293 179.761 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' D' D ' 345' ' ' ASN . . . . . . . . . . . . . 11.3 t-20 -58.0 -54.37 47.72 Favored 'General case' 0 C--N 1.303 -1.414 0 O-C-N 121.398 -0.813 . . . . 1.0900000000000001 109.45 179.968 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' D' D ' 346' ' ' GLU . . . . . . . . . . . . . 1.2 tt0 -61.81 -29.06 69.9 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.308 -0.87 . . . . 1.6899999999999999 109.827 -179.857 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' D' D ' 347' ' ' ALA . . . . . 0.982 ' HB1' ' HB1' ' C' ' 347' ' ' ALA . . . -61.73 -62.01 2.11 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.201 -0.937 . . . . 0.17999999999999999 110.122 -179.66 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' D' D ' 348' ' ' LEU . . . . . 0.547 HD22 ' N ' ' D' ' 348' ' ' LEU . 3.9 mm? -61.52 -44.71 96.57 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.159 -0.963 . . . . 0.31 110.119 -179.394 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' D' D ' 349' ' ' GLU . . . . . . . . . . . . . 3.1 mt-10 -56.64 -35.54 68.46 Favored 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.13 -0.982 . . . . 1.95 109.859 -179.507 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' D' D ' 350' ' ' LEU . . . . . 0.689 HD13 HD22 ' C' ' 350' ' ' LEU . 6.0 tt -65.02 -45.75 84.17 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.154 -0.966 . . . . 0.42999999999999999 109.576 -179.865 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' D' D ' 351' ' ' LYS . . . . . . . . . . . . . 21.8 tttt -59.03 -41.09 86.96 Favored 'General case' 0 C--N 1.304 -1.404 0 O-C-N 121.258 -0.901 . . . . 1.3999999999999999 109.381 -179.877 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' D' D ' 352' ' ' ASP . . . . . . . . . . . . . 11.7 m-20 -56.38 -50.47 71.46 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.328 -0.858 . . . . 1.1699999999999999 109.484 179.886 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' D' D ' 353' ' ' ALA . . . . . . . . . . . . . . . -68.68 -15.4 63.51 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.232 -0.918 . . . . 0.58999999999999997 109.543 -179.953 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' D' D ' 354' ' ' GLN . . . . . . . . . . . . . 2.2 mt-30 -83.09 -7.01 59.7 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.154 -0.966 . . . . 1.4399999999999999 109.52 -179.991 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' D' D ' 355' ' ' ALA . . . . . . . . . . . . . . . -70.54 -4.93 25.41 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.174 -0.953 . . . . 0.97999999999999998 109.557 179.986 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' D' D ' 356' ' ' GLY . . . . . . . . . . . . . . . -75.22 -83.46 0.4 Allowed Glycine 0 N--CA 1.491 2.344 0 N-CA-C 109.37 -1.492 . . . . 1.28 109.37 179.801 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' D' D ' 357' ' ' LYS . . . . . . . . . . . . . 2.3 tttt -86.32 136.03 33.3 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.313 -1.11 . . . . 4.0899999999999999 109.206 179.813 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' D' D ' 358' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -49.02 159.47 0.57 Allowed Pre-proline 0 N--CA 1.489 1.524 0 O-C-N 121.153 -0.967 . . . . 5.71 109.446 -179.835 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' D' D ' 359' ' ' PRO . . . . . . . . . . . . . 2.6 Cg_endo -61.48 150.25 86.03 Favored 'Trans proline' 0 C--N 1.31 -1.499 0 C-N-CA 122.208 1.939 . . . . 4.9699999999999998 110.213 -179.994 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' D' D ' 360' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.327 0 CA-C-O 117.958 -1.468 . . . . 6.9699999999999998 109.59 179.961 . . . . . . . . 0 0 . 1 . 023 nuclear build full ' A' A ' 319' ' ' LYS . . . . . . . . . . . . . 7.0 pttt . . . . . 0 N--CA 1.491 1.59 0 N-CA-C 109.41 -0.589 . . . . 7.5499999999999998 109.41 . . . . . . . . . 0 0 . 1 . 023 nuclear build full ' A' A ' 320' ' ' LYS . . . . . . . . . . . . . 38.5 mtmt 54.68 72.85 0.44 Allowed 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.318 -0.864 . . . . 6.4299999999999997 109.294 -179.97 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 321' ' ' LYS . . . . . . . . . . . . . 7.8 mtpt -82.31 120.13 76.34 Favored Pre-proline 0 N--CA 1.49 1.536 0 O-C-N 121.237 -0.915 . . . . 6.1299999999999999 109.208 -179.89 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 322' ' ' PRO . . . . . . . . . . . . . 5.0 Cg_exo -60.0 94.99 0.1 OUTLIER 'Trans proline' 0 C--N 1.313 -1.338 0 C-N-CA 121.85 1.7 . . . . 2.8300000000000001 109.985 179.947 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 323' ' ' LEU . . . . . . . . . . . . . 75.9 mt -80.3 94.18 6.06 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.293 -0.879 . . . . 2.8300000000000001 109.532 -179.884 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 324' ' ' ASP . . . . . . . . . . . . . 62.9 m-20 -84.09 88.73 7.19 Favored 'General case' 0 N--CA 1.489 1.477 0 O-C-N 121.134 -0.979 . . . . 1.53 109.072 179.536 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 325' ' ' GLY . . . . . 0.537 ' O ' ' CD1' ' A' ' 327' ' ' TYR . . . -71.34 -156.78 2.43 Favored Glycine 0 N--CA 1.49 2.276 0 N-CA-C 109.282 -1.527 . . . . 0.60999999999999999 109.282 179.721 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 326' ' ' GLU . . . . . . . . . . . . . 59.2 mm-40 -58.6 168.92 1.03 Allowed 'General case' 0 N--CA 1.488 1.475 0 O-C-N 121.218 -1.166 . . . . 2.1299999999999999 108.945 179.525 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 327' ' ' TYR . . . . . 0.537 ' CD1' ' O ' ' A' ' 325' ' ' GLY . 38.4 m-85 -148.64 105.36 3.57 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.169 -0.957 . . . . 0.47999999999999998 109.634 179.697 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 328' ' ' PHE . . . . . . . . . . . . . 98.2 m-85 -107.33 -166.92 1.2 Allowed 'General case' 0 C--N 1.303 -1.445 0 N-CA-C 108.851 -0.796 . . . . 0.31 108.851 179.68 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 329' ' ' THR . . . . . . . . . . . . . 68.1 p -151.07 164.71 35.82 Favored 'General case' 0 C--N 1.301 -1.517 0 O-C-N 121.139 -0.976 . . . . 0.22 109.27 -179.984 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 330' ' ' LEU . . . . . . . . . . . . . 16.1 tp -148.76 131.77 16.25 Favored 'General case' 0 C--N 1.302 -1.474 0 O-C-N 121.236 -0.915 . . . . 0.28000000000000003 109.377 -179.635 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 331' ' ' GLN . . . . . . . . . . . . . 1.6 tp60 -85.87 113.97 22.43 Favored 'General case' 0 N--CA 1.488 1.464 0 O-C-N 121.388 -0.82 . . . . 0.91000000000000003 109.151 179.955 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 332' ' ' ILE . . . . . 0.651 HG21 ' HA ' ' A' ' 338' ' ' PHE . 53.9 mt -102.83 102.23 13.31 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.497 0 O-C-N 121.295 -0.878 . . . . 0.26000000000000001 109.38 -179.827 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 333' ' ' ARG . . . . . . . . . . . . . 79.9 mtt180 -72.18 154.64 40.93 Favored 'General case' 0 N--CA 1.489 1.479 0 O-C-N 121.343 -0.848 . . . . 2.9199999999999999 109.37 179.992 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 334' ' ' GLY . . . . . . . . . . . . . . . 80.07 134.24 1.23 Allowed Glycine 0 N--CA 1.491 2.339 0 N-CA-C 109.598 -1.401 . . . . 0.40000000000000002 109.598 -179.86 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 335' ' ' ARG . . . . . 0.51 ' NH1' ' HG2' ' A' ' 335' ' ' ARG . 1.3 ttt-85 -79.93 -50.58 10.24 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.271 -1.135 . . . . 3.0099999999999998 109.83 -179.782 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 336' ' ' GLU . . . . . . . . . . . . . 1.4 pt-20 -55.61 -48.29 75.13 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.179 -0.95 . . . . 2.29 109.611 -179.689 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 337' ' ' ARG . . . . . 0.442 ' CG ' ' NH1' ' A' ' 337' ' ' ARG . 0.0 OUTLIER -60.1 -35.08 74.44 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.209 -0.932 . . . . 2.9300000000000002 109.474 179.97 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' A' A ' 338' ' ' PHE . . . . . 0.651 ' HA ' HG21 ' A' ' 332' ' ' ILE . 61.9 t80 -55.64 -55.69 29.19 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.321 -0.862 . . . . 0.38 109.531 179.998 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 339' ' ' GLU . . . . . . . . . . . . . 3.6 mm-40 -51.03 -32.68 22.34 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.339 -0.851 . . . . 1.97 110.118 -179.547 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 340' ' ' MET . . . . . . . . . . . . . 19.5 ttp -64.36 -52.92 55.95 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.151 -0.968 . . . . 0.31 110.198 -179.425 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 341' ' ' PHE . . . . . . . . . . . . . 39.8 m-85 -62.46 -46.08 90.14 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.195 -0.941 . . . . 0.17999999999999999 110.208 -179.274 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 342' ' ' ARG . . . . . . . . . . . . . 10.0 ttp180 -48.51 -41.19 29.24 Favored 'General case' 0 N--CA 1.491 1.625 0 O-C-N 121.061 -1.025 . . . . 2.4199999999999999 109.813 -179.827 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 343' ' ' GLU . . . . . . . . . . . . . 9.1 tp10 -59.31 -45.46 91.23 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.259 -0.901 . . . . 2.3500000000000001 109.967 -179.709 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 344' ' ' LEU . . . . . 0.404 ' O ' HD23 ' A' ' 348' ' ' LEU . 53.1 mt -62.77 -44.64 95.66 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.256 -0.903 . . . . 0.17999999999999999 110.024 -179.704 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 345' ' ' ASN . . . . . 0.425 HD22 HD11 ' C' ' 330' ' ' LEU . 54.7 t-20 -55.38 -49.52 72.12 Favored 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.172 -0.955 . . . . 1.0900000000000001 109.872 -179.823 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 346' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -61.06 -36.16 78.86 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.243 -0.91 . . . . 1.6499999999999999 109.585 -179.812 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 347' ' ' ALA . . . . . 0.872 ' HB1' ' HB1' ' B' ' 347' ' ' ALA . . . -60.14 -50.06 75.19 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.235 -0.915 . . . . 0.17999999999999999 109.962 -179.806 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 348' ' ' LEU . . . . . 0.55 HD12 ' NH2' ' C' ' 337' ' ' ARG . 3.6 mm? -62.24 -48.95 77.67 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.124 -0.985 . . . . 0.29999999999999999 109.87 -179.63 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 349' ' ' GLU . . . . . . . . . . . . . 76.3 mt-10 -55.53 -35.41 65.63 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.162 -0.961 . . . . 1.9399999999999999 109.7 -179.479 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 350' ' ' LEU . . . . . 0.783 HD13 HD22 ' B' ' 350' ' ' LEU . 5.6 tt -62.91 -45.3 93.17 Favored 'General case' 0 N--CA 1.488 1.472 0 O-C-N 121.266 -0.896 . . . . 0.46000000000000002 109.216 179.843 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 351' ' ' LYS . . . . . . . . . . . . . 19.1 tttm -56.37 -38.66 71.74 Favored 'General case' 0 N--CA 1.488 1.469 0 O-C-N 121.365 -0.834 . . . . 1.3999999999999999 109.481 179.982 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 352' ' ' ASP . . . . . . . . . . . . . 4.7 m-20 -55.61 -45.97 77.39 Favored 'General case' 0 N--CA 1.489 1.495 0 O-C-N 121.223 -0.923 . . . . 1.1599999999999999 109.429 179.784 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 353' ' ' ALA . . . . . . . . . . . . . . . -67.98 -28.26 67.28 Favored 'General case' 0 N--CA 1.489 1.494 0 O-C-N 121.309 -0.869 . . . . 0.63 109.172 179.734 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 354' ' ' GLN . . . . . . . . . . . . . 12.0 tt0 -81.3 0.92 34.84 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.321 -0.862 . . . . 1.47 109.471 179.756 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 355' ' ' ALA . . . . . . . . . . . . . . . -69.25 -77.96 0.07 Allowed 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.264 -0.898 . . . . 1.01 109.512 -179.807 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 356' ' ' GLY . . . . . . . . . . . . . . . -81.62 58.48 4.88 Favored Glycine 0 N--CA 1.492 2.368 0 N-CA-C 110.432 -1.067 . . . . 1.3 110.432 -179.578 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 357' ' ' LYS . . . . . . . . . . . . . 13.6 ttmt -90.16 92.33 8.91 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 120.821 -1.399 . . . . 4.0999999999999996 109.148 179.471 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 358' ' ' GLU . . . . . . . . . . . . . 34.9 tp10 -49.49 117.45 6.99 Favored Pre-proline 0 N--CA 1.49 1.561 0 O-C-N 121.14 -0.975 . . . . 5.75 109.484 -179.85 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 359' ' ' PRO . . . . . . . . . . . . . 2.8 Cg_endo -61.66 156.54 47.13 Favored 'Trans proline' 0 C--N 1.313 -1.322 0 C-N-CA 121.92 1.747 . . . . 5.0 109.939 179.81 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 360' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.216 0 N-CA-C 109.473 -1.451 . . . . 6.9699999999999998 109.473 179.916 . . . . . . . . 0 0 . 1 . 023 nuclear build full ' B' B ' 319' ' ' LYS . . . . . . . . . . . . . 7.3 pttt . . . . . 0 N--CA 1.492 1.628 0 N-CA-C 109.448 -0.575 . . . . 7.5499999999999998 109.448 . . . . . . . . . 0 0 . 1 . 023 nuclear build full ' B' B ' 320' ' ' LYS . . . . . . . . . . . . . 40.3 mtmt 54.81 72.53 0.46 Allowed 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.255 -0.903 . . . . 6.4400000000000004 109.479 -179.892 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 321' ' ' LYS . . . . . . . . . . . . . 8.1 mtpt -81.74 120.6 78.17 Favored Pre-proline 0 N--CA 1.488 1.472 0 O-C-N 121.137 -0.977 . . . . 6.1299999999999999 109.363 -179.999 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 322' ' ' PRO . . . . . . . . . . . . . 5.2 Cg_exo -59.88 95.48 0.1 OUTLIER 'Trans proline' 0 C--N 1.311 -1.401 0 C-N-CA 121.871 1.714 . . . . 2.8199999999999998 109.954 179.844 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 323' ' ' LEU . . . . . . . . . . . . . 74.4 mt -80.6 93.82 6.18 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.298 -0.877 . . . . 2.8399999999999999 109.593 -179.804 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 324' ' ' ASP . . . . . . . . . . . . . 62.8 m-20 -83.83 89.61 7.22 Favored 'General case' 0 C--N 1.305 -1.362 0 O-C-N 121.234 -0.916 . . . . 1.53 109.052 179.563 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 325' ' ' GLY . . . . . 0.548 ' O ' ' CD1' ' B' ' 327' ' ' TYR . . . -73.1 -157.1 3.91 Favored Glycine 0 N--CA 1.488 2.152 0 N-CA-C 109.111 -1.596 . . . . 0.58999999999999997 109.111 179.913 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' B' B ' 326' ' ' GLU . . . . . . . . . . . . . 60.4 mm-40 -58.28 168.5 1.06 Allowed 'General case' 0 C--N 1.304 -1.395 0 O-C-N 121.093 -1.239 . . . . 2.1299999999999999 108.96 179.746 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 327' ' ' TYR . . . . . 0.548 ' CD1' ' O ' ' B' ' 325' ' ' GLY . 39.2 m-85 -148.35 105.4 3.61 Favored 'General case' 0 C--N 1.301 -1.517 0 O-C-N 121.156 -0.965 . . . . 0.47999999999999998 109.614 179.846 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' B' B ' 328' ' ' PHE . . . . . . . . . . . . . 98.2 m-85 -107.54 -166.91 1.19 Allowed 'General case' 0 N--CA 1.488 1.455 0 N-CA-C 108.772 -0.825 . . . . 0.32000000000000001 108.772 179.752 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 329' ' ' THR . . . . . . . . . . . . . 69.7 p -151.04 164.89 35.39 Favored 'General case' 0 C--N 1.301 -1.52 0 O-C-N 121.151 -0.968 . . . . 0.23000000000000001 109.235 -179.988 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 330' ' ' LEU . . . . . . . . . . . . . 15.7 tp -148.95 131.6 15.9 Favored 'General case' 0 C--N 1.303 -1.445 0 O-C-N 121.189 -0.945 . . . . 0.28000000000000003 109.386 -179.689 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 331' ' ' GLN . . . . . . . . . . . . . 1.6 tp60 -85.62 113.87 22.17 Favored 'General case' 0 C--N 1.303 -1.432 0 O-C-N 121.347 -0.845 . . . . 0.91000000000000003 109.203 179.943 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 332' ' ' ILE . . . . . 0.661 HG21 ' HA ' ' B' ' 338' ' ' PHE . 52.4 mt -102.68 102.57 13.78 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.484 0 O-C-N 121.172 -0.955 . . . . 0.23999999999999999 109.44 -179.967 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' B' B ' 333' ' ' ARG . . . . . . . . . . . . . 80.2 mtt180 -72.39 154.71 40.76 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.458 -0.776 . . . . 2.9300000000000002 109.434 -179.911 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 334' ' ' GLY . . . . . . . . . . . . . . . 79.85 134.54 1.21 Allowed Glycine 0 N--CA 1.491 2.316 0 N-CA-C 109.437 -1.465 . . . . 0.40000000000000002 109.437 -179.899 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 335' ' ' ARG . . . . . 0.511 ' NH1' ' HG2' ' B' ' 335' ' ' ARG . 1.4 ttt-85 -80.15 -50.37 10.38 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.287 -1.125 . . . . 3.0099999999999998 109.868 -179.866 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' B' B ' 336' ' ' GLU . . . . . . . . . . . . . 1.3 pt-20 -55.54 -48.12 75.23 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.218 -0.926 . . . . 2.2799999999999998 109.644 -179.715 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 337' ' ' ARG . . . . . 0.441 ' CG ' ' NH1' ' B' ' 337' ' ' ARG . 0.0 OUTLIER -60.27 -35.22 75.03 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.199 -0.938 . . . . 2.9300000000000002 109.453 179.966 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' B' B ' 338' ' ' PHE . . . . . 0.661 ' HA ' HG21 ' B' ' 332' ' ' ILE . 62.3 t80 -55.55 -55.95 25.96 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.246 -0.909 . . . . 0.37 109.563 -179.998 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' B' B ' 339' ' ' GLU . . . . . . . . . . . . . 3.5 mm-40 -50.92 -32.37 20.49 Favored 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.233 -0.917 . . . . 1.98 110.113 -179.6 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 340' ' ' MET . . . . . . . . . . . . . 19.4 ttp -64.56 -52.97 54.88 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.146 -0.972 . . . . 0.32000000000000001 110.155 -179.457 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 341' ' ' PHE . . . . . . . . . . . . . 40.1 m-85 -62.56 -46.07 90.01 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.166 -0.959 . . . . 0.17999999999999999 110.254 -179.246 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 342' ' ' ARG . . . . . . . . . . . . . 10.1 ttp180 -48.46 -41.13 28.64 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.046 -1.034 . . . . 2.4199999999999999 109.771 -179.752 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 343' ' ' GLU . . . . . . . . . . . . . 9.2 tp10 -59.35 -45.55 91.09 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.238 -0.914 . . . . 2.3500000000000001 109.908 -179.668 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 344' ' ' LEU . . . . . . . . . . . . . 49.2 mt -62.91 -44.57 95.72 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.288 -0.883 . . . . 0.17999999999999999 109.968 -179.607 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 345' ' ' ASN . . . . . 0.498 HD22 HD11 ' D' ' 330' ' ' LEU . 55.7 t-20 -55.4 -49.68 71.75 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.22 -0.925 . . . . 1.0900000000000001 109.685 -179.704 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' B' B ' 346' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -60.81 -36.16 78.34 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.215 -0.928 . . . . 1.6599999999999999 109.599 -179.773 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' B' B ' 347' ' ' ALA . . . . . 0.872 ' HB1' ' HB1' ' A' ' 347' ' ' ALA . . . -60.34 -49.92 75.68 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.153 -0.967 . . . . 0.17000000000000001 109.926 -179.816 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' B' B ' 348' ' ' LEU . . . . . 0.525 HD22 ' N ' ' B' ' 348' ' ' LEU . 3.7 mm? -62.25 -49.04 77.28 Favored 'General case' 0 N--CA 1.493 1.692 0 O-C-N 121.182 -0.949 . . . . 0.28999999999999998 109.834 -179.67 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' B' B ' 349' ' ' GLU . . . . . . . . . . . . . 77.5 mt-10 -55.43 -35.58 65.57 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.251 -0.906 . . . . 1.95 109.642 -179.479 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 350' ' ' LEU . . . . . 0.783 HD22 HD13 ' A' ' 350' ' ' LEU . 5.7 tt -62.88 -45.18 93.76 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.255 -0.903 . . . . 0.45000000000000001 109.247 179.905 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' B' B ' 351' ' ' LYS . . . . . . . . . . . . . 19.2 tttm -56.38 -38.64 71.73 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.309 -0.869 . . . . 1.3799999999999999 109.412 179.922 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 352' ' ' ASP . . . . . . . . . . . . . 4.9 m-20 -55.6 -46.03 77.36 Favored 'General case' 0 N--CA 1.489 1.482 0 O-C-N 121.211 -0.931 . . . . 1.1599999999999999 109.38 179.866 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 353' ' ' ALA . . . . . . . . . . . . . . . -67.96 -27.88 66.97 Favored 'General case' 0 N--CA 1.489 1.497 0 O-C-N 121.251 -0.906 . . . . 0.60999999999999999 109.179 179.684 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 354' ' ' GLN . . . . . . . . . . . . . 11.6 tt0 -81.6 0.55 37.88 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.343 -0.848 . . . . 1.45 109.466 179.747 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 355' ' ' ALA . . . . . . . . . . . . . . . -69.05 -77.83 0.08 Allowed 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.194 -0.941 . . . . 0.97999999999999998 109.471 -179.868 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 356' ' ' GLY . . . . . . . . . . . . . . . -81.61 58.48 4.88 Favored Glycine 0 N--CA 1.492 2.383 0 N-CA-C 110.569 -1.012 . . . . 1.29 110.569 -179.64 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 357' ' ' LYS . . . . . . . . . . . . . 12.9 ttmt -90.28 92.37 8.89 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 120.959 -1.318 . . . . 4.0899999999999999 109.045 179.434 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 358' ' ' GLU . . . . . . . . . . . . . 37.7 tp10 -49.96 117.81 8.01 Favored Pre-proline 0 N--CA 1.489 1.516 0 O-C-N 121.114 -0.991 . . . . 5.7199999999999998 109.507 -179.785 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 359' ' ' PRO . . . . . . . . . . . . . 2.7 Cg_endo -61.79 156.58 47.54 Favored 'Trans proline' 0 C--N 1.313 -1.311 0 C-N-CA 121.91 1.74 . . . . 4.9800000000000004 110.031 179.911 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 360' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.273 0 N-CA-C 109.517 -1.433 . . . . 6.9800000000000004 109.517 179.995 . . . . . . . . 0 0 . 1 . 023 nuclear build full ' C' C ' 319' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.491 1.591 0 N-CA-C 109.348 -0.612 . . . . 6.8200000000000003 109.348 . . . . . . . . . 1 1 . 1 . 023 nuclear build full ' C' C ' 320' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER 60.89 84.56 0.13 Allowed 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.281 -0.887 . . . . 6.4900000000000002 109.669 179.877 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' C' C ' 321' ' ' LYS . . . . . 0.624 ' CB ' ' HD3' ' C' ' 322' ' ' PRO . 0.3 OUTLIER -160.47 -62.45 0.02 OUTLIER Pre-proline 0 N--CA 1.49 1.568 0 O-C-N 121.185 -0.947 . . . . 6.4000000000000004 109.77 179.497 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' C' C ' 322' ' ' PRO . . . . . 0.624 ' HD3' ' CB ' ' C' ' 321' ' ' LYS . 2.4 Cg_endo -67.03 -4.94 12.39 Favored 'Trans proline' 0 C--N 1.318 -1.075 0 C-N-CA 121.334 1.356 . . . . 3.4199999999999999 110.334 179.507 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' C' C ' 323' ' ' LEU . . . . . . . . . . . . . 85.5 mt -81.41 96.68 7.44 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.044 -1.035 . . . . 3.9500000000000002 109.492 -179.955 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' C' C ' 324' ' ' ASP . . . . . 0.484 ' OD1' ' N ' ' C' ' 324' ' ' ASP . 0.5 OUTLIER -84.3 90.87 7.63 Favored 'General case' 0 N--CA 1.489 1.483 0 O-C-N 121.251 -0.906 . . . . 1.6299999999999999 109.437 179.891 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' C' C ' 325' ' ' GLY . . . . . 0.563 ' O ' ' CD2' ' C' ' 327' ' ' TYR . . . -72.2 -164.7 7.37 Favored Glycine 0 N--CA 1.491 2.327 0 N-CA-C 109.41 -1.476 . . . . 0.72999999999999998 109.41 179.879 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' C' C ' 326' ' ' GLU . . . . . . . . . . . . . 2.3 mp0 -58.48 164.36 2.64 Favored 'General case' 0 N--CA 1.489 1.491 0 O-C-N 121.282 -1.128 . . . . 2.1699999999999999 109.057 179.57 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' C' C ' 327' ' ' TYR . . . . . 0.563 ' CD2' ' O ' ' C' ' 325' ' ' GLY . 38.7 m-85 -148.88 108.1 3.92 Favored 'General case' 0 C--N 1.302 -1.467 0 O-C-N 121.121 -0.987 . . . . 0.47999999999999998 109.865 179.973 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' C' C ' 328' ' ' PHE . . . . . 0.417 ' CE1' ' HA ' ' A' ' 335' ' ' ARG . 88.8 m-85 -112.55 -166.71 1.1 Allowed 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.457 -0.777 . . . . 0.33000000000000002 108.929 179.743 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' C' C ' 329' ' ' THR . . . . . . . . . . . . . 21.2 p -152.67 165.09 36.36 Favored 'General case' 0 N--CA 1.489 1.48 0 O-C-N 121.089 -1.007 . . . . 0.23000000000000001 109.608 179.966 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' C' C ' 330' ' ' LEU . . . . . 0.425 HD11 HD22 ' A' ' 345' ' ' ASN . 51.5 tp -150.68 126.18 10.16 Favored 'General case' 0 N--CA 1.488 1.453 0 O-C-N 121.258 -0.901 . . . . 0.28000000000000003 109.448 179.77 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' C' C ' 331' ' ' GLN . . . . . . . . . . . . . 4.4 tp-100 -86.74 117.37 25.45 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.325 -0.859 . . . . 1.48 109.3 179.883 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' C' C ' 332' ' ' ILE . . . . . 0.521 HD12 ' HD1' ' C' ' 338' ' ' PHE . 21.8 mt -103.49 110.12 28.99 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.554 0 O-C-N 121.119 -0.988 . . . . 0.23999999999999999 109.684 179.949 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' C' C ' 333' ' ' ARG . . . . . 0.507 ' HG2' ' CE2' ' A' ' 327' ' ' TYR . 11.8 mtm180 -73.71 143.44 46.17 Favored 'General case' 0 N--CA 1.488 1.469 0 O-C-N 121.174 -0.954 . . . . 2.7400000000000002 109.046 179.355 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' C' C ' 334' ' ' GLY . . . . . . . . . . . . . . . 90.16 134.67 5.71 Favored Glycine 0 N--CA 1.489 2.219 0 N-CA-C 109.618 -1.393 . . . . 0.34999999999999998 109.618 179.931 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' C' C ' 335' ' ' ARG . . . . . 0.486 ' CG ' ' NH1' ' C' ' 335' ' ' ARG . 0.0 OUTLIER -79.49 -46.09 18.09 Favored 'General case' 0 N--CA 1.488 1.466 0 O-C-N 121.374 -1.074 . . . . 2.5299999999999998 109.752 -179.939 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' C' C ' 336' ' ' GLU . . . . . . . . . . . . . 3.8 mt-10 -57.34 -48.52 78.79 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.274 -0.891 . . . . 2.6200000000000001 109.687 -179.747 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' C' C ' 337' ' ' ARG . . . . . 0.55 ' NH2' HD12 ' A' ' 348' ' ' LEU . 1.9 mtp180 -59.31 -34.93 72.91 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.36 -0.837 . . . . 2.8100000000000001 109.788 -179.712 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' C' C ' 338' ' ' PHE . . . . . 0.521 ' HD1' HD12 ' C' ' 332' ' ' ILE . 51.4 t80 -55.81 -54.06 49.14 Favored 'General case' 0 N--CA 1.489 1.501 0 O-C-N 121.219 -0.926 . . . . 0.40000000000000002 110.296 -179.65 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' C' C ' 339' ' ' GLU . . . . . . . . . . . . . 7.9 mt-10 -51.27 -34.71 34.04 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.186 -0.946 . . . . 2.0499999999999998 110.705 -179.161 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' C' C ' 340' ' ' MET . . . . . . . . . . . . . 38.1 ttp -64.78 -55.02 22.28 Favored 'General case' 0 N--CA 1.493 1.722 0 O-C-N 120.962 -1.087 . . . . 0.32000000000000001 110.626 -179.094 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' C' C ' 341' ' ' PHE . . . . . . . . . . . . . 49.3 m-85 -59.87 -44.8 93.98 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.143 -0.973 . . . . 0.17999999999999999 110.126 -179.053 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' C' C ' 342' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -50.24 -42.86 52.52 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.164 -0.96 . . . . 2.9100000000000001 110.27 -179.562 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' C' C ' 343' ' ' GLU . . . . . . . . . . . . . 1.8 tt0 -58.06 -48.93 78.64 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.154 -0.966 . . . . 2.1400000000000001 110.072 -179.362 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' C' C ' 344' ' ' LEU . . . . . 0.45 ' O ' HD23 ' C' ' 348' ' ' LEU . 66.2 mt -61.79 -36.63 81.65 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.125 -0.984 . . . . 0.22 109.763 -179.714 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' C' C ' 345' ' ' ASN . . . . . . . . . . . . . 23.0 t-20 -57.89 -57.19 13.89 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.228 -0.92 . . . . 1.0800000000000001 109.785 -179.814 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' C' C ' 346' ' ' GLU . . . . . . . . . . . . . 2.0 tm-20 -60.6 -29.3 69.13 Favored 'General case' 0 N--CA 1.489 1.525 0 O-C-N 121.291 -0.881 . . . . 2.21 109.752 -179.651 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' C' C ' 347' ' ' ALA . . . . . 0.757 ' HB1' ' HB1' ' D' ' 347' ' ' ALA . . . -62.08 -52.93 61.91 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.289 -0.882 . . . . 0.17999999999999999 109.934 -179.864 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' C' C ' 348' ' ' LEU . . . . . 0.528 ' N ' HD22 ' C' ' 348' ' ' LEU . 3.8 mm? -61.26 -52.33 65.19 Favored 'General case' 0 N--CA 1.492 1.675 0 O-C-N 121.223 -0.923 . . . . 0.32000000000000001 109.915 -179.487 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' C' C ' 349' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -56.57 -31.64 64.41 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.217 -0.927 . . . . 2.1899999999999999 109.588 -179.568 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' C' C ' 350' ' ' LEU . . . . . 0.81 ' CD2' HD13 ' D' ' 350' ' ' LEU . 10.0 tt -64.92 -44.2 90.33 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.236 -0.915 . . . . 0.46000000000000002 109.24 179.816 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' C' C ' 351' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -57.53 -40.84 79.67 Favored 'General case' 0 N--CA 1.488 1.47 0 O-C-N 121.466 -0.771 . . . . 1.3500000000000001 109.128 179.878 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' C' C ' 352' ' ' ASP . . . . . . . . . . . . . 30.0 m-20 -57.56 -34.71 69.47 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.358 -0.839 . . . . 1.1899999999999999 109.352 179.7 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' C' C ' 353' ' ' ALA . . . . . . . . . . . . . . . -66.54 -29.0 68.98 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.334 -0.854 . . . . 0.56999999999999995 109.53 -179.857 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' C' C ' 354' ' ' GLN . . . . . . . . . . . . . 3.5 tt0 -81.49 -9.23 59.75 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.124 -0.985 . . . . 1.47 109.269 179.907 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' C' C ' 355' ' ' ALA . . . . . . . . . . . . . . . -72.57 -10.16 59.46 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.243 -0.911 . . . . 0.93000000000000005 109.464 179.806 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' C' C ' 356' ' ' GLY . . . . . . . . . . . . . . . -80.26 -90.33 0.49 Allowed Glycine 0 N--CA 1.491 2.323 0 N-CA-C 109.418 -1.473 . . . . 1.3300000000000001 109.418 179.972 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' C' C ' 357' ' ' LYS . . . . . . . . . . . . . 3.0 mtpm? -86.15 117.18 24.81 Favored 'General case' 0 N--CA 1.488 1.47 0 O-C-N 121.287 -1.126 . . . . 4.0099999999999998 109.168 179.857 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' C' C ' 358' ' ' GLU . . . . . 0.446 ' HB3' ' HD2' ' C' ' 359' ' ' PRO . 23.0 mt-10 -48.67 160.49 0.46 Allowed Pre-proline 0 N--CA 1.49 1.544 0 O-C-N 121.268 -0.895 . . . . 5.75 109.632 -179.602 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' C' C ' 359' ' ' PRO . . . . . 0.446 ' HD2' ' HB3' ' C' ' 358' ' ' GLU . 5.1 Cg_exo -59.77 96.02 0.1 OUTLIER 'Trans proline' 0 C--N 1.312 -1.383 0 C-N-CA 122.259 1.973 . . . . 4.9400000000000004 110.488 -179.708 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' C' C ' 360' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.296 0 CA-C-O 117.995 -1.447 . . . . 6.5 109.494 179.82 . . . . . . . . 0 0 . 1 . 023 nuclear build full ' D' D ' 319' ' ' LYS . . . . . . . . . . . . . 8.2 pttt . . . . . 0 N--CA 1.49 1.547 0 N-CA-C 109.319 -0.623 . . . . 7.5300000000000002 109.319 . . . . . . . . . 0 0 . 1 . 023 nuclear build full ' D' D ' 320' ' ' LYS . . . . . . . . . . . . . 41.4 mtmt 55.45 73.01 0.44 Allowed 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.288 -0.883 . . . . 6.4100000000000001 109.419 -179.727 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' D' D ' 321' ' ' LYS . . . . . . . . . . . . . 8.0 mtpt -82.27 120.79 77.82 Favored Pre-proline 0 N--CA 1.487 1.423 0 O-C-N 121.164 -0.96 . . . . 6.1100000000000003 109.375 179.989 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' D' D ' 322' ' ' PRO . . . . . . . . . . . . . 5.1 Cg_exo -59.74 95.5 0.1 OUTLIER 'Trans proline' 0 C--N 1.311 -1.41 0 C-N-CA 121.846 1.697 . . . . 2.8199999999999998 110.041 179.902 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' D' D ' 323' ' ' LEU . . . . . . . . . . . . . 71.7 mt -80.35 94.37 6.12 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.172 -0.955 . . . . 2.8300000000000001 109.49 -179.891 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' D' D ' 324' ' ' ASP . . . . . . . . . . . . . 64.1 m-20 -84.32 88.82 7.27 Favored 'General case' 0 N--CA 1.488 1.431 0 O-C-N 121.039 -1.038 . . . . 1.54 108.965 179.664 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' D' D ' 325' ' ' GLY . . . . . 0.549 ' O ' ' CD1' ' D' ' 327' ' ' TYR . . . -72.08 -157.21 3.16 Favored Glycine 0 N--CA 1.49 2.247 0 N-CA-C 109.14 -1.584 . . . . 0.58999999999999997 109.14 179.814 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' D' D ' 326' ' ' GLU . . . . . . . . . . . . . 61.6 mm-40 -58.39 168.99 0.95 Allowed 'General case' 0 C--N 1.303 -1.413 0 O-C-N 121.147 -1.208 . . . . 2.1299999999999999 108.87 179.555 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' D' D ' 327' ' ' TYR . . . . . 0.549 ' CD1' ' O ' ' D' ' 325' ' ' GLY . 38.7 m-85 -148.88 105.4 3.54 Favored 'General case' 0 C--N 1.301 -1.525 0 O-C-N 121.151 -0.968 . . . . 0.46999999999999997 109.57 179.874 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' D' D ' 328' ' ' PHE . . . . . . . . . . . . . 98.1 m-85 -107.47 -166.92 1.2 Allowed 'General case' 0 C--N 1.302 -1.464 0 N-CA-C 108.953 -0.758 . . . . 0.29999999999999999 108.953 179.815 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' D' D ' 329' ' ' THR . . . . . . . . . . . . . 66.8 p -151.24 164.54 36.36 Favored 'General case' 0 C--N 1.301 -1.539 0 O-C-N 121.204 -0.935 . . . . 0.22 109.212 -179.965 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' D' D ' 330' ' ' LEU . . . . . 0.498 HD11 HD22 ' B' ' 345' ' ' ASN . 15.8 tp -148.68 131.52 16.09 Favored 'General case' 0 C--N 1.302 -1.475 0 O-C-N 121.192 -0.943 . . . . 0.28000000000000003 109.437 -179.557 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' D' D ' 331' ' ' GLN . . . . . . . . . . . . . 1.6 tp60 -85.43 114.22 22.31 Favored 'General case' 0 C--N 1.303 -1.429 0 O-C-N 121.338 -0.852 . . . . 0.93000000000000005 109.167 179.868 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' D' D ' 332' ' ' ILE . . . . . 0.655 HG21 ' HA ' ' D' ' 338' ' ' PHE . 53.0 mt -102.98 102.52 13.73 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.513 0 O-C-N 121.272 -0.892 . . . . 0.25 109.38 -179.962 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' D' D ' 333' ' ' ARG . . . . . 0.442 ' HG2' ' CE2' ' B' ' 327' ' ' TYR . 80.5 mtt180 -72.46 154.88 40.63 Favored 'General case' 0 N--CA 1.489 1.477 0 O-C-N 121.256 -0.903 . . . . 2.9300000000000002 109.517 -179.9 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' D' D ' 334' ' ' GLY . . . . . . . . . . . . . . . 79.6 134.57 1.14 Allowed Glycine 0 N--CA 1.49 2.262 0 N-CA-C 109.512 -1.435 . . . . 0.40999999999999998 109.512 -179.918 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' D' D ' 335' ' ' ARG . . . . . 0.52 ' NH1' ' HG2' ' D' ' 335' ' ' ARG . 1.4 ttt-85 -80.0 -50.4 10.45 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.208 -1.172 . . . . 3.0299999999999998 109.79 -179.731 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' D' D ' 336' ' ' GLU . . . . . . . . . . . . . 1.2 pt-20 -55.38 -48.11 74.81 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.178 -0.951 . . . . 2.2599999999999998 109.631 -179.618 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' D' D ' 337' ' ' ARG . . . . . 0.457 ' CG ' HH11 ' D' ' 337' ' ' ARG . 0.0 OUTLIER -60.41 -34.98 74.72 Favored 'General case' 0 N--CA 1.489 1.488 0 O-C-N 121.137 -0.977 . . . . 2.9199999999999999 109.507 179.914 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' D' D ' 338' ' ' PHE . . . . . 0.655 ' HA ' HG21 ' D' ' 332' ' ' ILE . 62.5 t80 -55.55 -56.02 25.12 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.298 -0.876 . . . . 0.37 109.656 179.937 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' D' D ' 339' ' ' GLU . . . . . . . . . . . . . 3.4 mm-40 -51.02 -32.22 20.75 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.199 -0.938 . . . . 1.99 110.163 -179.643 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' D' D ' 340' ' ' MET . . . . . . . . . . . . . 19.3 ttp -64.45 -53.36 49.5 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.162 -0.961 . . . . 0.31 110.175 -179.433 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' D' D ' 341' ' ' PHE . . . . . . . . . . . . . 40.2 m-85 -62.47 -46.37 88.81 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.123 -0.986 . . . . 0.17999999999999999 110.166 -179.188 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' D' D ' 342' ' ' ARG . . . . . . . . . . . . . 10.7 ttp180 -48.15 -41.13 25.9 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.08 -1.013 . . . . 2.4100000000000001 109.787 -179.765 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' D' D ' 343' ' ' GLU . . . . . . . . . . . . . 9.3 tp10 -59.25 -45.77 90.3 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.292 -0.88 . . . . 2.3500000000000001 109.933 -179.697 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' D' D ' 344' ' ' LEU . . . . . 0.43 HD22 HD22 ' C' ' 344' ' ' LEU . 46.3 mt -62.76 -44.56 95.88 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.164 -0.96 . . . . 0.19 110.013 -179.639 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' D' D ' 345' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -55.37 -49.45 72.25 Favored 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.204 -0.935 . . . . 1.0900000000000001 109.64 -179.643 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' D' D ' 346' ' ' GLU . . . . . . . . . . . . . 1.1 tt0 -61.15 -35.92 78.38 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.236 -0.915 . . . . 1.6899999999999999 109.652 -179.878 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' D' D ' 347' ' ' ALA . . . . . 0.757 ' HB1' ' HB1' ' C' ' 347' ' ' ALA . . . -60.25 -50.25 74.38 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.182 -0.949 . . . . 0.17999999999999999 109.89 -179.892 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' D' D ' 348' ' ' LEU . . . . . 0.529 HD22 ' N ' ' D' ' 348' ' ' LEU . 3.7 mm? -62.04 -48.96 77.94 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.146 -0.971 . . . . 0.31 109.889 -179.685 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' D' D ' 349' ' ' GLU . . . . . . . . . . . . . 77.2 mt-10 -55.64 -35.04 65.49 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.114 -0.991 . . . . 1.95 109.81 -179.538 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' D' D ' 350' ' ' LEU . . . . . 0.81 HD13 ' CD2' ' C' ' 350' ' ' LEU . 5.8 tt -63.38 -44.47 94.65 Favored 'General case' 0 N--CA 1.489 1.479 0 O-C-N 121.267 -0.895 . . . . 0.42999999999999999 109.233 179.943 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' D' D ' 351' ' ' LYS . . . . . . . . . . . . . 19.2 tttm -57.16 -38.28 73.34 Favored 'General case' 0 N--CA 1.489 1.481 0 O-C-N 121.446 -0.784 . . . . 1.3999999999999999 109.416 179.879 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' D' D ' 352' ' ' ASP . . . . . . . . . . . . . 5.2 m-20 -55.85 -45.9 78.33 Favored 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.242 -0.911 . . . . 1.1699999999999999 109.355 179.696 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' D' D ' 353' ' ' ALA . . . . . . . . . . . . . . . -68.04 -27.94 66.96 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.201 -0.937 . . . . 0.58999999999999997 109.179 179.67 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' D' D ' 354' ' ' GLN . . . . . . . . . . . . . 11.2 tt0 -81.53 0.45 38.03 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.392 -0.818 . . . . 1.4399999999999999 109.49 179.791 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' D' D ' 355' ' ' ALA . . . . . . . . . . . . . . . -69.22 -77.54 0.08 Allowed 'General case' 0 N--CA 1.489 1.49 0 O-C-N 121.231 -0.918 . . . . 0.97999999999999998 109.516 -179.879 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' D' D ' 356' ' ' GLY . . . . . . . . . . . . . . . -81.72 57.71 4.92 Favored Glycine 0 N--CA 1.492 2.404 0 N-CA-C 110.542 -1.023 . . . . 1.28 110.542 -179.563 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' D' D ' 357' ' ' LYS . . . . . . . . . . . . . 12.3 ttmt -89.6 92.02 8.92 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 120.82 -1.4 . . . . 4.0899999999999999 109.152 179.434 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' D' D ' 358' ' ' GLU . . . . . . . . . . . . . 40.6 tp10 -49.82 117.81 7.83 Favored Pre-proline 0 N--CA 1.492 1.649 0 O-C-N 121.14 -0.975 . . . . 5.71 109.387 -179.864 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' D' D ' 359' ' ' PRO . . . . . . . . . . . . . 2.5 Cg_endo -61.57 157.39 41.96 Favored 'Trans proline' 0 C--N 1.314 -1.288 0 C-N-CA 121.818 1.678 . . . . 4.9699999999999998 109.873 179.806 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' D' D ' 360' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 2.371 0 CA-C-O 118.018 -1.434 . . . . 6.9699999999999998 109.633 -179.955 . . . . . . . . 0 0 . 1 . 024 nuclear build full ' A' A ' 319' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 N--CA 1.492 1.666 0 N-CA-C 109.379 -0.6 . . . . 7.5499999999999998 109.379 . . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 320' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 63.09 115.99 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.384 -0.823 . . . . 6.4299999999999997 109.659 179.85 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 321' ' ' LYS . . . . . . . . . . . . . 8.4 mttt -81.81 144.03 51.26 Favored Pre-proline 0 N--CA 1.49 1.553 0 O-C-N 121.251 -0.906 . . . . 6.1299999999999999 109.097 179.851 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 322' ' ' PRO . . . . . . . . . . . . . 2.2 Cg_endo -61.98 -81.61 0.01 OUTLIER 'Trans proline' 0 C--N 1.31 -1.476 0 C-N-CA 122.105 1.87 . . . . 2.8300000000000001 110.485 -179.624 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 323' ' ' LEU . . . . . . . . . . . . . 46.2 mt -82.91 104.88 13.46 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.178 -0.952 . . . . 2.8300000000000001 109.791 -179.682 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 324' ' ' ASP . . . . . . . . . . . . . 8.0 m-20 -81.79 -154.82 0.12 Allowed 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.245 -0.91 . . . . 1.53 109.49 179.828 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 325' ' ' GLY . . . . . . . . . . . . . . . -69.69 -168.04 6.18 Favored Glycine 0 N--CA 1.491 2.366 0 N-CA-C 109.748 -1.341 . . . . 0.60999999999999999 109.748 179.978 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 326' ' ' GLU . . . . . . . . . . . . . 2.2 mm-40 -59.14 -173.72 0.02 OUTLIER 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.352 -1.087 . . . . 2.1299999999999999 109.627 -179.96 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 327' ' ' TYR . . . . . 0.525 ' CE1' ' HG2' ' C' ' 333' ' ' ARG . 43.2 m-85 -149.83 112.18 4.69 Favored 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.297 -0.877 . . . . 0.47999999999999998 109.737 179.889 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 328' ' ' PHE . . . . . 0.504 ' CE1' ' HA ' ' C' ' 335' ' ' ARG . 71.0 m-85 -113.93 -168.81 1.4 Allowed 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.252 -0.905 . . . . 0.31 109.187 179.69 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 329' ' ' THR . . . . . 0.403 HG23 ' O ' ' A' ' 328' ' ' PHE . 40.3 p -154.58 167.54 29.77 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.2 -0.938 . . . . 0.22 109.451 -179.992 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 330' ' ' LEU . . . . . . . . . . . . . 24.2 tp -150.37 131.42 14.36 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.254 -0.904 . . . . 0.28000000000000003 109.477 -179.888 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 331' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -87.13 111.94 21.44 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.3 -0.875 . . . . 0.91000000000000003 109.436 179.861 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 332' ' ' ILE . . . . . 0.534 HG21 ' HA ' ' A' ' 338' ' ' PHE . 97.0 mt -103.56 104.03 16.07 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.592 0 O-C-N 121.232 -0.918 . . . . 0.26000000000000001 109.529 -179.986 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 333' ' ' ARG . . . . . 0.596 ' HG2' ' CE2' ' C' ' 327' ' ' TYR . 13.3 mtp180 -72.53 149.99 43.59 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.259 -0.9 . . . . 2.9199999999999999 109.479 179.868 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 334' ' ' GLY . . . . . . . . . . . . . . . 86.37 131.14 2.86 Favored Glycine 0 N--CA 1.493 2.438 0 N-CA-C 109.84 -1.304 . . . . 0.40000000000000002 109.84 179.606 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 335' ' ' ARG . . . . . 0.457 ' O ' ' HB3' ' A' ' 338' ' ' PHE . 0.0 OUTLIER -80.26 -39.07 29.66 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.33 -1.1 . . . . 3.0099999999999998 109.586 179.874 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 336' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -57.99 -61.74 2.32 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.17 -0.956 . . . . 2.29 110.106 -179.561 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 337' ' ' ARG . . . . . 0.497 ' NE ' HD12 ' C' ' 348' ' ' LEU . 0.0 OUTLIER -59.96 -26.37 65.94 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.137 -0.977 . . . . 2.9300000000000002 109.788 -179.509 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 338' ' ' PHE . . . . . 0.534 ' HA ' HG21 ' A' ' 332' ' ' ILE . 50.8 t80 -55.67 -58.6 7.13 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.149 -0.969 . . . . 0.38 109.732 -179.869 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 339' ' ' GLU . . . . . . . . . . . . . 55.9 mt-10 -50.71 -32.94 20.97 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.269 -0.894 . . . . 1.97 109.876 -179.653 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 340' ' ' MET . . . . . . . . . . . . . 23.0 ttp -63.56 -51.19 66.44 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.107 -0.996 . . . . 0.31 110.044 -179.509 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 341' ' ' PHE . . . . . 0.434 ' HB2' HD13 ' A' ' 332' ' ' ILE . 36.7 m-85 -62.0 -45.84 91.85 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.166 -0.959 . . . . 0.17999999999999999 110.081 -179.557 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 342' ' ' ARG . . . . . 0.473 ' NH1' ' HG3' ' A' ' 342' ' ' ARG . 0.0 OUTLIER -49.58 -42.55 44.78 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.14 -0.975 . . . . 2.4199999999999999 110.047 -179.499 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 343' ' ' GLU . . . . . . . . . . . . . 1.6 tt0 -58.61 -47.93 82.69 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.099 -1.0 . . . . 2.3500000000000001 109.817 -179.57 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 344' ' ' LEU . . . . . 0.592 ' CD2' HD22 ' B' ' 344' ' ' LEU . 50.3 mt -61.39 -33.28 73.4 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.163 -0.961 . . . . 0.17999999999999999 109.536 -179.794 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 345' ' ' ASN . . . . . . . . . . . . . 21.6 t-20 -57.82 -59.25 5.52 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.249 -0.907 . . . . 1.0900000000000001 109.807 -179.944 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 346' ' ' GLU . . . . . . . . . . . . . 72.4 tt0 -62.16 -28.19 69.48 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.284 -0.885 . . . . 1.6499999999999999 110.136 -179.592 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 347' ' ' ALA . . . . . 0.769 ' HB1' ' HB1' ' B' ' 347' ' ' ALA . . . -60.71 -56.91 15.64 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.11 -0.994 . . . . 0.17999999999999999 110.006 -179.64 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 348' ' ' LEU . . . . . 0.539 HD22 ' N ' ' A' ' 348' ' ' LEU . 4.0 mm? -61.92 -46.49 89.13 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.13 -0.981 . . . . 0.29999999999999999 110.134 -179.56 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 349' ' ' GLU . . . . . . . . . . . . . 33.3 mm-40 -57.17 -33.22 67.21 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.196 -0.94 . . . . 1.9399999999999999 109.973 -179.452 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 350' ' ' LEU . . . . . 0.782 HD13 HD22 ' B' ' 350' ' ' LEU . 5.8 tt -64.66 -48.54 74.4 Favored 'General case' 0 N--CA 1.489 1.482 0 O-C-N 121.133 -0.98 . . . . 0.46000000000000002 109.516 -179.883 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 351' ' ' LYS . . . . . . . . . . . . . 22.1 tttm -58.1 -39.57 78.98 Favored 'General case' 0 N--CA 1.488 1.469 0 O-C-N 121.343 -0.848 . . . . 1.3999999999999999 109.413 -179.916 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 352' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -57.82 -52.5 65.21 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.295 -0.878 . . . . 1.1599999999999999 109.856 179.975 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 353' ' ' ALA . . . . . . . . . . . . . . . -66.47 -10.01 40.04 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.26 -0.9 . . . . 0.63 109.823 -179.547 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 354' ' ' GLN . . . . . . . . . . . . . 3.5 tt0 -84.13 -53.83 5.25 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.132 -0.98 . . . . 1.47 109.692 -179.98 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 355' ' ' ALA . . . . . . . . . . . . . . . -71.07 -8.47 53.61 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.254 -0.904 . . . . 1.01 109.815 -179.672 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 356' ' ' GLY . . . . . . . . . . . . . . . -81.38 -23.08 59.31 Favored Glycine 0 N--CA 1.491 2.316 0 N-CA-C 109.445 -1.462 . . . . 1.3 109.445 179.816 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 357' ' ' LYS . . . . . . . . . . . . . 15.1 mtpp -89.54 143.33 26.9 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.309 -1.112 . . . . 4.0999999999999996 109.38 179.923 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 358' ' ' GLU . . . . . 0.461 ' HG2' ' HD2' ' A' ' 359' ' ' PRO . 2.5 tt0 -49.61 143.67 10.45 Favored Pre-proline 0 N--CA 1.49 1.558 0 O-C-N 121.256 -0.902 . . . . 5.75 109.33 179.928 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 359' ' ' PRO . . . . . 0.461 ' HD2' ' HG2' ' A' ' 358' ' ' GLU . 2.3 Cg_endo -62.31 -164.56 0.04 OUTLIER 'Trans proline' 0 C--N 1.311 -1.396 0 C-N-CA 122.105 1.87 . . . . 5.0 110.228 -179.991 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 360' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.324 0 CA-C-O 117.961 -1.466 . . . . 6.9699999999999998 109.571 179.974 . . . . . . . . 0 0 . 1 . 024 nuclear build full ' B' B ' 319' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 N--CA 1.49 1.545 0 N-CA-C 109.414 -0.588 . . . . 7.5499999999999998 109.414 . . . . . . . . . 1 1 . 1 . 024 nuclear build full ' B' B ' 320' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 62.91 115.82 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.258 -0.901 . . . . 6.4400000000000004 109.629 179.826 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' B' B ' 321' ' ' LYS . . . . . . . . . . . . . 8.4 mttt -81.59 143.94 51.9 Favored Pre-proline 0 N--CA 1.49 1.534 0 O-C-N 121.223 -0.923 . . . . 6.1299999999999999 109.195 179.741 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' B' B ' 322' ' ' PRO . . . . . . . . . . . . . 2.1 Cg_endo -61.85 -81.73 0.01 OUTLIER 'Trans proline' 0 C--N 1.31 -1.461 0 C-N-CA 122.148 1.898 . . . . 2.8199999999999998 110.454 -179.648 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' B' B ' 323' ' ' LEU . . . . . . . . . . . . . 46.6 mt -82.8 105.01 13.47 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.201 -0.937 . . . . 2.8399999999999999 109.844 -179.725 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' B' B ' 324' ' ' ASP . . . . . . . . . . . . . 8.3 m-20 -81.74 -154.43 0.12 Allowed 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.291 -0.881 . . . . 1.53 109.524 179.841 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' B' B ' 325' ' ' GLY . . . . . . . . . . . . . . . -70.49 -168.1 7.24 Favored Glycine 0 N--CA 1.491 2.307 0 N-CA-C 109.693 -1.363 . . . . 0.58999999999999997 109.693 -179.952 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' B' B ' 326' ' ' GLU . . . . . . . . . . . . . 2.2 mm-40 -58.96 -173.63 0.02 OUTLIER 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.29 -1.124 . . . . 2.1299999999999999 109.696 -179.895 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' B' B ' 327' ' ' TYR . . . . . 0.597 ' CE1' ' HG2' ' D' ' 333' ' ' ARG . 42.5 m-85 -149.93 112.11 4.64 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.298 -0.876 . . . . 0.47999999999999998 109.755 179.977 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' B' B ' 328' ' ' PHE . . . . . 0.463 ' CE1' ' HA ' ' D' ' 335' ' ' ARG . 71.3 m-85 -113.81 -168.75 1.39 Allowed 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.242 -0.911 . . . . 0.32000000000000001 109.252 179.754 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' B' B ' 329' ' ' THR . . . . . 0.405 HG23 ' O ' ' B' ' 328' ' ' PHE . 40.1 p -154.6 167.3 30.59 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.269 -0.894 . . . . 0.23000000000000001 109.379 179.981 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' B' B ' 330' ' ' LEU . . . . . . . . . . . . . 24.2 tp -150.25 131.29 14.35 Favored 'General case' 0 N--CA 1.489 1.497 0 O-C-N 121.158 -0.964 . . . . 0.28000000000000003 109.483 -179.867 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' B' B ' 331' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -87.02 111.95 21.37 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.3 -0.875 . . . . 0.91000000000000003 109.428 179.927 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' B' B ' 332' ' ' ILE . . . . . 0.527 HG21 ' HA ' ' B' ' 338' ' ' PHE . 97.0 mt -103.51 103.88 15.83 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.534 0 O-C-N 121.226 -0.921 . . . . 0.23999999999999999 109.602 179.937 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' B' B ' 333' ' ' ARG . . . . . 0.545 ' HG2' ' CE1' ' D' ' 327' ' ' TYR . 12.9 mtp180 -72.5 150.32 43.35 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.364 -0.835 . . . . 2.9300000000000002 109.544 179.835 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' B' B ' 334' ' ' GLY . . . . . . . . . . . . . . . 86.07 131.0 2.71 Favored Glycine 0 N--CA 1.492 2.41 0 N-CA-C 109.812 -1.315 . . . . 0.40000000000000002 109.812 179.679 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' B' B ' 335' ' ' ARG . . . . . 0.462 ' O ' ' HB3' ' B' ' 338' ' ' PHE . 0.0 OUTLIER -80.31 -38.85 29.87 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.301 -1.117 . . . . 3.0099999999999998 109.625 179.905 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' B' B ' 336' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -58.02 -61.83 2.26 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.21 -0.932 . . . . 2.2799999999999998 110.056 -179.622 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' B' B ' 337' ' ' ARG . . . . . 0.481 ' NH1' ' HG2' ' B' ' 337' ' ' ARG . 0.0 OUTLIER -59.83 -26.55 65.88 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.067 -1.021 . . . . 2.9300000000000002 109.818 -179.559 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' B' B ' 338' ' ' PHE . . . . . 0.527 ' HA ' HG21 ' B' ' 332' ' ' ILE . 50.5 t80 -55.41 -58.85 6.06 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.11 -0.993 . . . . 0.37 109.692 -179.858 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' B' B ' 339' ' ' GLU . . . . . . . . . . . . . 56.8 mt-10 -50.62 -32.7 19.7 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.348 -0.845 . . . . 1.98 110.045 -179.666 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' B' B ' 340' ' ' MET . . . . . . . . . . . . . 23.9 ttp -63.79 -51.12 66.23 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.126 -0.983 . . . . 0.32000000000000001 110.013 -179.54 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' B' B ' 341' ' ' PHE . . . . . 0.426 ' HB2' HD13 ' B' ' 332' ' ' ILE . 36.4 m-85 -62.09 -45.84 91.72 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.169 -0.957 . . . . 0.17999999999999999 109.988 -179.569 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' B' B ' 342' ' ' ARG . . . . . 0.458 ' NH1' ' HG3' ' B' ' 342' ' ' ARG . 0.0 OUTLIER -49.59 -42.67 45.17 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.127 -0.983 . . . . 2.4199999999999999 110.065 -179.578 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' B' B ' 343' ' ' GLU . . . . . . . . . . . . . 1.6 tt0 -58.61 -47.95 82.64 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.072 -1.017 . . . . 2.3500000000000001 109.856 -179.575 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' B' B ' 344' ' ' LEU . . . . . 0.592 HD22 ' CD2' ' A' ' 344' ' ' LEU . 50.4 mt -61.32 -33.24 73.28 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.155 -0.966 . . . . 0.17999999999999999 109.544 -179.848 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' B' B ' 345' ' ' ASN . . . . . . . . . . . . . 21.5 t-20 -57.93 -59.28 5.5 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.225 -0.922 . . . . 1.0900000000000001 109.731 -179.952 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' B' B ' 346' ' ' GLU . . . . . . . . . . . . . 71.8 tt0 -62.05 -28.53 69.66 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.267 -0.896 . . . . 1.6599999999999999 110.076 -179.605 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' B' B ' 347' ' ' ALA . . . . . 0.769 ' HB1' ' HB1' ' A' ' 347' ' ' ALA . . . -60.42 -56.94 15.38 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.09 -1.006 . . . . 0.17000000000000001 109.992 -179.567 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' B' B ' 348' ' ' LEU . . . . . 0.53 HD22 ' N ' ' B' ' 348' ' ' LEU . 4.0 mm? -61.95 -46.64 88.41 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.179 -0.95 . . . . 0.28999999999999998 110.131 -179.491 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' B' B ' 349' ' ' GLU . . . . . . . . . . . . . 32.7 mm-40 -56.98 -33.26 66.93 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.133 -0.979 . . . . 1.95 110.092 -179.469 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' B' B ' 350' ' ' LEU . . . . . 0.782 HD22 HD13 ' A' ' 350' ' ' LEU . 5.8 tt -64.65 -48.42 74.86 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.17 -0.956 . . . . 0.45000000000000001 109.48 -179.919 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' B' B ' 351' ' ' LYS . . . . . . . . . . . . . 22.2 tttm -58.27 -39.33 78.97 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.349 -0.844 . . . . 1.3799999999999999 109.359 -179.907 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' B' B ' 352' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -58.01 -52.47 65.38 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.313 -0.867 . . . . 1.1599999999999999 109.88 -179.984 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' B' B ' 353' ' ' ALA . . . . . . . . . . . . . . . -66.55 -9.94 40.09 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.298 -0.877 . . . . 0.60999999999999999 109.847 -179.56 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' B' B ' 354' ' ' GLN . . . . . . . . . . . . . 3.5 tt0 -84.14 -53.9 5.2 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.125 -0.984 . . . . 1.45 109.621 179.955 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' B' B ' 355' ' ' ALA . . . . . . . . . . . . . . . -70.87 -8.83 55.56 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.301 -0.874 . . . . 0.97999999999999998 109.777 -179.68 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' B' B ' 356' ' ' GLY . . . . . . . . . . . . . . . -81.17 -22.86 60.09 Favored Glycine 0 N--CA 1.49 2.291 0 N-CA-C 109.505 -1.438 . . . . 1.29 109.505 179.968 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' B' B ' 357' ' ' LYS . . . . . . . . . . . . . 15.3 mtpp -89.84 143.16 27.03 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.316 -1.108 . . . . 4.0899999999999999 109.493 179.88 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' B' B ' 358' ' ' GLU . . . . . 0.461 ' HG2' ' HD2' ' B' ' 359' ' ' PRO . 2.4 tt0 -49.44 143.91 9.56 Favored Pre-proline 0 N--CA 1.491 1.589 0 O-C-N 121.246 -0.909 . . . . 5.7199999999999998 109.356 179.997 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' B' B ' 359' ' ' PRO . . . . . 0.461 ' HD2' ' HG2' ' B' ' 358' ' ' GLU . 2.3 Cg_endo -62.65 -164.62 0.04 OUTLIER 'Trans proline' 0 C--N 1.31 -1.471 0 C-N-CA 122.144 1.896 . . . . 4.9800000000000004 110.168 -179.919 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' B' B ' 360' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.359 0 CA-C-O 118.009 -1.439 . . . . 6.9800000000000004 109.618 179.974 . . . . . . . . 0 0 . 1 . 024 nuclear build full ' C' C ' 319' ' ' LYS . . . . . 0.466 ' O ' ' O ' ' C' ' 320' ' ' LYS . 0.1 OUTLIER . . . . . 0 N--CA 1.49 1.57 0 N-CA-C 109.47 -0.567 . . . . 6.8200000000000003 109.47 . . . . . . . . . 2 2 . 1 . 024 nuclear build full ' C' C ' 320' ' ' LYS . . . . . 0.466 ' O ' ' O ' ' C' ' 319' ' ' LYS . 1.9 tptt 59.21 152.63 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.241 -0.912 . . . . 6.4900000000000002 109.273 -179.965 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' C' C ' 321' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -158.58 84.7 2.51 Favored Pre-proline 0 N--CA 1.49 1.566 0 O-C-N 121.207 -0.933 . . . . 6.4000000000000004 109.678 -179.84 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' C' C ' 322' ' ' PRO . . . . . . . . . . . . . 2.0 Cg_endo -68.46 -1.03 6.66 Favored 'Trans proline' 0 C--N 1.309 -1.52 0 C-N-CA 122.259 1.973 . . . . 3.4199999999999999 110.729 179.817 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' C' C ' 323' ' ' LEU . . . . . 0.447 HD23 ' HA ' ' C' ' 323' ' ' LEU . 56.3 mt -79.97 91.99 5.5 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 120.984 -1.072 . . . . 3.9500000000000002 109.336 179.989 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' C' C ' 324' ' ' ASP . . . . . 0.456 ' HB3' ' CE1' ' C' ' 327' ' ' TYR . 3.8 m-20 -82.3 125.08 30.57 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.215 -0.928 . . . . 1.6299999999999999 109.614 179.999 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' C' C ' 325' ' ' GLY . . . . . 0.554 ' O ' ' CD1' ' C' ' 327' ' ' TYR . . . -70.07 -168.22 6.77 Favored Glycine 0 N--CA 1.491 2.311 0 N-CA-C 109.565 -1.414 . . . . 0.72999999999999998 109.565 179.965 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' C' C ' 326' ' ' GLU . . . . . 0.421 ' O ' ' CD1' ' C' ' 327' ' ' TYR . 30.6 mm-40 -59.17 171.68 0.7 Allowed 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.212 -1.169 . . . . 2.1699999999999999 109.402 179.923 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' C' C ' 327' ' ' TYR . . . . . 0.596 ' CE2' ' HG2' ' A' ' 333' ' ' ARG . 44.1 m-85 -149.36 114.31 5.41 Favored 'General case' 0 N--CA 1.488 1.437 0 O-C-N 121.254 -0.904 . . . . 0.47999999999999998 109.819 -179.878 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' C' C ' 328' ' ' PHE . . . . . 0.44 ' CE2' ' HA ' ' A' ' 335' ' ' ARG . 86.5 m-85 -113.27 -173.54 2.28 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.316 -0.865 . . . . 0.33000000000000002 109.132 179.595 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' C' C ' 329' ' ' THR . . . . . . . . . . . . . 22.6 p -152.38 165.2 35.74 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.12 -0.987 . . . . 0.23000000000000001 109.664 -179.851 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' C' C ' 330' ' ' LEU . . . . . . . . . . . . . 14.4 tp -151.32 129.23 11.7 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.339 -0.851 . . . . 0.28000000000000003 109.508 -179.853 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' C' C ' 331' ' ' GLN . . . . . 0.417 ' OE1' ' HB3' ' A' ' 327' ' ' TYR . 0.0 OUTLIER -89.13 116.56 27.48 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.174 -0.954 . . . . 1.48 109.837 -179.971 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' C' C ' 332' ' ' ILE . . . . . 0.431 HD13 ' CD2' ' C' ' 341' ' ' PHE . 87.6 mt -104.06 112.36 37.3 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.621 0 O-C-N 121.201 -0.937 . . . . 0.23999999999999999 109.555 179.661 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' C' C ' 333' ' ' ARG . . . . . 0.525 ' HG2' ' CE1' ' A' ' 327' ' ' TYR . 46.2 mtt180 -72.02 144.04 48.94 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.12 -0.988 . . . . 2.7400000000000002 109.321 179.711 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' C' C ' 334' ' ' GLY . . . . . . . . . . . . . . . 89.15 128.34 3.27 Favored Glycine 0 N--CA 1.492 2.385 0 N-CA-C 109.48 -1.448 . . . . 0.34999999999999998 109.48 -179.846 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' C' C ' 335' ' ' ARG . . . . . 0.504 ' HA ' ' CE1' ' A' ' 328' ' ' PHE . 37.1 ttp180 -78.98 -35.59 42.75 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.19 -1.183 . . . . 2.5299999999999998 109.676 -179.88 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' C' C ' 336' ' ' GLU . . . . . . . . . . . . . 2.0 tt0 -57.0 -60.4 3.64 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.247 -0.908 . . . . 2.6200000000000001 109.678 -179.808 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' C' C ' 337' ' ' ARG . . . . . 0.45 ' CG ' HH11 ' C' ' 337' ' ' ARG . 0.0 OUTLIER -59.51 -28.31 66.94 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.308 -0.87 . . . . 2.8100000000000001 109.553 -179.811 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' C' C ' 338' ' ' PHE . . . . . 0.467 ' HB3' ' O ' ' C' ' 335' ' ' ARG . 58.1 t80 -54.07 -55.37 28.14 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.249 -0.907 . . . . 0.40000000000000002 109.352 -179.962 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' C' C ' 339' ' ' GLU . . . . . . . . . . . . . 41.5 mt-10 -52.42 -32.08 37.46 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.242 -0.911 . . . . 2.0499999999999998 109.755 -179.997 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' C' C ' 340' ' ' MET . . . . . 0.436 ' HB3' ' O ' ' C' ' 337' ' ' ARG . 3.8 ttp -63.92 -55.03 25.62 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.227 -0.921 . . . . 0.32000000000000001 110.285 -179.402 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' C' C ' 341' ' ' PHE . . . . . 0.431 ' CD2' HD13 ' C' ' 332' ' ' ILE . 48.5 m-85 -61.0 -46.16 91.9 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.167 -0.958 . . . . 0.17999999999999999 109.701 -179.448 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' C' C ' 342' ' ' ARG . . . . . 0.404 ' CG ' HH11 ' C' ' 342' ' ' ARG . 0.2 OUTLIER -47.72 -41.47 22.96 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.287 -0.883 . . . . 2.9100000000000001 109.278 179.761 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' C' C ' 343' ' ' GLU . . . . . . . . . . . . . 43.3 tt0 -61.17 -48.74 80.18 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.245 -0.909 . . . . 2.1400000000000001 109.951 -179.869 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' C' C ' 344' ' ' LEU . . . . . . . . . . . . . 35.4 mt -60.88 -30.14 69.97 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.135 -0.978 . . . . 0.22 109.828 -179.517 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' C' C ' 345' ' ' ASN . . . . . . . . . . . . . 25.8 t-20 -57.77 -58.31 8.91 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.261 -0.9 . . . . 1.0800000000000001 109.488 179.879 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' C' C ' 346' ' ' GLU . . . . . 0.434 ' O ' ' HB2' ' C' ' 350' ' ' LEU . 20.1 tt0 -61.67 -25.63 67.51 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.301 -0.875 . . . . 2.21 109.922 -179.71 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' C' C ' 347' ' ' ALA . . . . . 0.469 ' O ' ' HB3' ' C' ' 350' ' ' LEU . . . -62.41 -55.62 26.07 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.106 -0.996 . . . . 0.17999999999999999 109.715 -179.815 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' C' C ' 348' ' ' LEU . . . . . 0.622 ' N ' HD22 ' C' ' 348' ' ' LEU . 4.1 mm? -63.19 -55.91 21.11 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.131 -0.981 . . . . 0.32000000000000001 109.969 -179.557 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' C' C ' 349' ' ' GLU . . . . . 0.426 ' OE2' ' HD3' ' A' ' 333' ' ' ARG . 41.6 mt-10 -56.61 -25.89 54.23 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.103 -0.998 . . . . 2.1899999999999999 109.24 -179.782 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' C' C ' 350' ' ' LEU . . . . . 1.132 HD11 HD22 ' D' ' 350' ' ' LEU . 0.5 OUTLIER -65.62 -49.45 68.66 Favored 'General case' 0 C--N 1.301 -1.516 0 N-CA-C 108.811 -0.811 . . . . 0.46000000000000002 108.811 179.813 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' C' C ' 351' ' ' LYS . . . . . 0.546 ' N ' HD13 ' C' ' 350' ' ' LEU . 6.3 tttt -62.27 -41.95 98.92 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.291 -0.881 . . . . 1.3500000000000001 109.298 179.319 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' C' C ' 352' ' ' ASP . . . . . . . . . . . . . 43.3 m-20 -56.06 -28.19 56.56 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.341 -0.849 . . . . 1.1899999999999999 109.836 -179.867 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' C' C ' 353' ' ' ALA . . . . . . . . . . . . . . . -66.33 -46.52 76.57 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.227 -0.92 . . . . 0.56999999999999995 109.78 -179.645 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' C' C ' 354' ' ' GLN . . . . . 0.497 ' NE2' ' HA ' ' C' ' 351' ' ' LYS . 0.0 OUTLIER -82.84 14.43 3.25 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.205 -0.934 . . . . 1.47 109.989 -179.773 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' C' C ' 355' ' ' ALA . . . . . . . . . . . . . . . -69.07 -72.71 0.17 Allowed 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.106 -0.996 . . . . 0.93000000000000005 109.962 -179.813 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' C' C ' 356' ' ' GLY . . . . . . . . . . . . . . . -81.88 58.69 4.91 Favored Glycine 0 N--CA 1.494 2.53 0 N-CA-C 110.442 -1.063 . . . . 1.3300000000000001 110.442 -179.624 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' C' C ' 357' ' ' LYS . . . . . . . . . . . . . 9.2 pttt -88.45 152.24 22.02 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 120.94 -1.33 . . . . 4.0099999999999998 109.491 179.787 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' C' C ' 358' ' ' GLU . . . . . . . . . . . . . 2.1 mt-10 -50.54 148.77 6.43 Favored Pre-proline 0 N--CA 1.491 1.624 0 O-C-N 121.163 -0.961 . . . . 5.75 109.58 179.9 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' C' C ' 359' ' ' PRO . . . . . . . . . . . . . 1.4 Cg_endo -64.62 119.5 6.55 Favored 'Trans proline' 0 C--N 1.31 -1.47 0 C-N-CA 122.237 1.958 . . . . 4.9400000000000004 110.14 179.927 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' C' C ' 360' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.255 0 CA-C-O 117.985 -1.453 . . . . 6.5 109.544 179.945 . . . . . . . . 0 0 . 1 . 024 nuclear build full ' D' D ' 319' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 N--CA 1.491 1.577 0 CA-C-O 121.322 0.582 . . . . 7.5300000000000002 109.465 . . . . . . . . . 1 1 . 1 . 024 nuclear build full ' D' D ' 320' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 62.87 116.06 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.202 -0.936 . . . . 6.4100000000000001 109.628 -179.994 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' D' D ' 321' ' ' LYS . . . . . . . . . . . . . 8.3 mttt -81.67 144.06 51.84 Favored Pre-proline 0 N--CA 1.49 1.56 0 O-C-N 121.175 -0.953 . . . . 6.1100000000000003 109.149 179.769 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' D' D ' 322' ' ' PRO . . . . . . . . . . . . . 2.1 Cg_endo -62.04 -81.67 0.01 OUTLIER 'Trans proline' 0 C--N 1.31 -1.484 0 C-N-CA 122.059 1.84 . . . . 2.8199999999999998 110.484 -179.643 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' D' D ' 323' ' ' LEU . . . . . . . . . . . . . 46.4 mt -82.69 104.95 13.32 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.15 -0.969 . . . . 2.8300000000000001 109.913 -179.747 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' D' D ' 324' ' ' ASP . . . . . . . . . . . . . 8.3 m-20 -81.76 -154.71 0.12 Allowed 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.317 -0.864 . . . . 1.54 109.483 179.807 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' D' D ' 325' ' ' GLY . . . . . . . . . . . . . . . -69.96 -167.99 6.49 Favored Glycine 0 N--CA 1.491 2.306 0 N-CA-C 109.733 -1.347 . . . . 0.58999999999999997 109.733 -179.971 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' D' D ' 326' ' ' GLU . . . . . . . . . . . . . 2.2 mm-40 -59.21 -173.98 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.383 -1.069 . . . . 2.1299999999999999 109.551 -179.945 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' D' D ' 327' ' ' TYR . . . . . 0.545 ' CE1' ' HG2' ' B' ' 333' ' ' ARG . 43.0 m-85 -149.71 112.34 4.76 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.367 -0.833 . . . . 0.46999999999999997 109.74 179.936 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' D' D ' 328' ' ' PHE . . . . . 0.404 ' O ' HG23 ' D' ' 329' ' ' THR . 71.8 m-85 -113.94 -168.68 1.39 Allowed 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.277 -0.889 . . . . 0.29999999999999999 109.201 179.737 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' D' D ' 329' ' ' THR . . . . . 0.404 HG23 ' O ' ' D' ' 328' ' ' PHE . 39.5 p -154.59 167.34 30.43 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.19 -0.944 . . . . 0.22 109.41 179.987 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' D' D ' 330' ' ' LEU . . . . . . . . . . . . . 24.6 tp -150.24 131.36 14.43 Favored 'General case' 0 N--CA 1.488 1.472 0 O-C-N 121.239 -0.913 . . . . 0.28000000000000003 109.512 -179.878 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' D' D ' 331' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -87.13 111.85 21.35 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.351 -0.843 . . . . 0.93000000000000005 109.434 179.971 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' D' D ' 332' ' ' ILE . . . . . 0.545 HG21 ' HA ' ' D' ' 338' ' ' PHE . 97.0 mt -103.46 103.8 15.7 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.533 0 O-C-N 121.145 -0.972 . . . . 0.25 109.708 179.994 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' D' D ' 333' ' ' ARG . . . . . 0.597 ' HG2' ' CE1' ' B' ' 327' ' ' TYR . 13.2 mtp180 -72.57 150.11 43.42 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.256 -0.903 . . . . 2.9300000000000002 109.458 179.887 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' D' D ' 334' ' ' GLY . . . . . . . . . . . . . . . 86.31 130.94 2.8 Favored Glycine 0 N--CA 1.491 2.333 0 N-CA-C 109.815 -1.314 . . . . 0.40999999999999998 109.815 179.723 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' D' D ' 335' ' ' ARG . . . . . 0.463 ' HA ' ' CE1' ' B' ' 328' ' ' PHE . 0.0 OUTLIER -80.28 -38.94 29.83 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.308 -1.113 . . . . 3.0299999999999998 109.575 179.883 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' D' D ' 336' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -58.08 -61.79 2.29 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.241 -0.912 . . . . 2.2599999999999998 110.031 -179.597 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' D' D ' 337' ' ' ARG . . . . . 0.474 ' NH1' ' HG2' ' D' ' 337' ' ' ARG . 0.0 OUTLIER -59.86 -26.38 65.79 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.175 -0.953 . . . . 2.9199999999999999 109.862 -179.579 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' D' D ' 338' ' ' PHE . . . . . 0.545 ' HA ' HG21 ' D' ' 332' ' ' ILE . 51.0 t80 -55.58 -58.7 6.71 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.195 -0.941 . . . . 0.37 109.725 -179.869 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' D' D ' 339' ' ' GLU . . . . . . . . . . . . . 55.6 mt-10 -50.63 -32.7 19.72 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.301 -0.874 . . . . 1.99 110.067 -179.711 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' D' D ' 340' ' ' MET . . . . . . . . . . . . . 23.2 ttp -63.78 -51.18 65.99 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.181 -0.95 . . . . 0.31 110.008 -179.62 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' D' D ' 341' ' ' PHE . . . . . 0.449 ' HB2' HD13 ' D' ' 332' ' ' ILE . 36.6 m-85 -62.01 -45.88 91.66 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.224 -0.922 . . . . 0.17999999999999999 110.064 -179.55 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' D' D ' 342' ' ' ARG . . . . . 0.461 ' NH1' ' HG3' ' D' ' 342' ' ' ARG . 0.0 OUTLIER -49.58 -42.42 44.39 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.086 -1.009 . . . . 2.4100000000000001 110.094 -179.513 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' D' D ' 343' ' ' GLU . . . . . . . . . . . . . 1.6 tt0 -58.81 -47.69 83.93 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.018 -1.051 . . . . 2.3500000000000001 109.886 -179.538 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' D' D ' 344' ' ' LEU . . . . . . . . . . . . . 49.5 mt -61.59 -33.13 73.35 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.106 -0.996 . . . . 0.19 109.435 -179.776 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' D' D ' 345' ' ' ASN . . . . . . . . . . . . . 21.7 t-20 -58.03 -59.14 5.73 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.299 -0.875 . . . . 1.0900000000000001 109.716 -179.851 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' D' D ' 346' ' ' GLU . . . . . . . . . . . . . 72.1 tt0 -62.11 -28.61 69.75 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.337 -0.852 . . . . 1.6899999999999999 110.059 -179.641 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' D' D ' 347' ' ' ALA . . . . . . . . . . . . . . . -60.24 -57.05 14.45 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.084 -1.01 . . . . 0.17999999999999999 110.063 -179.641 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' D' D ' 348' ' ' LEU . . . . . 0.533 HD22 ' N ' ' D' ' 348' ' ' LEU . 4.0 mm? -61.92 -46.59 88.69 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.246 -0.909 . . . . 0.31 110.106 -179.426 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' D' D ' 349' ' ' GLU . . . . . . . . . . . . . 33.6 mm-40 -56.97 -33.41 67.06 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.187 -0.946 . . . . 1.95 109.964 -179.397 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' D' D ' 350' ' ' LEU . . . . . 1.132 HD22 HD11 ' C' ' 350' ' ' LEU . 5.8 tt -64.64 -48.19 75.74 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.15 -0.969 . . . . 0.42999999999999999 109.666 -179.921 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' D' D ' 351' ' ' LYS . . . . . . . . . . . . . 22.3 tttm -58.43 -39.49 79.94 Favored 'General case' 0 N--CA 1.487 1.414 0 O-C-N 121.24 -0.913 . . . . 1.3999999999999999 109.349 -179.874 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' D' D ' 352' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -57.97 -52.39 65.72 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.28 -0.887 . . . . 1.1699999999999999 109.829 179.929 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' D' D ' 353' ' ' ALA . . . . . . . . . . . . . . . -66.58 -9.93 40.33 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.21 -0.931 . . . . 0.58999999999999997 109.783 -179.483 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' D' D ' 354' ' ' GLN . . . . . . . . . . . . . 2.5 tt0 -84.2 -53.97 5.13 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.134 -0.979 . . . . 1.4399999999999999 109.613 179.996 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' D' D ' 355' ' ' ALA . . . . . . . . . . . . . . . -70.81 -8.77 54.89 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.22 -0.925 . . . . 0.97999999999999998 109.85 -179.676 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' D' D ' 356' ' ' GLY . . . . . . . . . . . . . . . -81.11 -23.01 59.89 Favored Glycine 0 N--CA 1.491 2.305 0 N-CA-C 109.477 -1.449 . . . . 1.28 109.477 179.807 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' D' D ' 357' ' ' LYS . . . . . . . . . . . . . 15.2 mtpp -89.47 143.21 27.0 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.328 -1.101 . . . . 4.0899999999999999 109.504 179.85 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' D' D ' 358' ' ' GLU . . . . . 0.475 ' HG2' ' HD2' ' D' ' 359' ' ' PRO . 2.4 tt0 -49.73 144.07 10.31 Favored Pre-proline 0 N--CA 1.489 1.517 0 O-C-N 121.153 -0.967 . . . . 5.71 109.331 -179.996 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' D' D ' 359' ' ' PRO . . . . . 0.475 ' HD2' ' HG2' ' D' ' 358' ' ' GLU . 2.3 Cg_endo -62.53 -164.83 0.04 OUTLIER 'Trans proline' 0 C--N 1.31 -1.491 0 C-N-CA 122.07 1.846 . . . . 4.9699999999999998 110.23 -179.948 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' D' D ' 360' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.322 0 N-CA-C 109.458 -1.457 . . . . 6.9699999999999998 109.458 179.929 . . . . . . . . 0 0 . 1 . 025 nuclear build full ' A' A ' 319' ' ' LYS . . . . . . . . . . . . . 9.9 mtmt . . . . . 0 N--CA 1.491 1.601 0 N-CA-C 109.418 -0.586 . . . . 7.5499999999999998 109.418 . . . . . . . . . 0 0 . 1 . 025 nuclear build full ' A' A ' 320' ' ' LYS . . . . . 0.469 ' O ' ' HD3' ' A' ' 322' ' ' PRO . 6.8 mttt 57.69 45.55 18.81 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.32 -0.862 . . . . 6.4299999999999997 109.264 -179.932 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 321' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -82.11 114.26 49.57 Favored Pre-proline 0 N--CA 1.492 1.625 0 O-C-N 121.413 -0.805 . . . . 6.1299999999999999 109.438 -179.882 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 322' ' ' PRO . . . . . 0.469 ' HD3' ' O ' ' A' ' 320' ' ' LYS . 1.9 Cg_endo -68.2 -4.84 13.46 Favored 'Trans proline' 0 C--N 1.313 -1.293 0 C-N-CA 121.83 1.686 . . . . 2.8300000000000001 110.389 -179.819 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 323' ' ' LEU . . . . . . . . . . . . . 16.7 mt -84.87 46.69 1.29 Allowed 'General case' 0 N--CA 1.488 1.452 0 O-C-N 121.091 -1.006 . . . . 2.8300000000000001 109.663 179.923 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 324' ' ' ASP . . . . . . . . . . . . . 19.4 m-20 -79.86 140.66 36.7 Favored 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.034 -1.041 . . . . 1.53 109.182 179.927 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 325' ' ' GLY . . . . . . . . . . . . . . . -67.96 179.99 17.31 Favored Glycine 0 N--CA 1.489 2.203 0 N-CA-C 109.475 -1.45 . . . . 0.60999999999999999 109.475 -179.811 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 326' ' ' GLU . . . . . . . . . . . . . 3.0 mm-40 -57.72 179.61 0.06 Allowed 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.155 -1.203 . . . . 2.1299999999999999 109.371 -179.938 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 327' ' ' TYR . . . . . 0.417 ' CE1' ' HG2' ' C' ' 333' ' ' ARG . 48.4 m-85 -148.92 106.28 3.63 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.163 -0.96 . . . . 0.47999999999999998 109.629 -179.919 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 328' ' ' PHE . . . . . . . . . . . . . 68.6 m-85 -112.97 -164.08 0.89 Allowed 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.23 -0.919 . . . . 0.31 109.55 179.834 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 329' ' ' THR . . . . . . . . . . . . . 20.9 p -153.83 173.96 15.21 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.228 -0.92 . . . . 0.22 109.227 179.833 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 330' ' ' LEU . . . . . 0.447 HD21 HD22 ' C' ' 345' ' ' ASN . 28.8 tp -152.16 131.95 13.25 Favored 'General case' 0 N--CA 1.489 1.476 0 O-C-N 120.94 -1.1 . . . . 0.28000000000000003 109.833 -179.891 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 331' ' ' GLN . . . . . . . . . . . . . 6.4 tp-100 -88.97 107.34 18.97 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.354 -0.841 . . . . 0.91000000000000003 109.192 179.533 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 332' ' ' ILE . . . . . . . . . . . . . 36.9 mt -103.3 107.21 21.64 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.624 0 O-C-N 121.112 -0.993 . . . . 0.26000000000000001 109.778 -179.792 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 333' ' ' ARG . . . . . 0.601 ' HG2' ' CE2' ' C' ' 327' ' ' TYR . 0.0 OUTLIER -73.45 155.88 38.82 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.39 -0.819 . . . . 2.9199999999999999 109.393 179.702 . . . . . . . . 3 3 . 1 . 025 nuclear build full ' A' A ' 334' ' ' GLY . . . . . . . . . . . . . . . 77.13 128.23 0.35 Allowed Glycine 0 N--CA 1.492 2.433 0 N-CA-C 109.898 -1.281 . . . . 0.40000000000000002 109.898 179.584 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 335' ' ' ARG . . . . . 0.56 ' HG3' ' CE2' ' C' ' 328' ' ' PHE . 1.7 ttt-85 -80.0 -36.1 36.44 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.371 -1.076 . . . . 3.0099999999999998 109.543 179.862 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 336' ' ' GLU . . . . . . . . . . . . . 2.2 tm-20 -56.22 -64.84 0.73 Allowed 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.27 -0.893 . . . . 2.29 109.723 -179.84 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 337' ' ' ARG . . . . . 0.714 ' HE ' HD12 ' C' ' 348' ' ' LEU . 0.0 OUTLIER -60.78 -28.9 69.09 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.339 -0.851 . . . . 2.9300000000000002 109.542 -179.675 . . . . . . . . 3 3 . 1 . 025 nuclear build full ' A' A ' 338' ' ' PHE . . . . . . . . . . . . . 52.3 t80 -55.52 -60.17 3.8 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.163 -0.96 . . . . 0.38 109.462 -179.925 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 339' ' ' GLU . . . . . . . . . . . . . 65.0 mm-40 -51.24 -30.09 16.45 Favored 'General case' 0 N--CA 1.488 1.456 0 O-C-N 121.357 -0.839 . . . . 1.97 109.757 -179.903 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 340' ' ' MET . . . . . 0.432 ' HB3' ' O ' ' A' ' 337' ' ' ARG . 7.6 ttp -64.19 -50.45 68.03 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.175 -0.953 . . . . 0.31 109.575 -179.95 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 341' ' ' PHE . . . . . . . . . . . . . 45.5 m-85 -63.0 -45.7 91.14 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.33 -0.856 . . . . 0.17999999999999999 109.981 -179.703 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 342' ' ' ARG . . . . . . . . . . . . . 5.4 ttm180 -49.29 -40.99 36.82 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.122 -0.986 . . . . 2.4199999999999999 109.915 -179.535 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 343' ' ' GLU . . . . . . . . . . . . . 1.4 tt0 -58.71 -43.78 90.18 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.145 -0.972 . . . . 2.3500000000000001 109.806 -179.714 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 344' ' ' LEU . . . . . 0.762 HD22 HD22 ' B' ' 344' ' ' LEU . 42.9 mt -63.28 -46.15 88.17 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.239 -0.913 . . . . 0.17999999999999999 109.876 -179.749 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 345' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -55.61 -46.95 77.27 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.115 -0.991 . . . . 1.0900000000000001 109.923 -179.481 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 346' ' ' GLU . . . . . . . . . . . . . 1.4 tp10 -60.72 -36.39 78.72 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.179 -0.951 . . . . 1.6499999999999999 109.776 -179.66 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 347' ' ' ALA . . . . . 1.04 ' HB1' ' HB1' ' B' ' 347' ' ' ALA . . . -59.4 -51.1 71.37 Favored 'General case' 0 N--CA 1.493 1.692 0 O-C-N 121.222 -0.924 . . . . 0.17999999999999999 109.944 -179.712 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 348' ' ' LEU . . . . . 0.597 HD22 ' N ' ' A' ' 348' ' ' LEU . 4.1 mm? -61.78 -43.86 98.01 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.237 -0.914 . . . . 0.29999999999999999 109.658 -179.721 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 349' ' ' GLU . . . . . . . . . . . . . 2.2 mm-40 -59.17 -34.16 71.77 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.199 -0.938 . . . . 1.9399999999999999 110.244 -179.551 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 350' ' ' LEU . . . . . 0.604 HD22 HD13 ' B' ' 350' ' ' LEU . 6.7 tt -63.12 -43.72 97.63 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.074 -1.016 . . . . 0.46000000000000002 109.465 -179.773 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 351' ' ' LYS . . . . . . . . . . . . . 25.5 tttm -56.67 -42.73 79.51 Favored 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.22 -0.925 . . . . 1.3999999999999999 109.861 -179.679 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 352' ' ' ASP . . . . . . . . . . . . . 36.2 m-20 -58.69 -49.92 75.78 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.186 -0.946 . . . . 1.1599999999999999 109.817 179.974 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 353' ' ' ALA . . . . . . . . . . . . . . . -67.65 -10.27 50.73 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.27 -0.894 . . . . 0.63 109.534 -179.776 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 354' ' ' GLN . . . . . 0.448 ' OE1' HD11 ' B' ' 350' ' ' LEU . 8.1 tt0 -84.72 -59.07 2.47 Favored 'General case' 0 C--N 1.302 -1.473 0 O-C-N 121.25 -0.906 . . . . 1.47 109.767 -179.917 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 355' ' ' ALA . . . . . . . . . . . . . . . -70.0 -4.22 19.83 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.327 -0.858 . . . . 1.01 110.152 -179.534 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 356' ' ' GLY . . . . . . . . . . . . . . . -79.64 -10.78 85.44 Favored Glycine 0 N--CA 1.492 2.399 0 N-CA-C 109.362 -1.495 . . . . 1.3 109.362 179.866 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 357' ' ' LYS . . . . . . . . . . . . . 51.9 mttt -88.49 170.76 10.61 Favored 'General case' 0 N--CA 1.487 1.411 0 O-C-N 121.279 -1.13 . . . . 4.0999999999999996 109.372 179.735 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 358' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -48.74 150.99 2.27 Favored Pre-proline 0 N--CA 1.491 1.579 0 O-C-N 121.26 -0.9 . . . . 5.75 109.254 179.961 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 359' ' ' PRO . . . . . . . . . . . . . 5.3 Cg_exo -58.95 -159.9 0.02 OUTLIER 'Trans proline' 0 C--N 1.309 -1.525 0 C-N-CA 122.05 1.833 . . . . 5.0 110.164 -179.958 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 360' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.194 0 CA-C-O 117.972 -1.46 . . . . 6.9699999999999998 109.551 -179.94 . . . . . . . . 0 0 . 1 . 025 nuclear build full ' B' B ' 319' ' ' LYS . . . . . . . . . . . . . 10.0 mtmt . . . . . 0 N--CA 1.489 1.516 0 N-CA-C 109.485 -0.561 . . . . 7.5499999999999998 109.485 . . . . . . . . . 0 0 . 1 . 025 nuclear build full ' B' B ' 320' ' ' LYS . . . . . 0.464 ' O ' ' HD3' ' B' ' 322' ' ' PRO . 6.2 mttt 57.86 45.14 18.92 Favored 'General case' 0 N--CA 1.489 1.501 0 O-C-N 121.259 -0.901 . . . . 6.4400000000000004 109.233 179.907 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' B' B ' 321' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -81.79 114.24 48.75 Favored Pre-proline 0 N--CA 1.491 1.603 0 O-C-N 121.39 -0.819 . . . . 6.1299999999999999 109.437 -179.952 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' B' B ' 322' ' ' PRO . . . . . 0.464 ' HD3' ' O ' ' B' ' 320' ' ' LYS . 1.8 Cg_endo -68.34 -4.62 13.19 Favored 'Trans proline' 0 C--N 1.313 -1.293 0 C-N-CA 121.938 1.759 . . . . 2.8199999999999998 110.534 -179.924 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' B' B ' 323' ' ' LEU . . . . . . . . . . . . . 17.0 mt -85.05 45.64 1.19 Allowed 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.215 -0.928 . . . . 2.8399999999999999 109.739 -179.834 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 324' ' ' ASP . . . . . . . . . . . . . 20.1 m-20 -79.28 139.2 37.92 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.16 -0.963 . . . . 1.53 109.548 179.998 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 325' ' ' GLY . . . . . . . . . . . . . . . -66.12 179.72 10.9 Favored Glycine 0 N--CA 1.49 2.254 0 N-CA-C 109.476 -1.449 . . . . 0.58999999999999997 109.476 179.99 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 326' ' ' GLU . . . . . . . . . . . . . 3.0 mm-40 -58.1 179.5 0.07 Allowed 'General case' 0 N--CA 1.488 1.452 0 O-C-N 121.259 -1.142 . . . . 2.1299999999999999 109.349 179.952 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 327' ' ' TYR . . . . . 0.59 ' CE1' ' HG2' ' D' ' 333' ' ' ARG . 47.6 m-85 -148.55 106.16 3.67 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.224 -0.923 . . . . 0.47999999999999998 109.633 -179.841 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' B' B ' 328' ' ' PHE . . . . . 0.416 ' CZ ' ' HG3' ' D' ' 335' ' ' ARG . 66.7 m-85 -113.22 -164.5 0.92 Allowed 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.287 -0.883 . . . . 0.32000000000000001 109.546 179.797 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' B' B ' 329' ' ' THR . . . . . . . . . . . . . 20.8 p -153.4 174.41 14.39 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.297 -0.877 . . . . 0.23000000000000001 109.276 -179.956 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 330' ' ' LEU . . . . . . . . . . . . . 28.3 tp -152.75 131.53 12.41 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.062 -1.024 . . . . 0.28000000000000003 109.917 -179.826 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 331' ' ' GLN . . . . . 0.43 ' NE2' ' O ' ' D' ' 328' ' ' PHE . 45.8 tp60 -88.81 107.91 19.23 Favored 'General case' 0 N--CA 1.489 1.48 0 O-C-N 121.33 -0.857 . . . . 0.91000000000000003 109.135 179.507 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' B' B ' 332' ' ' ILE . . . . . . . . . . . . . 35.2 mt -103.84 107.15 21.62 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.584 0 O-C-N 121.136 -0.977 . . . . 0.23999999999999999 109.618 -179.728 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 333' ' ' ARG . . . . . 0.529 ' HG2' ' CE1' ' D' ' 327' ' ' TYR . 0.0 OUTLIER -73.66 155.05 39.42 Favored 'General case' 0 N--CA 1.488 1.46 0 O-C-N 121.293 -0.879 . . . . 2.9300000000000002 109.347 179.695 . . . . . . . . 3 3 . 1 . 025 nuclear build full ' B' B ' 334' ' ' GLY . . . . . . . . . . . . . . . 78.05 128.39 0.45 Allowed Glycine 0 N--CA 1.492 2.369 0 N-CA-C 109.965 -1.254 . . . . 0.40000000000000002 109.965 179.702 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 335' ' ' ARG . . . . . 0.499 ' NH1' ' HG2' ' B' ' 335' ' ' ARG . 1.7 ttt-85 -80.01 -35.8 36.83 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.308 -1.113 . . . . 3.0099999999999998 109.467 179.845 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' B' B ' 336' ' ' GLU . . . . . . . . . . . . . 2.3 tm-20 -56.49 -65.43 0.61 Allowed 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.333 -0.854 . . . . 2.2799999999999998 109.725 -179.699 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 337' ' ' ARG . . . . . 0.582 ' HE ' HD12 ' D' ' 348' ' ' LEU . 0.0 OUTLIER -60.18 -29.25 68.57 Favored 'General case' 0 N--CA 1.488 1.463 0 O-C-N 121.283 -0.886 . . . . 2.9300000000000002 109.647 -179.789 . . . . . . . . 3 3 . 1 . 025 nuclear build full ' B' B ' 338' ' ' PHE . . . . . . . . . . . . . 53.1 t80 -55.03 -59.83 4.2 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.243 -0.911 . . . . 0.37 109.542 -179.949 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 339' ' ' GLU . . . . . . . . . . . . . 62.4 mm-40 -51.6 -30.08 19.8 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.34 -0.85 . . . . 1.98 109.71 -179.963 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 340' ' ' MET . . . . . 0.44 ' HB3' ' O ' ' B' ' 337' ' ' ARG . 7.0 ttp -64.16 -50.91 66.32 Favored 'General case' 0 N--CA 1.489 1.499 0 O-C-N 121.192 -0.942 . . . . 0.32000000000000001 109.592 -179.732 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' B' B ' 341' ' ' PHE . . . . . . . . . . . . . 47.0 m-85 -62.46 -46.24 89.41 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.231 -0.918 . . . . 0.17999999999999999 109.939 -179.822 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 342' ' ' ARG . . . . . . . . . . . . . 5.4 ttm180 -48.98 -41.04 32.91 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.182 -0.949 . . . . 2.4199999999999999 109.9 -179.437 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 343' ' ' GLU . . . . . . . . . . . . . 1.4 tt0 -58.91 -43.92 91.15 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.171 -0.956 . . . . 2.3500000000000001 109.673 -179.641 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 344' ' ' LEU . . . . . 0.762 HD22 HD22 ' A' ' 344' ' ' LEU . 41.3 mt -62.95 -46.27 88.54 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.217 -0.927 . . . . 0.17999999999999999 109.939 -179.8 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' B' B ' 345' ' ' ASN . . . . . . . . . . . . . 41.7 t-20 -55.42 -46.85 76.63 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.253 -0.904 . . . . 1.0900000000000001 109.823 -179.527 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 346' ' ' GLU . . . . . . . . . . . . . 1.4 tp10 -60.76 -36.66 79.49 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.239 -0.913 . . . . 1.6599999999999999 109.825 -179.714 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 347' ' ' ALA . . . . . 1.04 ' HB1' ' HB1' ' A' ' 347' ' ' ALA . . . -59.23 -51.46 69.88 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.177 -0.952 . . . . 0.17000000000000001 109.886 -179.731 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' B' B ' 348' ' ' LEU . . . . . 0.603 HD22 ' N ' ' B' ' 348' ' ' LEU . 4.1 mm? -61.21 -44.36 97.4 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.234 -0.917 . . . . 0.28999999999999998 109.723 -179.751 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' B' B ' 349' ' ' GLU . . . . . . . . . . . . . 2.3 mm-40 -58.51 -34.75 71.29 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.257 -0.902 . . . . 1.95 110.214 -179.584 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 350' ' ' LEU . . . . . 0.604 HD13 HD22 ' A' ' 350' ' ' LEU . 6.4 tt -62.53 -44.14 97.09 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.058 -1.026 . . . . 0.45000000000000001 109.579 -179.888 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' B' B ' 351' ' ' LYS . . . . . . . . . . . . . 26.3 tttm -56.5 -43.24 79.51 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.312 -0.867 . . . . 1.3799999999999999 109.797 -179.728 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 352' ' ' ASP . . . . . . . . . . . . . 35.0 m-20 -58.0 -50.41 73.5 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.218 -0.926 . . . . 1.1599999999999999 109.712 179.972 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 353' ' ' ALA . . . . . . . . . . . . . . . -67.08 -10.96 55.55 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.087 -1.008 . . . . 0.60999999999999999 109.62 -179.662 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 354' ' ' GLN . . . . . 0.409 ' OE1' HD11 ' A' ' 350' ' ' LEU . 8.6 tt0 -84.09 -59.05 2.52 Favored 'General case' 0 N--CA 1.489 1.497 0 O-C-N 121.324 -0.86 . . . . 1.45 109.781 -179.774 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' B' B ' 355' ' ' ALA . . . . . . . . . . . . . . . -70.14 -4.13 19.95 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.32 -0.863 . . . . 0.97999999999999998 110.202 -179.321 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 356' ' ' GLY . . . . . . . . . . . . . . . -80.17 -9.71 86.3 Favored Glycine 0 N--CA 1.49 2.262 0 N-CA-C 109.398 -1.481 . . . . 1.29 109.398 179.848 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 357' ' ' LYS . . . . . . . . . . . . . 54.1 mttt -89.31 171.06 10.04 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.348 -1.089 . . . . 4.0899999999999999 109.289 179.621 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 358' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -48.5 151.0 2.12 Favored Pre-proline 0 N--CA 1.491 1.579 0 O-C-N 121.145 -0.972 . . . . 5.7199999999999998 109.288 179.958 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' B' B ' 359' ' ' PRO . . . . . . . . . . . . . 4.9 Cg_exo -59.01 -159.6 0.02 OUTLIER 'Trans proline' 0 C--N 1.311 -1.446 0 C-N-CA 122.169 1.912 . . . . 4.9800000000000004 110.13 179.844 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 360' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.319 0 N-CA-C 109.475 -1.45 . . . . 6.9800000000000004 109.475 179.997 . . . . . . . . 0 0 . 1 . 025 nuclear build full ' C' C ' 319' ' ' LYS . . . . . . . . . . . . . 3.4 mttm . . . . . 0 N--CA 1.49 1.549 0 N-CA-C 109.297 -0.631 . . . . 6.8200000000000003 109.297 . . . . . . . . . 0 0 . 1 . 025 nuclear build full ' C' C ' 320' ' ' LYS . . . . . . . . . . . . . 17.1 mmtt 58.58 97.33 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.27 -0.894 . . . . 6.4900000000000002 109.981 179.673 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' C' C ' 321' ' ' LYS . . . . . 0.519 ' HB2' ' HD2' ' C' ' 322' ' ' PRO . 0.0 OUTLIER -81.6 163.24 55.07 Favored Pre-proline 0 N--CA 1.489 1.508 0 N-CA-C 108.582 -0.896 . . . . 6.4000000000000004 108.582 179.32 . . . . . . . . 3 3 . 1 . 025 nuclear build full ' C' C ' 322' ' ' PRO . . . . . 0.519 ' HD2' ' HB2' ' C' ' 321' ' ' LYS . 4.2 Cg_exo -56.82 -149.14 0.0 OUTLIER 'Trans proline' 0 C--N 1.308 -1.602 0 C-N-CA 121.709 1.606 . . . . 3.4199999999999999 109.988 -179.869 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' C' C ' 323' ' ' LEU . . . . . 0.419 HD23 ' HA ' ' C' ' 323' ' ' LEU . 71.2 mt -77.82 138.76 39.14 Favored 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.0 -1.063 . . . . 3.9500000000000002 109.131 -179.875 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' C' C ' 324' ' ' ASP . . . . . . . . . . . . . 79.7 m-20 -76.89 161.68 28.22 Favored 'General case' 0 N--CA 1.488 1.468 0 O-C-N 121.235 -0.915 . . . . 1.6299999999999999 109.707 -179.477 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' C' C ' 325' ' ' GLY . . . . . . . . . . . . . . . -68.25 -177.3 12.45 Favored Glycine 0 N--CA 1.487 2.093 0 N-CA-C 109.587 -1.405 . . . . 0.72999999999999998 109.587 -179.848 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' C' C ' 326' ' ' GLU . . . . . . . . . . . . . 42.1 mm-40 -58.57 -177.27 0.03 OUTLIER 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.195 -1.179 . . . . 2.1699999999999999 109.653 -179.853 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' C' C ' 327' ' ' TYR . . . . . 0.601 ' CE2' ' HG2' ' A' ' 333' ' ' ARG . 47.7 m-85 -149.66 101.88 3.11 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.325 -0.859 . . . . 0.47999999999999998 109.258 -179.956 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' C' C ' 328' ' ' PHE . . . . . 0.56 ' CE2' ' HG3' ' A' ' 335' ' ' ARG . 71.1 m-85 -110.15 -161.34 0.75 Allowed 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.164 -0.96 . . . . 0.33000000000000002 110.075 -179.799 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' C' C ' 329' ' ' THR . . . . . 0.441 HG23 ' C ' ' C' ' 328' ' ' PHE . 33.8 p -154.95 169.76 23.31 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.482 -0.761 . . . . 0.23000000000000001 109.071 179.834 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' C' C ' 330' ' ' LEU . . . . . . . . . . . . . 16.8 tp -149.89 127.23 11.43 Favored 'General case' 0 N--CA 1.489 1.494 0 O-C-N 121.219 -0.925 . . . . 0.28000000000000003 109.851 -179.924 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' C' C ' 331' ' ' GLN . . . . . . . . . . . . . 12.5 tp60 -87.76 113.2 23.21 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.401 -0.812 . . . . 1.48 109.162 179.658 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' C' C ' 332' ' ' ILE . . . . . . . . . . . . . 32.1 mt -103.14 110.11 28.79 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.6 0 O-C-N 121.117 -0.99 . . . . 0.23999999999999999 109.782 -179.789 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' C' C ' 333' ' ' ARG . . . . . 0.417 ' HG2' ' CE1' ' A' ' 327' ' ' TYR . 18.7 mtt180 -73.08 148.13 44.32 Favored 'General case' 0 N--CA 1.488 1.435 0 O-C-N 121.368 -0.833 . . . . 2.7400000000000002 109.3 179.594 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' C' C ' 334' ' ' GLY . . . . . . . . . . . . . . . 80.07 128.6 0.73 Allowed Glycine 0 N--CA 1.489 2.221 0 N-CA-C 109.749 -1.34 . . . . 0.34999999999999998 109.749 179.945 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' C' C ' 335' ' ' ARG . . . . . 0.445 ' CG ' ' NH1' ' C' ' 335' ' ' ARG . 0.1 OUTLIER -78.38 -30.25 47.77 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.323 -1.104 . . . . 2.5299999999999998 109.478 179.919 . . . . . . . . 3 3 . 1 . 025 nuclear build full ' C' C ' 336' ' ' GLU . . . . . . . . . . . . . 24.6 mt-10 -58.26 -66.02 0.55 Allowed 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.309 -0.869 . . . . 2.6200000000000001 109.751 -179.924 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' C' C ' 337' ' ' ARG . . . . . . . . . . . . . 1.2 mtp180 -59.26 -26.92 65.33 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.211 -0.931 . . . . 2.8100000000000001 109.614 -179.805 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' C' C ' 338' ' ' PHE . . . . . 0.426 ' HB3' ' O ' ' C' ' 335' ' ' ARG . 74.3 t80 -56.03 -59.1 5.4 Favored 'General case' 0 N--CA 1.489 1.476 0 O-C-N 121.154 -0.966 . . . . 0.40000000000000002 109.808 -179.88 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' C' C ' 339' ' ' GLU . . . . . . . . . . . . . 4.2 mt-10 -50.5 -33.89 23.1 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.208 -0.932 . . . . 2.0499999999999998 110.09 -179.512 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' C' C ' 340' ' ' MET . . . . . . . . . . . . . 31.2 ttp -63.72 -51.56 64.43 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.195 -0.941 . . . . 0.32000000000000001 110.101 -179.498 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' C' C ' 341' ' ' PHE . . . . . . . . . . . . . 47.8 m-85 -61.22 -46.58 89.84 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.114 -0.991 . . . . 0.17999999999999999 110.012 -179.417 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' C' C ' 342' ' ' ARG . . . . . 0.49 ' NH1' ' HG3' ' C' ' 342' ' ' ARG . 0.0 OUTLIER -48.31 -42.52 31.3 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.246 -0.909 . . . . 2.9100000000000001 110.252 -179.508 . . . . . . . . 3 3 . 1 . 025 nuclear build full ' C' C ' 343' ' ' GLU . . . . . . . . . . . . . 44.4 tt0 -58.5 -47.37 84.31 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.165 -0.959 . . . . 2.1400000000000001 110.095 -179.459 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' C' C ' 344' ' ' LEU . . . . . 0.779 HD22 HD22 ' D' ' 344' ' ' LEU . 92.6 mt -61.14 -44.58 97.1 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.119 -0.988 . . . . 0.22 109.952 -179.58 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' C' C ' 345' ' ' ASN . . . . . 0.447 HD22 HD21 ' A' ' 330' ' ' LEU . 64.7 t-20 -56.04 -51.72 66.79 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.218 -0.927 . . . . 1.0800000000000001 110.045 -179.557 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' C' C ' 346' ' ' GLU . . . . . . . . . . . . . 7.7 tp10 -61.36 -31.95 71.84 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.059 -1.025 . . . . 2.21 109.553 -179.898 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' C' C ' 347' ' ' ALA . . . . . 1.037 ' HB1' ' HB1' ' D' ' 347' ' ' ALA . . . -59.97 -54.48 45.57 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.16 -0.962 . . . . 0.17999999999999999 109.96 179.954 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' C' C ' 348' ' ' LEU . . . . . 0.714 HD12 ' HE ' ' A' ' 337' ' ' ARG . 4.0 mm? -61.11 -40.68 94.68 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.177 -0.952 . . . . 0.32000000000000001 109.791 -179.839 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' C' C ' 349' ' ' GLU . . . . . . . . . . . . . 11.7 mm-40 -57.74 -38.83 76.01 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.277 -0.89 . . . . 2.1899999999999999 110.01 -179.469 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' C' C ' 350' ' ' LEU . . . . . 0.589 HD22 HD13 ' D' ' 350' ' ' LEU . 6.7 tt -63.18 -39.9 95.98 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.113 -0.992 . . . . 0.46000000000000002 109.612 -179.839 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' C' C ' 351' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -59.16 -50.64 73.26 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.19 -0.944 . . . . 1.3500000000000001 109.484 -179.843 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' C' C ' 352' ' ' ASP . . . . . . . . . . . . . 73.5 m-20 -55.69 -38.41 69.63 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.344 -0.847 . . . . 1.1899999999999999 109.864 179.953 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' C' C ' 353' ' ' ALA . . . . . . . . . . . . . . . -68.74 -31.98 71.42 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.33 -0.856 . . . . 0.56999999999999995 110.554 -179.328 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' C' C ' 354' ' ' GLN . . . . . . . . . . . . . 1.3 mt-30 -82.28 -16.49 49.26 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.007 -1.058 . . . . 1.47 109.991 -179.394 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' C' C ' 355' ' ' ALA . . . . . . . . . . . . . . . -74.55 -23.09 58.74 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.174 -0.954 . . . . 0.93000000000000005 109.576 179.881 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' C' C ' 356' ' ' GLY . . . . . . . . . . . . . . . -79.38 -0.07 82.22 Favored Glycine 0 N--CA 1.49 2.29 0 N-CA-C 109.899 -1.28 . . . . 1.3300000000000001 109.899 -179.748 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' C' C ' 357' ' ' LYS . . . . . 0.536 ' HA ' ' CE ' ' C' ' 357' ' ' LYS . 0.3 OUTLIER -84.99 138.39 32.49 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.187 -1.184 . . . . 4.0099999999999998 109.399 -179.951 . . . . . . . . 3 3 . 1 . 025 nuclear build full ' C' C ' 358' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -50.58 154.06 2.46 Favored Pre-proline 0 N--CA 1.491 1.589 0 O-C-N 121.336 -0.853 . . . . 5.75 109.924 -179.614 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' C' C ' 359' ' ' PRO . . . . . . . . . . . . . 1.9 Cg_endo -62.96 -81.05 0.01 OUTLIER 'Trans proline' 0 C--N 1.309 -1.542 0 C-N-CA 122.297 1.998 . . . . 4.9400000000000004 109.961 179.647 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' C' C ' 360' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.256 0 N-CA-C 109.466 -1.454 . . . . 6.5 109.466 179.927 . . . . . . . . 0 0 . 1 . 025 nuclear build full ' D' D ' 319' ' ' LYS . . . . . . . . . . . . . 10.1 mtmt . . . . . 0 N--CA 1.49 1.551 0 N-CA-C 109.271 -0.64 . . . . 7.5300000000000002 109.271 . . . . . . . . . 0 0 . 1 . 025 nuclear build full ' D' D ' 320' ' ' LYS . . . . . 0.479 ' O ' ' HD3' ' D' ' 322' ' ' PRO . 5.7 mttt 57.98 45.1 18.6 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.192 -0.942 . . . . 6.4100000000000001 109.356 -179.937 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' D' D ' 321' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -81.78 113.79 45.39 Favored Pre-proline 0 N--CA 1.491 1.618 0 O-C-N 121.474 -0.766 . . . . 6.1100000000000003 109.454 -179.949 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' D' D ' 322' ' ' PRO . . . . . 0.479 ' HD3' ' O ' ' D' ' 320' ' ' LYS . 1.9 Cg_endo -68.42 -4.77 13.57 Favored 'Trans proline' 0 C--N 1.312 -1.359 0 C-N-CA 121.899 1.732 . . . . 2.8199999999999998 110.463 -179.775 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' D' D ' 323' ' ' LEU . . . . . . . . . . . . . 17.3 mt -84.84 46.11 1.23 Allowed 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.077 -1.015 . . . . 2.8300000000000001 109.746 179.919 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' D' D ' 324' ' ' ASP . . . . . . . . . . . . . 22.0 m-20 -79.65 140.5 37.05 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.175 -0.953 . . . . 1.54 109.312 -179.979 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' D' D ' 325' ' ' GLY . . . . . . . . . . . . . . . -67.3 -179.87 13.8 Favored Glycine 0 N--CA 1.489 2.19 0 N-CA-C 109.437 -1.465 . . . . 0.58999999999999997 109.437 -179.991 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' D' D ' 326' ' ' GLU . . . . . . . . . . . . . 3.1 mm-40 -58.08 179.78 0.06 Allowed 'General case' 0 N--CA 1.489 1.478 0 O-C-N 121.214 -1.168 . . . . 2.1299999999999999 109.379 179.906 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' D' D ' 327' ' ' TYR . . . . . 0.529 ' CE1' ' HG2' ' B' ' 333' ' ' ARG . 48.7 m-85 -148.99 105.76 3.57 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.201 -0.937 . . . . 0.46999999999999997 109.676 -179.8 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' D' D ' 328' ' ' PHE . . . . . 0.43 ' O ' ' NE2' ' B' ' 331' ' ' GLN . 67.3 m-85 -112.8 -163.9 0.88 Allowed 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.281 -0.887 . . . . 0.29999999999999999 109.613 179.782 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' D' D ' 329' ' ' THR . . . . . . . . . . . . . 21.1 p -153.97 174.17 15.01 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.178 -0.951 . . . . 0.22 109.192 179.94 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' D' D ' 330' ' ' LEU . . . . . . . . . . . . . 29.1 tp -152.29 132.07 13.22 Favored 'General case' 0 N--CA 1.489 1.494 0 O-C-N 121.166 -0.959 . . . . 0.28000000000000003 109.852 -179.864 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' D' D ' 331' ' ' GLN . . . . . 0.408 ' NE2' ' O ' ' B' ' 328' ' ' PHE . 46.3 tp60 -89.31 107.98 19.37 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.355 -0.841 . . . . 0.93000000000000005 109.095 179.463 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' D' D ' 332' ' ' ILE . . . . . . . . . . . . . 33.5 mt -103.67 106.98 21.21 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.518 0 O-C-N 121.195 -0.94 . . . . 0.25 109.766 -179.855 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' D' D ' 333' ' ' ARG . . . . . 0.59 ' HG2' ' CE1' ' B' ' 327' ' ' TYR . 0.0 OUTLIER -73.58 154.35 39.84 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.37 -0.831 . . . . 2.9300000000000002 109.402 179.693 . . . . . . . . 3 3 . 1 . 025 nuclear build full ' D' D ' 334' ' ' GLY . . . . . . . . . . . . . . . 78.93 128.42 0.55 Allowed Glycine 0 N--CA 1.492 2.403 0 N-CA-C 109.94 -1.264 . . . . 0.40999999999999998 109.94 179.607 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' D' D ' 335' ' ' ARG . . . . . 0.495 ' NH1' ' HG2' ' D' ' 335' ' ' ARG . 1.6 ttt-85 -80.24 -35.19 36.44 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.371 -1.076 . . . . 3.0299999999999998 109.453 179.93 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' D' D ' 336' ' ' GLU . . . . . . . . . . . . . 2.4 tm-20 -57.19 -65.5 0.61 Allowed 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.311 -0.868 . . . . 2.2599999999999998 109.685 -179.663 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' D' D ' 337' ' ' ARG . . . . . 0.55 ' HE ' HD12 ' B' ' 348' ' ' LEU . 0.0 OUTLIER -60.19 -29.11 68.49 Favored 'General case' 0 N--CA 1.489 1.486 0 O-C-N 121.392 -0.818 . . . . 2.9199999999999999 109.543 -179.924 . . . . . . . . 3 3 . 1 . 025 nuclear build full ' D' D ' 338' ' ' PHE . . . . . . . . . . . . . 54.9 t80 -54.84 -60.04 3.9 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.246 -0.909 . . . . 0.37 109.554 179.883 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' D' D ' 339' ' ' GLU . . . . . . . . . . . . . 60.7 mm-40 -51.63 -29.59 18.27 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.287 -0.883 . . . . 1.99 109.838 -179.813 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' D' D ' 340' ' ' MET . . . . . 0.424 ' HB3' ' O ' ' D' ' 337' ' ' ARG . 6.6 ttp -64.6 -50.61 66.52 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.15 -0.969 . . . . 0.31 109.58 -179.818 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' D' D ' 341' ' ' PHE . . . . . . . . . . . . . 46.5 m-85 -62.8 -46.26 88.78 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.347 -0.846 . . . . 0.17999999999999999 109.954 -179.735 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' D' D ' 342' ' ' ARG . . . . . . . . . . . . . 5.5 ttm180 -49.09 -41.38 35.35 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.262 -0.899 . . . . 2.4100000000000001 109.922 -179.429 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' D' D ' 343' ' ' GLU . . . . . . . . . . . . . 1.4 tt0 -58.66 -44.02 90.01 Favored 'General case' 0 N--CA 1.489 1.5 0 O-C-N 121.215 -0.928 . . . . 2.3500000000000001 109.543 -179.621 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' D' D ' 344' ' ' LEU . . . . . 0.779 HD22 HD22 ' C' ' 344' ' ' LEU . 40.1 mt -62.92 -46.22 88.81 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.346 -0.846 . . . . 0.19 110.025 -179.743 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' D' D ' 345' ' ' ASN . . . . . . . . . . . . . 41.6 t-20 -55.59 -46.56 77.25 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.159 -0.963 . . . . 1.0900000000000001 109.837 -179.519 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' D' D ' 346' ' ' GLU . . . . . . . . . . . . . 1.4 tp10 -60.67 -36.75 79.5 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.152 -0.967 . . . . 1.6899999999999999 109.774 -179.806 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' D' D ' 347' ' ' ALA . . . . . 1.037 ' HB1' ' HB1' ' C' ' 347' ' ' ALA . . . -59.05 -50.95 72.14 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.091 -1.006 . . . . 0.17999999999999999 110.025 -179.737 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' D' D ' 348' ' ' LEU . . . . . 0.604 HD22 ' N ' ' D' ' 348' ' ' LEU . 4.0 mm? -61.89 -43.84 98.02 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.129 -0.982 . . . . 0.31 109.829 -179.791 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' D' D ' 349' ' ' GLU . . . . . . . . . . . . . 2.3 mm-40 -59.05 -34.47 71.97 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.318 -0.864 . . . . 1.95 110.085 -179.531 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' D' D ' 350' ' ' LEU . . . . . 0.589 HD13 HD22 ' C' ' 350' ' ' LEU . 6.2 tt -62.83 -43.8 97.84 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.135 -0.978 . . . . 0.42999999999999999 109.518 -179.87 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' D' D ' 351' ' ' LYS . . . . . . . . . . . . . 27.2 tttm -56.98 -42.7 80.69 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.352 -0.842 . . . . 1.3999999999999999 109.728 -179.676 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' D' D ' 352' ' ' ASP . . . . . . . . . . . . . 33.7 m-20 -58.55 -50.36 74.07 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.118 -0.989 . . . . 1.1699999999999999 109.613 -179.969 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' D' D ' 353' ' ' ALA . . . . . . . . . . . . . . . -66.93 -11.01 55.03 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.28 -0.888 . . . . 0.58999999999999997 109.634 -179.794 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' D' D ' 354' ' ' GLN . . . . . . . . . . . . . 9.1 tt0 -84.16 -58.92 2.57 Favored 'General case' 0 C--N 1.3 -1.552 0 O-C-N 121.281 -0.887 . . . . 1.4399999999999999 109.775 -179.774 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' D' D ' 355' ' ' ALA . . . . . . . . . . . . . . . -70.0 -4.07 19.16 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.373 -0.83 . . . . 0.97999999999999998 110.14 -179.264 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' D' D ' 356' ' ' GLY . . . . . . . . . . . . . . . -79.75 -10.78 85.38 Favored Glycine 0 N--CA 1.491 2.308 0 N-CA-C 109.369 -1.492 . . . . 1.28 109.369 179.908 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' D' D ' 357' ' ' LYS . . . . . . . . . . . . . 56.5 mttt -88.89 171.43 9.91 Favored 'General case' 0 N--CA 1.488 1.456 0 O-C-N 121.264 -1.139 . . . . 4.0899999999999999 109.51 179.805 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' D' D ' 358' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -48.46 151.15 2.05 Favored Pre-proline 0 N--CA 1.49 1.53 0 O-C-N 121.099 -1.001 . . . . 5.71 109.275 179.885 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' D' D ' 359' ' ' PRO . . . . . . . . . . . . . 4.8 Cg_exo -59.43 -159.48 0.02 OUTLIER 'Trans proline' 0 C--N 1.308 -1.573 0 C-N-CA 122.185 1.923 . . . . 4.9699999999999998 110.156 -179.985 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' D' D ' 360' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.218 0 CA-C-O 118.025 -1.431 . . . . 6.9699999999999998 109.592 -179.99 . . . . . . . . 0 0 . 1 . 026 nuclear build full ' A' A ' 319' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.49 1.557 0 N-CA-C 109.673 -0.491 . . . . 7.5499999999999998 109.673 . . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 320' ' ' LYS . . . . . . . . . . . . . 8.7 ttmm 59.56 84.91 0.11 Allowed 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.132 -0.98 . . . . 6.4299999999999997 109.306 -179.826 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 321' ' ' LYS . . . . . 0.509 ' N ' ' HD3' ' A' ' 322' ' ' PRO . 0.0 OUTLIER -159.08 60.8 1.7 Allowed Pre-proline 0 N--CA 1.491 1.58 0 O-C-N 121.172 -0.955 . . . . 6.1299999999999999 109.747 -179.86 . . . . . . . . 3 3 . 1 . 026 nuclear build full ' A' A ' 322' ' ' PRO . . . . . 0.509 ' HD3' ' N ' ' A' ' 321' ' ' LYS . 2.6 Cg_endo -61.75 116.35 3.38 Favored 'Trans proline' 0 C--N 1.309 -1.545 0 C-N-CA 122.093 1.862 . . . . 2.8300000000000001 110.188 179.729 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 323' ' ' LEU . . . . . . . . . . . . . 20.0 mt -81.45 118.01 22.35 Favored 'General case' 0 N--CA 1.489 1.501 0 O-C-N 121.234 -0.916 . . . . 2.8300000000000001 109.399 179.936 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 324' ' ' ASP . . . . . 0.452 ' HB2' ' OH ' ' A' ' 327' ' ' TYR . 16.8 m-20 -79.46 179.71 7.3 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.198 -0.939 . . . . 1.53 109.574 -179.765 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 325' ' ' GLY . . . . . . . . . . . . . . . -69.18 -149.31 0.29 Allowed Glycine 0 N--CA 1.492 2.39 0 N-CA-C 109.86 -1.296 . . . . 0.60999999999999999 109.86 -179.764 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 326' ' ' GLU . . . . . . . . . . . . . 32.4 mp0 -58.45 -168.41 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.336 -1.097 . . . . 2.1299999999999999 109.611 -179.935 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 327' ' ' TYR . . . . . 0.584 ' CE1' ' HG2' ' C' ' 333' ' ' ARG . 41.5 m-85 -148.78 112.6 5.11 Favored 'General case' 0 N--CA 1.489 1.5 0 O-C-N 121.373 -0.829 . . . . 0.47999999999999998 109.555 180.0 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 328' ' ' PHE . . . . . . . . . . . . . 98.0 m-85 -113.88 -169.43 1.51 Allowed 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.258 -0.901 . . . . 0.31 109.369 179.804 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 329' ' ' THR . . . . . . . . . . . . . 20.8 p -153.29 168.95 24.32 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.302 -0.874 . . . . 0.22 109.665 -179.761 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 330' ' ' LEU . . . . . . . . . . . . . 41.7 tp -152.19 129.11 10.98 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.29 -0.881 . . . . 0.28000000000000003 109.591 -179.856 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 331' ' ' GLN . . . . . . . . . . . . . 1.4 tt0 -87.13 114.61 23.89 Favored 'General case' 0 N--CA 1.488 1.429 0 O-C-N 121.403 -0.81 . . . . 0.91000000000000003 109.14 179.537 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 332' ' ' ILE . . . . . 0.653 HG21 ' HA ' ' A' ' 338' ' ' PHE . 45.8 mt -103.32 104.3 16.44 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.54 0 O-C-N 121.095 -1.003 . . . . 0.26000000000000001 109.487 -179.933 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 333' ' ' ARG . . . . . 0.482 ' HG2' ' CE2' ' C' ' 327' ' ' TYR . 49.4 mtt180 -72.82 143.58 47.82 Favored 'General case' 0 N--CA 1.488 1.433 0 O-C-N 121.306 -0.871 . . . . 2.9199999999999999 109.108 179.822 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 334' ' ' GLY . . . . . . . . . . . . . . . 89.2 125.72 2.7 Favored Glycine 0 N--CA 1.491 2.342 0 N-CA-C 109.423 -1.471 . . . . 0.40000000000000002 109.423 -179.93 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 335' ' ' ARG . . . . . . . . . . . . . 15.1 ttt180 -76.41 -40.39 50.97 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.202 -1.175 . . . . 3.0099999999999998 109.742 -179.897 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 336' ' ' GLU . . . . . . . . . . . . . 20.0 tt0 -58.09 -58.76 7.03 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.42 -0.8 . . . . 2.29 109.928 -179.746 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 337' ' ' ARG . . . . . 0.433 ' CG ' ' NH1' ' A' ' 337' ' ' ARG . 0.0 OUTLIER -61.18 -32.51 72.25 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.229 -0.919 . . . . 2.9300000000000002 109.509 -179.833 . . . . . . . . 3 3 . 1 . 026 nuclear build full ' A' A ' 338' ' ' PHE . . . . . 0.653 ' HA ' HG21 ' A' ' 332' ' ' ILE . 53.0 t80 -55.75 -53.88 51.25 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.303 -0.873 . . . . 0.38 109.392 179.908 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 339' ' ' GLU . . . . . . . . . . . . . 43.1 mt-10 -50.8 -32.49 20.18 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.247 -0.908 . . . . 1.97 109.861 -179.644 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 340' ' ' MET . . . . . . . . . . . . . 19.6 ttp -63.1 -51.64 65.77 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.088 -1.007 . . . . 0.31 109.79 -179.551 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 341' ' ' PHE . . . . . . . . . . . . . 37.3 m-85 -62.06 -41.47 98.19 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.133 -0.98 . . . . 0.17999999999999999 109.816 -179.829 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 342' ' ' ARG . . . . . . . . . . . . . 6.1 tpt180 -49.1 -43.46 41.32 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.261 -0.899 . . . . 2.4199999999999999 110.105 -179.497 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 343' ' ' GLU . . . . . . . . . . . . . 1.3 tt0 -59.95 -46.02 90.75 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.202 -0.936 . . . . 2.3500000000000001 109.639 -179.757 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 344' ' ' LEU . . . . . . . . . . . . . 57.6 mt -62.04 -30.28 70.87 Favored 'General case' 0 N--CA 1.488 1.467 0 O-C-N 121.315 -0.866 . . . . 0.17999999999999999 109.372 -179.954 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 345' ' ' ASN . . . . . . . . . . . . . 12.4 t-20 -59.24 -58.09 10.14 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.346 -0.846 . . . . 1.0900000000000001 109.965 -179.725 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 346' ' ' GLU . . . . . . . . . . . . . 15.8 tt0 -61.74 -28.15 69.23 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.212 -0.93 . . . . 1.6499999999999999 109.731 -179.555 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 347' ' ' ALA . . . . . 0.704 ' HB1' ' HB1' ' B' ' 347' ' ' ALA . . . -60.9 -61.71 2.38 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.099 -1.001 . . . . 0.17999999999999999 110.011 -179.607 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 348' ' ' LEU . . . . . 0.603 HD22 ' N ' ' A' ' 348' ' ' LEU . 3.8 mm? -61.52 -45.65 93.3 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.278 -0.889 . . . . 0.29999999999999999 110.21 -179.396 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 349' ' ' GLU . . . . . 0.433 ' OE2' ' HD2' ' C' ' 333' ' ' ARG . 3.5 mt-10 -57.69 -32.93 67.84 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.226 -0.921 . . . . 1.9399999999999999 110.072 -179.339 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 350' ' ' LEU . . . . . 0.69 HD22 HD22 ' B' ' 350' ' ' LEU . 7.8 tt -65.75 -43.99 87.24 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.032 -1.043 . . . . 0.46000000000000002 109.391 -179.91 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 351' ' ' LYS . . . . . . . . . . . . . 13.3 tttt -59.07 -50.95 72.11 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.381 -0.824 . . . . 1.3999999999999999 109.352 -179.937 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 352' ' ' ASP . . . . . . . . . . . . . 2.3 m-20 -56.24 -31.23 63.36 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.205 -0.934 . . . . 1.1599999999999999 109.82 -179.922 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 353' ' ' ALA . . . . . . . . . . . . . . . -67.25 -33.25 74.93 Favored 'General case' 0 N--CA 1.495 1.776 0 O-C-N 121.13 -0.981 . . . . 0.63 110.072 -179.731 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 354' ' ' GLN . . . . . . . . . . . . . 63.6 mt-30 -83.11 -10.12 58.84 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.128 -0.983 . . . . 1.47 109.576 -179.696 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 355' ' ' ALA . . . . . . . . . . . . . . . -73.49 -3.3 26.8 Favored 'General case' 0 N--CA 1.493 1.717 0 O-C-N 121.312 -0.867 . . . . 1.01 110.135 -179.901 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 356' ' ' GLY . . . . . . . . . . . . . . . -79.72 -33.38 34.24 Favored Glycine 0 N--CA 1.489 2.22 0 N-CA-C 109.769 -1.332 . . . . 1.3 109.769 -179.528 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 357' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -87.1 149.94 24.34 Favored 'General case' 0 N--CA 1.489 1.494 0 O-C-N 121.315 -1.109 . . . . 4.0999999999999996 109.633 -179.912 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 358' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -49.15 117.38 6.52 Favored Pre-proline 0 N--CA 1.492 1.664 0 O-C-N 121.157 -0.964 . . . . 5.75 109.453 -179.975 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 359' ' ' PRO . . . . . . . . . . . . . 4.4 Cg_exo -59.29 131.19 39.62 Favored 'Trans proline' 0 C--N 1.313 -1.303 0 C-N-CA 121.866 1.711 . . . . 5.0 110.307 -179.826 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 360' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.255 0 CA-C-O 117.973 -1.459 . . . . 6.9699999999999998 109.499 -179.902 . . . . . . . . 0 0 . 1 . 026 nuclear build full ' B' B ' 319' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.49 1.551 0 CA-C-O 121.195 0.521 . . . . 7.5499999999999998 109.798 . . . . . . . . . 1 1 . 1 . 026 nuclear build full ' B' B ' 320' ' ' LYS . . . . . . . . . . . . . 8.9 ttmm 59.38 84.5 0.11 Allowed 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.17 -0.956 . . . . 6.4400000000000004 109.448 -179.852 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' B' B ' 321' ' ' LYS . . . . . 0.531 ' N ' ' HD3' ' B' ' 322' ' ' PRO . 0.0 OUTLIER -158.39 59.41 1.55 Allowed Pre-proline 0 N--CA 1.492 1.649 0 O-C-N 121.153 -0.967 . . . . 6.1299999999999999 109.959 -179.689 . . . . . . . . 3 3 . 1 . 026 nuclear build full ' B' B ' 322' ' ' PRO . . . . . 0.531 ' HD3' ' N ' ' B' ' 321' ' ' LYS . 2.6 Cg_endo -61.28 116.11 3.17 Favored 'Trans proline' 0 C--N 1.309 -1.508 0 C-N-CA 122.169 1.913 . . . . 2.8199999999999998 110.166 179.752 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' B' B ' 323' ' ' LEU . . . . . . . . . . . . . 18.6 mt -80.91 118.62 22.56 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.261 -0.9 . . . . 2.8399999999999999 109.359 179.952 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' B' B ' 324' ' ' ASP . . . . . 0.417 ' HB2' ' OH ' ' B' ' 327' ' ' TYR . 17.2 m-20 -79.64 179.36 7.55 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.203 -0.936 . . . . 1.53 109.494 179.992 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' B' B ' 325' ' ' GLY . . . . . . . . . . . . . . . -68.88 -148.97 0.24 Allowed Glycine 0 N--CA 1.491 2.312 0 N-CA-C 109.908 -1.277 . . . . 0.58999999999999997 109.908 -179.768 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' B' B ' 326' ' ' GLU . . . . . . . . . . . . . 34.5 mp0 -58.77 -168.18 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.29 -1.123 . . . . 2.1299999999999999 109.768 -179.724 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' B' B ' 327' ' ' TYR . . . . . 0.417 ' OH ' ' HB2' ' B' ' 324' ' ' ASP . 41.8 m-85 -149.37 112.2 4.83 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.354 -0.841 . . . . 0.47999999999999998 109.898 -179.994 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' B' B ' 328' ' ' PHE . . . . . 0.451 ' CE2' ' HA ' ' D' ' 335' ' ' ARG . 97.3 m-85 -113.52 -169.51 1.51 Allowed 'General case' 0 N--CA 1.487 1.411 0 O-C-N 121.342 -0.849 . . . . 0.32000000000000001 109.503 179.942 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' B' B ' 329' ' ' THR . . . . . . . . . . . . . 18.0 p -152.94 169.27 23.28 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.182 -0.948 . . . . 0.23000000000000001 109.792 -179.661 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' B' B ' 330' ' ' LEU . . . . . . . . . . . . . 39.6 tp -152.4 129.31 10.99 Favored 'General case' 0 N--CA 1.489 1.478 0 O-C-N 121.365 -0.835 . . . . 0.28000000000000003 109.668 179.998 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' B' B ' 331' ' ' GLN . . . . . . . . . . . . . 1.3 tt0 -87.01 115.27 24.28 Favored 'General case' 0 N--CA 1.488 1.475 0 O-C-N 121.36 -0.837 . . . . 0.91000000000000003 109.115 179.504 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' B' B ' 332' ' ' ILE . . . . . 0.668 HG21 ' HA ' ' B' ' 338' ' ' PHE . 42.6 mt -103.48 103.59 15.38 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.599 0 O-C-N 120.945 -1.097 . . . . 0.23999999999999999 109.7 179.964 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' B' B ' 333' ' ' ARG . . . . . . . . . . . . . 50.3 mtt180 -72.4 142.75 48.7 Favored 'General case' 0 C--N 1.302 -1.463 0 O-C-N 121.085 -1.01 . . . . 2.9300000000000002 109.261 179.759 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' B' B ' 334' ' ' GLY . . . . . . . . . . . . . . . 89.79 125.6 2.86 Favored Glycine 0 N--CA 1.49 2.29 0 N-CA-C 109.583 -1.407 . . . . 0.40000000000000002 109.583 -179.821 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' B' B ' 335' ' ' ARG . . . . . . . . . . . . . 16.6 ttt180 -76.45 -40.37 50.69 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.151 -1.206 . . . . 3.0099999999999998 109.72 -179.928 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' B' B ' 336' ' ' GLU . . . . . . . . . . . . . 24.1 tt0 -58.23 -59.31 5.51 Favored 'General case' 0 N--CA 1.489 1.49 0 O-C-N 121.083 -1.011 . . . . 2.2799999999999998 109.69 -179.577 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' B' B ' 337' ' ' ARG . . . . . 0.455 HH11 ' CG ' ' B' ' 337' ' ' ARG . 0.0 OUTLIER -60.26 -32.42 71.14 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.12 -0.987 . . . . 2.9300000000000002 109.766 -179.795 . . . . . . . . 3 3 . 1 . 026 nuclear build full ' B' B ' 338' ' ' PHE . . . . . 0.668 ' HA ' HG21 ' B' ' 332' ' ' ILE . 52.4 t80 -55.93 -52.94 62.36 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.226 -0.921 . . . . 0.37 109.625 -179.895 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' B' B ' 339' ' ' GLU . . . . . . . . . . . . . 35.3 mt-10 -51.12 -33.03 24.71 Favored 'General case' 0 N--CA 1.488 1.461 0 O-C-N 121.35 -0.844 . . . . 1.98 109.848 -179.574 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' B' B ' 340' ' ' MET . . . . . . . . . . . . . 20.0 ttp -62.83 -51.36 67.32 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.115 -0.99 . . . . 0.32000000000000001 109.924 -179.512 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' B' B ' 341' ' ' PHE . . . . . . . . . . . . . 35.6 m-85 -62.41 -41.72 98.9 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.128 -0.982 . . . . 0.17999999999999999 109.796 -179.834 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' B' B ' 342' ' ' ARG . . . . . . . . . . . . . 5.7 tpt180 -48.88 -44.32 39.82 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.383 -0.823 . . . . 2.4199999999999999 109.68 -179.806 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' B' B ' 343' ' ' GLU . . . . . . . . . . . . . 1.3 tt0 -58.44 -47.42 84.04 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.085 -1.009 . . . . 2.3500000000000001 109.705 -179.85 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' B' B ' 344' ' ' LEU . . . . . . . . . . . . . 51.6 mt -61.01 -30.52 70.35 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.158 -0.964 . . . . 0.17999999999999999 109.684 -179.831 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' B' B ' 345' ' ' ASN . . . . . . . . . . . . . 12.1 t-20 -58.91 -58.33 9.12 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.314 -0.866 . . . . 1.0900000000000001 110.132 -179.837 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' B' B ' 346' ' ' GLU . . . . . . . . . . . . . 17.7 tt0 -61.65 -28.44 69.38 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.112 -0.993 . . . . 1.6599999999999999 109.568 -179.464 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' B' B ' 347' ' ' ALA . . . . . 0.704 ' HB1' ' HB1' ' A' ' 347' ' ' ALA . . . -60.59 -61.14 2.81 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.248 -0.908 . . . . 0.17000000000000001 110.199 -179.778 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' B' B ' 348' ' ' LEU . . . . . 0.599 HD22 ' N ' ' B' ' 348' ' ' LEU . 3.8 mm? -62.36 -46.05 90.44 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.307 -0.871 . . . . 0.28999999999999998 110.023 -179.279 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' B' B ' 349' ' ' GLU . . . . . . . . . . . . . 3.9 mt-10 -57.09 -33.2 67.07 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.025 -1.047 . . . . 1.95 110.099 -179.48 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' B' B ' 350' ' ' LEU . . . . . 0.69 HD22 HD22 ' A' ' 350' ' ' LEU . 7.8 tt -65.41 -44.3 87.87 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.159 -0.963 . . . . 0.45000000000000001 109.442 -179.923 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' B' B ' 351' ' ' LYS . . . . . . . . . . . . . 15.0 tttt -58.74 -50.65 73.12 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.233 -0.917 . . . . 1.3799999999999999 109.454 -179.984 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' B' B ' 352' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 -56.35 -31.92 64.23 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.224 -0.922 . . . . 1.1599999999999999 109.841 -179.85 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' B' B ' 353' ' ' ALA . . . . . . . . . . . . . . . -66.82 -33.0 74.65 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.194 -0.941 . . . . 0.60999999999999999 109.896 -179.661 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' B' B ' 354' ' ' GLN . . . . . . . . . . . . . 63.4 mt-30 -82.89 -9.9 59.09 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.107 -0.995 . . . . 1.45 109.515 -179.914 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' B' B ' 355' ' ' ALA . . . . . . . . . . . . . . . -73.93 -3.22 27.65 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.11 -0.994 . . . . 0.97999999999999998 110.217 -179.722 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' B' B ' 356' ' ' GLY . . . . . . . . . . . . . . . -80.37 -32.03 35.91 Favored Glycine 0 N--CA 1.491 2.336 0 N-CA-C 109.803 -1.319 . . . . 1.29 109.803 -179.742 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' B' B ' 357' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -87.74 149.37 24.25 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.104 -1.233 . . . . 4.0899999999999999 109.402 179.866 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' B' B ' 358' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -49.01 116.88 5.87 Favored Pre-proline 0 N--CA 1.488 1.448 0 O-C-N 121.363 -0.836 . . . . 5.7199999999999998 109.333 179.903 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' B' B ' 359' ' ' PRO . . . . . . . . . . . . . 4.3 Cg_exo -59.44 132.14 44.57 Favored 'Trans proline' 0 C--N 1.31 -1.449 0 C-N-CA 122.052 1.834 . . . . 4.9800000000000004 110.321 -179.9 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' B' B ' 360' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.494 2.529 0 N-CA-C 109.408 -1.477 . . . . 6.9800000000000004 109.408 -179.847 . . . . . . . . 0 0 . 1 . 026 nuclear build full ' C' C ' 319' ' ' LYS . . . . . 0.477 ' O ' ' O ' ' C' ' 320' ' ' LYS . 0.0 OUTLIER . . . . . 0 N--CA 1.488 1.44 0 N-CA-C 109.49 -0.559 . . . . 6.8200000000000003 109.49 . . . . . . . . . 2 2 . 1 . 026 nuclear build full ' C' C ' 320' ' ' LYS . . . . . 0.477 ' O ' ' O ' ' C' ' 319' ' ' LYS . 1.4 tttp 56.21 162.33 0.02 OUTLIER 'General case' 0 N--CA 1.489 1.477 0 O-C-N 121.26 -0.9 . . . . 6.4900000000000002 109.378 179.996 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' C' C ' 321' ' ' LYS . . . . . . . . . . . . . 1.8 mptt -159.73 83.71 2.26 Favored Pre-proline 0 N--CA 1.489 1.503 0 O-C-N 121.275 -0.891 . . . . 6.4000000000000004 109.556 179.898 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' C' C ' 322' ' ' PRO . . . . . . . . . . . . . 6.1 Cg_endo -71.39 16.11 0.32 Allowed 'Trans proline' 0 C--N 1.309 -1.541 0 C-N-CA 122.727 2.285 . . . . 3.4199999999999999 111.943 -179.83 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' C' C ' 323' ' ' LEU . . . . . . . . . . . . . 15.8 mt -80.24 86.94 5.58 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 120.597 -1.314 . . . . 3.9500000000000002 109.601 -179.857 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' C' C ' 324' ' ' ASP . . . . . 0.533 ' CB ' ' OH ' ' C' ' 327' ' ' TYR . 0.9 OUTLIER -86.57 148.15 25.62 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.17 -0.956 . . . . 1.6299999999999999 110.165 -179.94 . . . . . . . . 3 3 . 1 . 026 nuclear build full ' C' C ' 325' ' ' GLY . . . . . . . . . . . . . . . -71.25 -158.53 3.05 Favored Glycine 0 N--CA 1.49 2.278 0 N-CA-C 109.395 -1.482 . . . . 0.72999999999999998 109.395 179.415 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' C' C ' 326' ' ' GLU . . . . . 0.408 ' O ' ' CD1' ' C' ' 327' ' ' TYR . 3.5 mt-10 -59.49 -166.86 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.193 -1.181 . . . . 2.1699999999999999 109.382 179.695 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' C' C ' 327' ' ' TYR . . . . . 0.533 ' OH ' ' CB ' ' C' ' 324' ' ' ASP . 33.7 m-85 -149.33 112.09 4.81 Favored 'General case' 0 N--CA 1.488 1.45 0 O-C-N 121.375 -0.828 . . . . 0.47999999999999998 110.458 179.721 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' C' C ' 328' ' ' PHE . . . . . 0.448 ' O ' HG23 ' C' ' 329' ' ' THR . 68.9 m-85 -112.96 -166.36 1.07 Allowed 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.423 -0.798 . . . . 0.33000000000000002 108.975 179.458 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' C' C ' 329' ' ' THR . . . . . 0.448 HG23 ' O ' ' C' ' 328' ' ' PHE . 4.4 p -154.28 166.01 34.5 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.259 -0.901 . . . . 0.23000000000000001 109.492 -179.944 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' C' C ' 330' ' ' LEU . . . . . . . . . . . . . 42.0 tp -150.07 129.42 12.9 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.24 -0.912 . . . . 0.28000000000000003 109.762 -179.692 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' C' C ' 331' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -87.59 116.48 25.74 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.278 -0.889 . . . . 1.48 109.095 179.683 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' C' C ' 332' ' ' ILE . . . . . 0.635 HG21 ' HA ' ' C' ' 338' ' ' PHE . 76.1 mt -104.14 110.71 31.16 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.559 0 O-C-N 121.195 -0.941 . . . . 0.23999999999999999 109.828 -179.748 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' C' C ' 333' ' ' ARG . . . . . 0.584 ' HG2' ' CE1' ' A' ' 327' ' ' TYR . 58.2 mtt180 -73.89 143.01 45.98 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.238 -0.914 . . . . 2.7400000000000002 109.368 179.64 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' C' C ' 334' ' ' GLY . . . . . . . . . . . . . . . 80.92 133.71 1.38 Allowed Glycine 0 N--CA 1.491 2.341 0 N-CA-C 109.884 -1.286 . . . . 0.34999999999999998 109.884 179.845 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' C' C ' 335' ' ' ARG . . . . . . . . . . . . . 3.8 ttt180 -77.69 -35.35 52.27 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.271 -1.135 . . . . 2.5299999999999998 109.402 179.81 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' C' C ' 336' ' ' GLU . . . . . . . . . . . . . 2.0 mp0 -56.93 -57.38 12.78 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.239 -0.913 . . . . 2.6200000000000001 109.763 -179.85 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' C' C ' 337' ' ' ARG . . . . . 0.441 HH11 ' HG3' ' C' ' 337' ' ' ARG . 0.3 OUTLIER -59.44 -34.52 72.62 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.158 -0.964 . . . . 2.8100000000000001 109.683 -179.746 . . . . . . . . 3 3 . 1 . 026 nuclear build full ' C' C ' 338' ' ' PHE . . . . . 0.635 ' HA ' HG21 ' C' ' 332' ' ' ILE . 61.2 t80 -54.87 -55.65 28.07 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.415 -0.803 . . . . 0.40000000000000002 109.747 -179.841 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' C' C ' 339' ' ' GLU . . . . . . . . . . . . . 11.4 mm-40 -50.92 -35.85 35.4 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.319 -0.863 . . . . 2.0499999999999998 110.367 -179.592 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' C' C ' 340' ' ' MET . . . . . . . . . . . . . 34.6 ttp -63.33 -48.66 77.11 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.112 -0.993 . . . . 0.32000000000000001 110.054 -179.343 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' C' C ' 341' ' ' PHE . . . . . . . . . . . . . 30.9 m-85 -63.23 -46.32 87.5 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.187 -0.946 . . . . 0.17999999999999999 110.251 -179.351 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' C' C ' 342' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -48.89 -39.96 27.95 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.015 -1.053 . . . . 2.9100000000000001 109.799 -179.663 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' C' C ' 343' ' ' GLU . . . . . . . . . . . . . 31.3 tt0 -58.41 -52.82 63.99 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.08 -1.013 . . . . 2.1400000000000001 109.507 179.913 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' C' C ' 344' ' ' LEU . . . . . . . . . . . . . 86.4 mt -62.02 -25.02 67.41 Favored 'General case' 0 N--CA 1.488 1.454 0 O-C-N 121.344 -0.848 . . . . 0.22 109.23 -179.943 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' C' C ' 345' ' ' ASN . . . . . . . . . . . . . 6.9 t-20 -60.31 -61.43 2.61 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.322 -0.861 . . . . 1.0800000000000001 109.341 -179.942 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' C' C ' 346' ' ' GLU . . . . . . . . . . . . . 34.5 tt0 -61.29 -23.2 65.53 Favored 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.316 -0.865 . . . . 2.21 109.487 -179.931 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' C' C ' 347' ' ' ALA . . . . . 0.418 ' HB1' ' HB1' ' D' ' 347' ' ' ALA . . . -63.2 -62.8 1.45 Allowed 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.308 -0.87 . . . . 0.17999999999999999 109.776 -179.941 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' C' C ' 348' ' ' LEU . . . . . 0.523 ' HA ' HD13 ' C' ' 348' ' ' LEU . 3.5 mm? -61.6 -40.77 95.99 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.333 -0.854 . . . . 0.32000000000000001 109.712 -179.676 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' C' C ' 349' ' ' GLU . . . . . 0.441 ' HA ' ' OE1' ' C' ' 349' ' ' GLU . 7.8 mm-40 -57.28 -38.66 74.26 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 120.994 -1.066 . . . . 2.1899999999999999 109.52 -179.825 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' C' C ' 350' ' ' LEU . . . . . 0.518 HD22 HD22 ' D' ' 350' ' ' LEU . 9.5 tt -63.74 -44.02 94.75 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.429 -0.794 . . . . 0.46000000000000002 109.07 179.853 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' C' C ' 351' ' ' LYS . . . . . . . . . . . . . 2.6 tttt -59.46 -39.4 83.52 Favored 'General case' 0 C--N 1.301 -1.532 0 O-C-N 121.504 -0.748 . . . . 1.3500000000000001 109.431 179.981 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' C' C ' 352' ' ' ASP . . . . . . . . . . . . . 24.6 m-20 -58.44 -39.9 81.1 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.316 -0.865 . . . . 1.1899999999999999 109.561 -179.781 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' C' C ' 353' ' ' ALA . . . . . . . . . . . . . . . -67.27 -22.27 65.67 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.276 -0.89 . . . . 0.56999999999999995 109.795 -179.657 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' C' C ' 354' ' ' GLN . . . . . . . . . . . . . 3.4 tt0 -80.85 -11.65 59.56 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.093 -1.004 . . . . 1.47 109.315 -179.977 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' C' C ' 355' ' ' ALA . . . . . . . . . . . . . . . -72.3 -3.04 21.45 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.234 -0.916 . . . . 0.93000000000000005 109.454 179.464 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' C' C ' 356' ' ' GLY . . . . . . . . . . . . . . . -71.68 -81.42 0.31 Allowed Glycine 0 N--CA 1.489 2.215 0 N-CA-C 110.057 -1.217 . . . . 1.3300000000000001 110.057 -179.527 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' C' C ' 357' ' ' LYS . . . . . . . . . . . . . 5.8 mttp -83.99 -173.94 5.0 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.293 -1.122 . . . . 4.0099999999999998 109.503 -179.746 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' C' C ' 358' ' ' GLU . . . . . . . . . . . . . 12.5 pt-20 -48.74 146.91 4.83 Favored Pre-proline 0 N--CA 1.489 1.508 0 O-C-N 121.358 -0.839 . . . . 5.75 109.529 -179.725 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' C' C ' 359' ' ' PRO . . . . . . . . . . . . . 1.8 Cg_endo -62.5 85.05 0.11 Allowed 'Trans proline' 0 C--N 1.311 -1.4 0 C-N-CA 122.132 1.888 . . . . 4.9400000000000004 110.395 -179.909 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' C' C ' 360' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.343 0 N-CA-C 109.463 -1.455 . . . . 6.5 109.463 179.86 . . . . . . . . 0 0 . 1 . 026 nuclear build full ' D' D ' 319' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.49 1.534 0 CA-C-O 121.326 0.584 . . . . 7.5300000000000002 109.774 . . . . . . . . . 1 1 . 1 . 026 nuclear build full ' D' D ' 320' ' ' LYS . . . . . . . . . . . . . 9.3 ttmm 59.89 84.92 0.11 Allowed 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.284 -0.885 . . . . 6.4100000000000001 109.494 -179.928 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' D' D ' 321' ' ' LYS . . . . . 0.54 ' N ' ' HD3' ' D' ' 322' ' ' PRO . 0.0 OUTLIER -158.51 58.46 1.33 Allowed Pre-proline 0 N--CA 1.491 1.602 0 O-C-N 121.113 -0.992 . . . . 6.1100000000000003 109.882 -179.742 . . . . . . . . 3 3 . 1 . 026 nuclear build full ' D' D ' 322' ' ' PRO . . . . . 0.54 ' HD3' ' N ' ' D' ' 321' ' ' LYS . 3.0 Cg_exo -60.68 115.91 3.0 Favored 'Trans proline' 0 C--N 1.309 -1.528 0 C-N-CA 122.182 1.921 . . . . 2.8199999999999998 110.112 179.857 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' D' D ' 323' ' ' LEU . . . . . . . . . . . . . 16.3 mt -81.46 117.74 22.14 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.24 -0.912 . . . . 2.8300000000000001 109.689 -179.748 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' D' D ' 324' ' ' ASP . . . . . 0.408 ' HB2' ' OH ' ' D' ' 327' ' ' TYR . 14.9 m-20 -78.36 179.74 6.8 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.381 -0.824 . . . . 1.54 109.69 179.977 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' D' D ' 325' ' ' GLY . . . . . . . . . . . . . . . -68.85 -149.54 0.27 Allowed Glycine 0 N--CA 1.49 2.266 0 N-CA-C 109.957 -1.257 . . . . 0.58999999999999997 109.957 -179.823 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' D' D ' 326' ' ' GLU . . . . . . . . . . . . . 33.9 mp0 -58.65 -168.1 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.478 0 O-C-N 121.379 -1.071 . . . . 2.1299999999999999 109.642 -179.923 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' D' D ' 327' ' ' TYR . . . . . 0.408 ' OH ' ' HB2' ' D' ' 324' ' ' ASP . 41.6 m-85 -149.62 112.21 4.76 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.321 -0.862 . . . . 0.46999999999999997 109.784 -179.866 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' D' D ' 328' ' ' PHE . . . . . . . . . . . . . 98.7 m-85 -113.1 -169.41 1.48 Allowed 'General case' 0 C--N 1.302 -1.498 0 O-C-N 121.315 -0.866 . . . . 0.29999999999999999 109.381 -179.969 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' D' D ' 329' ' ' THR . . . . . . . . . . . . . 16.9 p -152.66 168.71 24.73 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.222 -0.924 . . . . 0.22 109.639 -179.753 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' D' D ' 330' ' ' LEU . . . . . . . . . . . . . 41.4 tp -152.1 129.28 11.18 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.283 -0.885 . . . . 0.28000000000000003 109.754 -179.982 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' D' D ' 331' ' ' GLN . . . . . . . . . . . . . 1.5 tt0 -87.55 115.31 24.89 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.112 -0.992 . . . . 0.93000000000000005 109.291 179.654 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' D' D ' 332' ' ' ILE . . . . . 0.655 HG21 ' HA ' ' D' ' 338' ' ' PHE . 39.3 mt -103.2 102.92 14.33 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.562 0 O-C-N 121.165 -0.959 . . . . 0.25 109.739 -179.886 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' D' D ' 333' ' ' ARG . . . . . . . . . . . . . 49.3 mtt180 -71.84 141.88 49.61 Favored 'General case' 0 N--CA 1.487 1.403 0 O-C-N 121.372 -0.83 . . . . 2.9300000000000002 109.189 179.626 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' D' D ' 334' ' ' GLY . . . . . . . . . . . . . . . 90.87 125.04 3.08 Favored Glycine 0 N--CA 1.492 2.377 0 N-CA-C 109.376 -1.49 . . . . 0.40999999999999998 109.376 -179.931 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' D' D ' 335' ' ' ARG . . . . . 0.451 ' HA ' ' CE2' ' B' ' 328' ' ' PHE . 18.5 ttt180 -76.64 -40.64 48.57 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.158 -1.201 . . . . 3.0299999999999998 109.734 -179.971 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' D' D ' 336' ' ' GLU . . . . . . . . . . . . . 24.1 tt0 -57.86 -58.58 7.76 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.269 -0.895 . . . . 2.2599999999999998 109.785 -179.771 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' D' D ' 337' ' ' ARG . . . . . 0.46 ' CG ' ' NH1' ' D' ' 337' ' ' ARG . 0.0 OUTLIER -61.45 -32.33 72.31 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.072 -1.017 . . . . 2.9199999999999999 109.581 -179.669 . . . . . . . . 3 3 . 1 . 026 nuclear build full ' D' D ' 338' ' ' PHE . . . . . 0.655 ' HA ' HG21 ' D' ' 332' ' ' ILE . 52.7 t80 -55.6 -53.24 58.91 Favored 'General case' 0 N--CA 1.489 1.492 0 O-C-N 121.304 -0.872 . . . . 0.37 109.527 179.926 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' D' D ' 339' ' ' GLU . . . . . . . . . . . . . 28.7 mt-10 -50.91 -32.3 20.22 Favored 'General case' 0 N--CA 1.494 1.762 0 O-C-N 121.308 -0.87 . . . . 1.99 110.109 -179.806 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' D' D ' 340' ' ' MET . . . . . . . . . . . . . 20.7 ttp -63.7 -51.28 65.75 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.069 -1.019 . . . . 0.31 109.642 -179.626 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' D' D ' 341' ' ' PHE . . . . . . . . . . . . . 34.9 m-85 -62.48 -41.59 98.89 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.11 -0.994 . . . . 0.17999999999999999 109.937 -179.656 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' D' D ' 342' ' ' ARG . . . . . . . . . . . . . 6.4 tpt180 -49.27 -43.51 43.09 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.162 -0.961 . . . . 2.4100000000000001 109.819 -179.793 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' D' D ' 343' ' ' GLU . . . . . . . . . . . . . 1.3 tt0 -59.26 -47.3 85.87 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.293 -0.879 . . . . 2.3500000000000001 109.679 -179.766 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' D' D ' 344' ' ' LEU . . . . . . . . . . . . . 48.3 mt -61.42 -30.22 70.43 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.241 -0.912 . . . . 0.19 109.354 -179.89 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' D' D ' 345' ' ' ASN . . . . . . . . . . . . . 11.8 t-20 -58.67 -59.18 5.81 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.186 -0.946 . . . . 1.0900000000000001 109.981 -179.979 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' D' D ' 346' ' ' GLU . . . . . . . . . . . . . 19.1 tt0 -60.87 -27.81 68.39 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.228 -0.92 . . . . 1.6899999999999999 109.927 -179.542 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' D' D ' 347' ' ' ALA . . . . . 0.418 ' HB1' ' HB1' ' C' ' 347' ' ' ALA . . . -61.09 -61.49 2.53 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.082 -1.011 . . . . 0.17999999999999999 110.111 -179.705 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' D' D ' 348' ' ' LEU . . . . . 0.629 HD22 ' N ' ' D' ' 348' ' ' LEU . 3.8 mm? -62.1 -45.89 91.49 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.368 -0.832 . . . . 0.31 110.239 -179.441 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' D' D ' 349' ' ' GLU . . . . . . . . . . . . . 3.8 mt-10 -57.6 -33.19 67.94 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.186 -0.946 . . . . 1.95 109.784 -179.299 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' D' D ' 350' ' ' LEU . . . . . 0.518 HD22 HD22 ' C' ' 350' ' ' LEU . 7.7 tt -65.01 -43.88 91.03 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.302 -0.874 . . . . 0.42999999999999999 109.531 -179.98 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' D' D ' 351' ' ' LYS . . . . . . . . . . . . . 16.7 tttt -59.5 -50.16 74.98 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.502 -0.749 . . . . 1.3999999999999999 109.543 -179.783 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' D' D ' 352' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 -56.62 -32.37 65.24 Favored 'General case' 0 N--CA 1.488 1.458 0 O-C-N 121.293 -0.879 . . . . 1.1699999999999999 109.767 -179.799 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' D' D ' 353' ' ' ALA . . . . . . . . . . . . . . . -66.51 -32.31 73.58 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.296 -0.878 . . . . 0.58999999999999997 109.929 -179.732 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' D' D ' 354' ' ' GLN . . . . . . . . . . . . . 19.9 mt-30 -83.54 -9.68 58.79 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.1 -1.0 . . . . 1.4399999999999999 109.687 -179.702 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' D' D ' 355' ' ' ALA . . . . . . . . . . . . . . . -74.07 -3.19 27.93 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.253 -0.905 . . . . 0.97999999999999998 110.321 -179.783 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' D' D ' 356' ' ' GLY . . . . . . . . . . . . . . . -80.66 -31.33 36.85 Favored Glycine 0 N--CA 1.492 2.402 0 N-CA-C 109.934 -1.266 . . . . 1.28 109.934 -179.44 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' D' D ' 357' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -88.15 149.3 23.98 Favored 'General case' 0 C--N 1.302 -1.458 0 O-C-N 121.186 -1.185 . . . . 4.0899999999999999 109.498 -179.963 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' D' D ' 358' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -49.28 116.02 5.33 Favored Pre-proline 0 N--CA 1.489 1.502 0 O-C-N 121.292 -0.88 . . . . 5.71 109.392 -179.917 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' D' D ' 359' ' ' PRO . . . . . . . . . . . . . 4.5 Cg_exo -59.06 131.8 43.58 Favored 'Trans proline' 0 C--N 1.315 -1.202 0 C-N-CA 121.998 1.798 . . . . 4.9699999999999998 110.395 -179.614 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' D' D ' 360' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.328 0 CA-C-O 117.968 -1.462 . . . . 6.9699999999999998 109.592 179.99 . . . . . . . . 0 0 . 1 . 027 nuclear build full ' A' A ' 319' ' ' LYS . . . . . . . . . . . . . 13.6 mttt . . . . . 0 N--CA 1.49 1.557 0 N-CA-C 109.606 -0.516 . . . . 7.5499999999999998 109.606 . . . . . . . . . 0 0 . 1 . 027 nuclear build full ' A' A ' 320' ' ' LYS . . . . . 0.487 ' O ' ' HD3' ' A' ' 322' ' ' PRO . 11.4 mttt 59.85 -129.73 1.04 Allowed 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.085 -1.009 . . . . 6.4299999999999997 109.145 179.988 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 321' ' ' LYS . . . . . . . . . . . . . 32.1 mttt -80.62 113.59 41.06 Favored Pre-proline 0 N--CA 1.491 1.616 0 O-C-N 120.886 -1.134 . . . . 6.1299999999999999 109.34 179.932 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 322' ' ' PRO . . . . . 0.487 ' HD3' ' O ' ' A' ' 320' ' ' LYS . 1.0 OUTLIER -66.45 127.74 17.9 Favored 'Trans proline' 0 C--N 1.315 -1.193 0 C-N-CA 122.004 1.803 . . . . 2.8300000000000001 109.848 -179.57 . . . . . . . . 3 3 . 1 . 027 nuclear build full ' A' A ' 323' ' ' LEU . . . . . . . . . . . . . 95.5 mt -80.43 90.69 5.65 Favored 'General case' 0 C--N 1.303 -1.456 0 O-C-N 121.136 -0.978 . . . . 2.8300000000000001 109.583 -179.816 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 324' ' ' ASP . . . . . . . . . . . . . 37.3 m-20 -82.16 102.41 11.07 Favored 'General case' 0 N--CA 1.489 1.484 0 O-C-N 121.228 -0.92 . . . . 1.53 109.369 179.759 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 325' ' ' GLY . . . . . 0.583 ' O ' ' CD2' ' A' ' 327' ' ' TYR . . . -68.97 -167.29 4.89 Favored Glycine 0 N--CA 1.489 2.21 0 N-CA-C 109.246 -1.542 . . . . 0.60999999999999999 109.246 179.859 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 326' ' ' GLU . . . . . . . . . . . . . 5.7 mm-40 -59.42 159.44 8.07 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.217 -1.166 . . . . 2.1299999999999999 109.242 179.785 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 327' ' ' TYR . . . . . 0.59 ' CE1' ' HG3' ' C' ' 333' ' ' ARG . 41.0 m-85 -148.76 108.07 3.94 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.25 -0.906 . . . . 0.47999999999999998 109.849 -179.909 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 328' ' ' PHE . . . . . 0.477 ' CE2' ' HA ' ' C' ' 335' ' ' ARG . 46.7 m-85 -113.35 -166.45 1.09 Allowed 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.214 -0.929 . . . . 0.31 109.297 179.691 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 329' ' ' THR . . . . . . . . . . . . . 20.2 p -152.75 171.29 18.46 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.131 -0.98 . . . . 0.22 109.238 179.729 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 330' ' ' LEU . . . . . 0.504 HD21 ' HB2' ' C' ' 345' ' ' ASN . 35.0 tp -151.47 130.29 12.43 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.109 -0.995 . . . . 0.28000000000000003 109.815 -179.799 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 331' ' ' GLN . . . . . . . . . . . . . 13.4 tp60 -88.22 109.12 19.67 Favored 'General case' 0 N--CA 1.488 1.471 0 O-C-N 121.446 -0.784 . . . . 0.91000000000000003 108.938 179.463 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 332' ' ' ILE . . . . . . . . . . . . . 30.6 mt -103.21 106.68 20.55 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.6 0 O-C-N 120.965 -1.084 . . . . 0.26000000000000001 109.641 -179.814 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 333' ' ' ARG . . . . . 0.463 ' HG2' ' CE1' ' C' ' 327' ' ' TYR . 61.8 mtt180 -72.81 148.67 44.29 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.205 -0.935 . . . . 2.9199999999999999 109.585 179.873 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 334' ' ' GLY . . . . . . . . . . . . . . . 83.27 129.52 1.5 Allowed Glycine 0 N--CA 1.492 2.377 0 N-CA-C 109.648 -1.381 . . . . 0.40000000000000002 109.648 179.734 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 335' ' ' ARG . . . . . . . . . . . . . 15.2 ttt180 -79.76 -32.8 41.03 Favored 'General case' 0 N--CA 1.489 1.476 0 O-C-N 121.27 -1.135 . . . . 3.0099999999999998 109.486 179.774 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 336' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -56.87 -62.87 1.44 Allowed 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.359 -0.838 . . . . 2.29 109.415 -179.812 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 337' ' ' ARG . . . . . . . . . . . . . 1.4 mmt180 -60.92 -29.89 69.87 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.323 -0.861 . . . . 2.9300000000000002 109.638 179.974 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 338' ' ' PHE . . . . . . . . . . . . . 72.0 t80 -54.72 -57.75 10.27 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.344 -0.848 . . . . 0.38 109.759 -179.881 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 339' ' ' GLU . . . . . . . . . . . . . 50.7 mt-10 -52.11 -36.18 50.26 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.087 -1.008 . . . . 1.97 109.958 -179.869 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 340' ' ' MET . . . . . . . . . . . . . 41.5 ttp -63.44 -46.39 86.54 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.137 -0.977 . . . . 0.31 109.888 -179.647 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 341' ' ' PHE . . . . . . . . . . . . . 39.9 m-85 -62.79 -46.25 88.86 Favored 'General case' 0 N--CA 1.494 1.74 0 O-C-N 121.106 -0.997 . . . . 0.17999999999999999 110.076 -179.734 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 342' ' ' ARG . . . . . . . . . . . . . 22.3 ttt180 -49.38 -44.12 44.66 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.219 -0.926 . . . . 2.4199999999999999 110.296 -179.414 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 343' ' ' GLU . . . . . . . . . . . . . 1.8 tp10 -57.33 -45.34 84.38 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.115 -0.991 . . . . 2.3500000000000001 110.005 -179.735 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 344' ' ' LEU . . . . . 0.573 HD22 ' CD2' ' B' ' 344' ' ' LEU . 69.6 mt -62.59 -41.5 99.0 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.17 -0.956 . . . . 0.17999999999999999 110.034 -179.558 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 345' ' ' ASN . . . . . 0.558 ' HB2' HD21 ' C' ' 330' ' ' LEU . 62.9 t-20 -56.95 -49.78 74.64 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.244 -0.91 . . . . 1.0900000000000001 109.665 -179.737 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 346' ' ' GLU . . . . . . . . . . . . . 4.5 tp10 -62.72 -34.41 77.11 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.167 -0.958 . . . . 1.6499999999999999 110.14 -179.788 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 347' ' ' ALA . . . . . 1.001 ' HB1' ' HB1' ' B' ' 347' ' ' ALA . . . -59.26 -55.44 34.83 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.083 -1.01 . . . . 0.17999999999999999 109.956 -179.602 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 348' ' ' LEU . . . . . 0.564 HD22 ' N ' ' A' ' 348' ' ' LEU . 3.9 mm? -61.19 -44.62 97.01 Favored 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.345 -0.847 . . . . 0.29999999999999999 109.871 -179.552 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 349' ' ' GLU . . . . . . . . . . . . . 2.5 mt-10 -57.4 -33.46 67.87 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.359 -0.838 . . . . 1.9399999999999999 109.93 -179.364 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 350' ' ' LEU . . . . . 0.687 HD23 ' O ' ' A' ' 350' ' ' LEU . 4.8 tt -63.29 -46.27 87.51 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.175 -0.953 . . . . 0.46000000000000002 109.299 -179.604 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 351' ' ' LYS . . . . . . . . . . . . . 42.8 tttt -59.58 -37.61 78.97 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.42 -0.8 . . . . 1.3999999999999999 109.312 179.946 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 352' ' ' ASP . . . . . . . . . . . . . 3.5 m-20 -57.43 -43.6 84.0 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.34 -0.85 . . . . 1.1599999999999999 109.698 179.837 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 353' ' ' ALA . . . . . . . . . . . . . . . -67.65 -18.69 65.04 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.183 -0.948 . . . . 0.63 109.936 -179.357 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 354' ' ' GLN . . . . . . . . . . . . . 23.5 tt0 -82.6 -11.91 58.07 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.086 -1.009 . . . . 1.47 109.445 -179.887 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 355' ' ' ALA . . . . . . . . . . . . . . . -73.06 -2.01 19.58 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.339 -0.85 . . . . 1.01 109.594 179.758 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 356' ' ' GLY . . . . . . . . . . . . . . . -77.84 -5.49 86.61 Favored Glycine 0 N--CA 1.489 2.169 0 N-CA-C 109.733 -1.347 . . . . 1.3 109.733 -179.743 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 357' ' ' LYS . . . . . . . . . . . . . 23.9 mttt -87.59 143.87 26.97 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.184 -1.186 . . . . 4.0999999999999996 109.125 179.647 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 358' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -48.65 164.66 0.27 Allowed Pre-proline 0 N--CA 1.49 1.559 0 O-C-N 121.236 -0.915 . . . . 5.75 109.417 -179.895 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 359' ' ' PRO . . . . . . . . . . . . . 1.9 Cg_endo -62.53 134.44 47.86 Favored 'Trans proline' 0 C--N 1.309 -1.535 0 C-N-CA 122.285 1.99 . . . . 5.0 110.226 179.916 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 360' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.488 2.159 0 CA-C-O 117.999 -1.445 . . . . 6.9699999999999998 109.602 179.782 . . . . . . . . 0 0 . 1 . 027 nuclear build full ' B' B ' 319' ' ' LYS . . . . . . . . . . . . . 13.2 mttt . . . . . 0 N--CA 1.49 1.541 0 N-CA-C 109.423 -0.584 . . . . 7.5499999999999998 109.423 . . . . . . . . . 0 0 . 1 . 027 nuclear build full ' B' B ' 320' ' ' LYS . . . . . 0.498 ' O ' ' HD3' ' B' ' 322' ' ' PRO . 10.4 mttt 60.28 -130.01 0.95 Allowed 'General case' 0 N--CA 1.489 1.478 0 O-C-N 121.152 -0.968 . . . . 6.4400000000000004 108.981 -179.57 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' B' B ' 321' ' ' LYS . . . . . . . . . . . . . 27.4 mttt -80.18 113.75 41.24 Favored Pre-proline 0 N--CA 1.488 1.472 0 O-C-N 120.935 -1.103 . . . . 6.1299999999999999 109.498 -179.931 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' B' B ' 322' ' ' PRO . . . . . 0.498 ' HD3' ' O ' ' B' ' 320' ' ' LYS . 1.2 Cg_endo -66.52 127.26 16.92 Favored 'Trans proline' 0 C--N 1.315 -1.23 0 C-N-CA 122.1 1.866 . . . . 2.8199999999999998 110.016 -179.845 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' B' B ' 323' ' ' LEU . . . . . . . . . . . . . 92.7 mt -80.33 90.63 5.58 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.159 -0.963 . . . . 2.8399999999999999 109.528 -179.817 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' B' B ' 324' ' ' ASP . . . . . . . . . . . . . 39.9 m-20 -82.31 103.18 11.71 Favored 'General case' 0 N--CA 1.488 1.459 0 O-C-N 121.228 -0.92 . . . . 1.53 109.294 179.603 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' B' B ' 325' ' ' GLY . . . . . 0.591 ' O ' ' CD2' ' B' ' 327' ' ' TYR . . . -69.31 -166.99 5.13 Favored Glycine 0 N--CA 1.491 2.328 0 N-CA-C 109.295 -1.522 . . . . 0.58999999999999997 109.295 179.976 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' B' B ' 326' ' ' GLU . . . . . . . . . . . . . 5.4 mm-40 -59.13 160.04 6.72 Favored 'General case' 0 C--N 1.304 -1.401 0 O-C-N 121.062 -1.258 . . . . 2.1299999999999999 109.209 179.833 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' B' B ' 327' ' ' TYR . . . . . 0.591 ' CD2' ' O ' ' B' ' 325' ' ' GLY . 40.0 m-85 -149.36 107.22 3.69 Favored 'General case' 0 C--N 1.303 -1.421 0 O-C-N 121.183 -0.948 . . . . 0.47999999999999998 109.824 -179.983 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' B' B ' 328' ' ' PHE . . . . . . . . . . . . . 45.3 m-85 -113.03 -166.13 1.05 Allowed 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.213 -0.929 . . . . 0.32000000000000001 109.12 179.8 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' B' B ' 329' ' ' THR . . . . . . . . . . . . . 22.4 p -153.33 170.63 20.17 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.321 -0.862 . . . . 0.23000000000000001 109.197 -179.934 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' B' B ' 330' ' ' LEU . . . . . 0.587 HD11 HD22 ' D' ' 345' ' ' ASN . 33.4 tp -150.64 130.64 13.42 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.22 -0.925 . . . . 0.28000000000000003 110.023 -179.804 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' B' B ' 331' ' ' GLN . . . . . . . . . . . . . 12.6 tp60 -88.49 108.87 19.62 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.335 -0.853 . . . . 0.91000000000000003 108.934 179.415 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' B' B ' 332' ' ' ILE . . . . . . . . . . . . . 30.4 mt -103.08 106.75 20.65 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.546 0 O-C-N 121.171 -0.955 . . . . 0.23999999999999999 109.651 -179.621 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' B' B ' 333' ' ' ARG . . . . . 0.41 ' HG2' ' CE1' ' D' ' 327' ' ' TYR . 62.2 mtt180 -72.89 148.81 44.03 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.361 -0.837 . . . . 2.9300000000000002 109.632 179.911 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' B' B ' 334' ' ' GLY . . . . . . . . . . . . . . . 83.16 129.9 1.52 Allowed Glycine 0 N--CA 1.49 2.281 0 N-CA-C 109.569 -1.412 . . . . 0.40000000000000002 109.569 179.585 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' B' B ' 335' ' ' ARG . . . . . . . . . . . . . 16.7 ttt180 -79.88 -32.81 40.37 Favored 'General case' 0 N--CA 1.489 1.5 0 O-C-N 121.351 -1.087 . . . . 3.0099999999999998 109.425 179.929 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' B' B ' 336' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -57.22 -62.42 1.78 Allowed 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.063 -1.023 . . . . 2.2799999999999998 109.677 -179.853 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' B' B ' 337' ' ' ARG . . . . . . . . . . . . . 1.1 mmt180 -61.11 -30.61 70.46 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.223 -0.923 . . . . 2.9300000000000002 109.625 -179.907 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' B' B ' 338' ' ' PHE . . . . . . . . . . . . . 69.0 t80 -54.4 -56.8 15.0 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.315 -0.865 . . . . 0.37 109.731 -179.82 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' B' B ' 339' ' ' GLU . . . . . . . . . . . . . 51.7 mt-10 -52.86 -35.59 57.79 Favored 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.24 -0.912 . . . . 1.98 109.824 -179.692 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' B' B ' 340' ' ' MET . . . . . . . . . . . . . 42.1 ttp -63.87 -46.46 84.82 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.211 -0.931 . . . . 0.32000000000000001 109.874 -179.678 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' B' B ' 341' ' ' PHE . . . . . . . . . . . . . 39.6 m-85 -62.73 -46.12 89.58 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.212 -0.93 . . . . 0.17999999999999999 110.055 -179.57 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' B' B ' 342' ' ' ARG . . . . . . . . . . . . . 23.0 ttt180 -48.98 -43.93 40.56 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.302 -0.874 . . . . 2.4199999999999999 110.318 -179.584 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' B' B ' 343' ' ' GLU . . . . . . . . . . . . . 1.9 tp10 -58.14 -45.0 88.12 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.224 -0.922 . . . . 2.3500000000000001 109.934 -179.309 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' B' B ' 344' ' ' LEU . . . . . 0.573 ' CD2' HD22 ' A' ' 344' ' ' LEU . 70.6 mt -62.68 -42.26 99.53 Favored 'General case' 0 N--CA 1.488 1.459 0 O-C-N 121.18 -0.95 . . . . 0.17999999999999999 109.808 -179.693 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' B' B ' 345' ' ' ASN . . . . . 0.603 HD22 HD11 ' D' ' 330' ' ' LEU . 63.2 t-20 -55.9 -49.97 71.96 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.197 -0.939 . . . . 1.0900000000000001 109.786 -179.804 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' B' B ' 346' ' ' GLU . . . . . . . . . . . . . 4.3 tp10 -62.98 -34.65 78.0 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.261 -0.899 . . . . 1.6599999999999999 109.909 -179.584 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' B' B ' 347' ' ' ALA . . . . . 1.001 ' HB1' ' HB1' ' A' ' 347' ' ' ALA . . . -58.99 -55.79 30.57 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.072 -1.018 . . . . 0.17000000000000001 110.047 -179.587 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' B' B ' 348' ' ' LEU . . . . . 0.58 HD22 ' N ' ' B' ' 348' ' ' LEU . 3.9 mm? -60.86 -45.05 96.06 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.213 -0.93 . . . . 0.28999999999999998 109.804 -179.709 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' B' B ' 349' ' ' GLU . . . . . . . . . . . . . 2.6 mt-10 -57.21 -32.84 66.91 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.442 -0.786 . . . . 1.95 110.06 -179.509 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' B' B ' 350' ' ' LEU . . . . . 0.681 HD23 ' O ' ' B' ' 350' ' ' LEU . 4.8 tt -63.82 -46.7 83.91 Favored 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.091 -1.006 . . . . 0.45000000000000001 109.399 -179.685 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' B' B ' 351' ' ' LYS . . . . . . . . . . . . . 42.6 tttt -59.19 -37.15 76.69 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.299 -0.876 . . . . 1.3799999999999999 109.294 179.716 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' B' B ' 352' ' ' ASP . . . . . . . . . . . . . 2.3 m-20 -57.84 -43.46 85.86 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.336 -0.853 . . . . 1.1599999999999999 109.873 -179.979 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' B' B ' 353' ' ' ALA . . . . . . . . . . . . . . . -67.42 -19.4 65.37 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.313 -0.867 . . . . 0.60999999999999999 109.834 -179.722 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' B' B ' 354' ' ' GLN . . . . . . . . . . . . . 24.4 tt0 -82.09 -12.39 58.25 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.037 -1.039 . . . . 1.45 109.534 -179.713 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' B' B ' 355' ' ' ALA . . . . . . . . . . . . . . . -72.45 -1.8 17.08 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.308 -0.87 . . . . 0.97999999999999998 109.683 179.733 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' B' B ' 356' ' ' GLY . . . . . . . . . . . . . . . -78.07 -5.92 87.27 Favored Glycine 0 N--CA 1.491 2.355 0 N-CA-C 109.905 -1.278 . . . . 1.29 109.905 -179.528 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' B' B ' 357' ' ' LYS . . . . . . . . . . . . . 23.2 mttt -87.14 143.17 27.42 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.161 -1.199 . . . . 4.0899999999999999 109.317 179.614 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' B' B ' 358' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -48.13 164.78 0.25 Allowed Pre-proline 0 N--CA 1.491 1.605 0 O-C-N 121.203 -0.936 . . . . 5.7199999999999998 109.69 -179.83 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' B' B ' 359' ' ' PRO . . . . . . . . . . . . . 1.8 Cg_endo -62.54 134.8 49.64 Favored 'Trans proline' 0 C--N 1.309 -1.511 0 C-N-CA 121.969 1.779 . . . . 4.9800000000000004 110.039 179.847 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' B' B ' 360' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.355 0 N-CA-C 109.409 -1.476 . . . . 6.9800000000000004 109.409 -179.95 . . . . . . . . 0 0 . 1 . 027 nuclear build full ' C' C ' 319' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.49 1.541 0 N-CA-C 109.475 -0.565 . . . . 6.8200000000000003 109.475 . . . . . . . . . 1 1 . 1 . 027 nuclear build full ' C' C ' 320' ' ' LYS . . . . . 0.482 ' O ' ' HG2' ' C' ' 321' ' ' LYS . 2.1 tttm 57.59 85.28 0.09 Allowed 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.249 -0.907 . . . . 6.4900000000000002 109.347 179.914 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' C' C ' 321' ' ' LYS . . . . . 0.482 ' HG2' ' O ' ' C' ' 320' ' ' LYS . 1.1 mttt -155.13 108.45 2.27 Favored Pre-proline 0 N--CA 1.488 1.463 0 O-C-N 121.364 -0.835 . . . . 6.4000000000000004 108.949 179.991 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' C' C ' 322' ' ' PRO . . . . . . . . . . . . . 3.1 Cg_exo -60.46 -166.19 0.04 OUTLIER 'Trans proline' 0 C--N 1.311 -1.446 0 C-N-CA 121.894 1.729 . . . . 3.4199999999999999 110.19 -179.557 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' C' C ' 323' ' ' LEU . . . . . 0.417 HD23 ' HA ' ' C' ' 323' ' ' LEU . 85.1 mt -80.93 110.37 16.4 Favored 'General case' 0 C--N 1.303 -1.431 0 O-C-N 121.267 -0.896 . . . . 3.9500000000000002 109.534 -179.897 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' C' C ' 324' ' ' ASP . . . . . . . . . . . . . 73.9 m-20 -79.35 111.42 15.58 Favored 'General case' 0 N--CA 1.487 1.398 0 O-C-N 121.114 -0.991 . . . . 1.6299999999999999 108.673 179.389 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' C' C ' 325' ' ' GLY . . . . . 0.528 ' O ' ' CD2' ' C' ' 327' ' ' TYR . . . -67.04 179.91 12.93 Favored Glycine 0 N--CA 1.491 2.334 0 N-CA-C 109.102 -1.599 . . . . 0.72999999999999998 109.102 -179.679 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' C' C ' 326' ' ' GLU . . . . . . . . . . . . . 1.8 mt-10 -56.25 174.73 0.12 Allowed 'General case' 0 N--CA 1.488 1.444 0 O-C-N 121.246 -1.149 . . . . 2.1699999999999999 109.066 179.789 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' C' C ' 327' ' ' TYR . . . . . 0.528 ' CD2' ' O ' ' C' ' 325' ' ' GLY . 39.9 m-85 -150.81 108.37 3.65 Favored 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.139 -0.976 . . . . 0.47999999999999998 109.86 -179.99 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' C' C ' 328' ' ' PHE . . . . . . . . . . . . . 98.4 m-85 -113.79 -166.97 1.14 Allowed 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.149 -0.97 . . . . 0.33000000000000002 109.453 179.731 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' C' C ' 329' ' ' THR . . . . . 0.422 ' HA ' ' O ' ' A' ' 330' ' ' LEU . 6.7 p -152.03 172.41 16.34 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.107 -0.996 . . . . 0.23000000000000001 109.595 -179.929 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' C' C ' 330' ' ' LEU . . . . . 0.558 HD21 ' HB2' ' A' ' 345' ' ' ASN . 31.1 tp -151.69 130.14 12.15 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.137 -0.977 . . . . 0.28000000000000003 109.757 -179.609 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' C' C ' 331' ' ' GLN . . . . . . . . . . . . . 2.4 tp60 -86.85 109.85 19.58 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.208 -0.933 . . . . 1.48 109.355 179.8 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' C' C ' 332' ' ' ILE . . . . . 0.749 HG21 ' HA ' ' C' ' 338' ' ' PHE . 70.1 mt -103.16 106.04 19.37 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.518 0 O-C-N 121.185 -0.947 . . . . 0.23999999999999999 109.945 -179.616 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' C' C ' 333' ' ' ARG . . . . . 0.59 ' HG3' ' CE1' ' A' ' 327' ' ' TYR . 0.0 OUTLIER -72.27 151.61 42.69 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.381 -0.825 . . . . 2.7400000000000002 109.174 179.588 . . . . . . . . 3 3 . 1 . 027 nuclear build full ' C' C ' 334' ' ' GLY . . . . . . . . . . . . . . . 80.19 129.92 0.84 Allowed Glycine 0 N--CA 1.49 2.237 0 N-CA-C 109.434 -1.466 . . . . 0.34999999999999998 109.434 -179.91 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' C' C ' 335' ' ' ARG . . . . . 0.477 ' HA ' ' CE2' ' A' ' 328' ' ' PHE . 10.1 ttp180 -79.18 -35.8 41.28 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.246 -1.15 . . . . 2.5299999999999998 109.876 -179.678 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' C' C ' 336' ' ' GLU . . . . . . . . . . . . . 89.4 mt-10 -58.6 -63.01 1.44 Allowed 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.201 -0.937 . . . . 2.6200000000000001 109.921 -179.697 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' C' C ' 337' ' ' ARG . . . . . 0.46 ' NH1' ' CG ' ' C' ' 337' ' ' ARG . 0.3 OUTLIER -59.16 -31.06 68.63 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.126 -0.983 . . . . 2.8100000000000001 109.278 179.966 . . . . . . . . 3 3 . 1 . 027 nuclear build full ' C' C ' 338' ' ' PHE . . . . . 0.749 ' HA ' HG21 ' C' ' 332' ' ' ILE . 66.8 t80 -52.95 -58.58 6.48 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.272 -0.892 . . . . 0.40000000000000002 109.071 179.57 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' C' C ' 339' ' ' GLU . . . . . . . . . . . . . 2.7 mm-40 -51.55 -31.29 23.84 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.341 -0.849 . . . . 2.0499999999999998 109.741 179.713 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' C' C ' 340' ' ' MET . . . . . . . . . . . . . 29.5 ttp -63.74 -53.14 55.66 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.153 -0.967 . . . . 0.32000000000000001 109.681 -179.811 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' C' C ' 341' ' ' PHE . . . . . 0.442 ' HB2' HD13 ' C' ' 332' ' ' ILE . 46.0 m-85 -60.58 -38.1 83.51 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.345 -0.847 . . . . 0.17999999999999999 109.413 -179.989 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' C' C ' 342' ' ' ARG . . . . . . . . . . . . . 11.7 ttp180 -51.71 -53.14 42.54 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.449 -0.782 . . . . 2.9100000000000001 110.283 -179.683 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' C' C ' 343' ' ' GLU . . . . . . . . . . . . . 15.9 tp10 -55.73 -42.16 74.93 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.199 -0.938 . . . . 2.1400000000000001 110.26 -179.135 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' C' C ' 344' ' ' LEU . . . . . 0.452 ' O ' HD23 ' C' ' 348' ' ' LEU . 57.7 mt -61.83 -40.85 96.74 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.117 -0.99 . . . . 0.22 109.503 -179.706 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' C' C ' 345' ' ' ASN . . . . . 0.504 ' HB2' HD21 ' A' ' 330' ' ' LEU . 0.7 OUTLIER -57.6 -51.08 70.97 Favored 'General case' 0 C--N 1.303 -1.451 0 O-C-N 121.441 -0.787 . . . . 1.0800000000000001 109.331 179.803 . . . . . . . . 3 3 . 1 . 027 nuclear build full ' C' C ' 346' ' ' GLU . . . . . . . . . . . . . 3.6 tm-20 -61.75 -32.4 72.65 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.376 -0.828 . . . . 2.21 109.751 -179.993 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' C' C ' 347' ' ' ALA . . . . . 0.732 ' HB1' ' HB1' ' D' ' 347' ' ' ALA . . . -62.79 -52.85 61.56 Favored 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.249 -0.907 . . . . 0.17999999999999999 109.821 -179.846 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' C' C ' 348' ' ' LEU . . . . . 0.547 ' N ' HD22 ' C' ' 348' ' ' LEU . 4.2 mm? -61.13 -48.89 79.54 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.284 -0.885 . . . . 0.32000000000000001 109.644 -179.544 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' C' C ' 349' ' ' GLU . . . . . . . . . . . . . 61.1 mt-10 -58.71 -31.21 68.06 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.293 -0.88 . . . . 2.1899999999999999 109.754 -179.797 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' C' C ' 350' ' ' LEU . . . . . 0.911 ' CD2' HD13 ' D' ' 350' ' ' LEU . 10.2 tt -63.37 -40.72 98.02 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.218 -0.926 . . . . 0.46000000000000002 109.109 179.838 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' C' C ' 351' ' ' LYS . . . . . . . . . . . . . 36.1 tttm -61.4 -43.22 99.25 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.362 -0.836 . . . . 1.3500000000000001 109.483 179.869 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' C' C ' 352' ' ' ASP . . . . . . . . . . . . . 4.4 m-20 -56.23 -49.04 75.27 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.246 -0.909 . . . . 1.1899999999999999 109.551 -179.957 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' C' C ' 353' ' ' ALA . . . . . . . . . . . . . . . -68.25 -17.57 64.33 Favored 'General case' 0 N--CA 1.488 1.471 0 O-C-N 121.312 -0.868 . . . . 0.56999999999999995 109.363 -179.886 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' C' C ' 354' ' ' GLN . . . . . 0.494 ' CD ' HD11 ' D' ' 350' ' ' LEU . 0.8 OUTLIER -83.77 -14.74 50.77 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.331 -0.856 . . . . 1.47 109.082 179.853 . . . . . . . . 3 3 . 1 . 027 nuclear build full ' C' C ' 355' ' ' ALA . . . . . . . . . . . . . . . -73.46 -4.51 34.14 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.409 -0.807 . . . . 0.93000000000000005 110.037 -179.925 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' C' C ' 356' ' ' GLY . . . . . . . . . . . . . . . -77.29 -3.61 82.43 Favored Glycine 0 N--CA 1.49 2.293 0 N-CA-C 109.744 -1.342 . . . . 1.3300000000000001 109.744 -179.62 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' C' C ' 357' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -86.91 134.19 33.54 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.266 -1.138 . . . . 4.0099999999999998 109.322 179.881 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' C' C ' 358' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -47.81 137.55 10.11 Favored Pre-proline 0 C--N 1.303 -1.416 0 O-C-N 121.254 -0.904 . . . . 5.75 109.553 -179.841 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' C' C ' 359' ' ' PRO . . . . . . . . . . . . . 1.4 Cg_endo -65.33 98.93 0.34 Allowed 'Trans proline' 0 C--N 1.312 -1.369 0 C-N-CA 122.15 1.9 . . . . 4.9400000000000004 109.888 179.548 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' C' C ' 360' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.312 0 N-CA-C 109.313 -1.515 . . . . 6.5 109.313 -179.942 . . . . . . . . 0 0 . 1 . 027 nuclear build full ' D' D ' 319' ' ' LYS . . . . . . . . . . . . . 13.8 mttt . . . . . 0 N--CA 1.488 1.46 0 N-CA-C 109.419 -0.586 . . . . 7.5300000000000002 109.419 . . . . . . . . . 0 0 . 1 . 027 nuclear build full ' D' D ' 320' ' ' LYS . . . . . 0.495 ' O ' ' HD3' ' D' ' 322' ' ' PRO . 10.2 mttt 60.28 -128.72 1.0 Allowed 'General case' 0 N--CA 1.491 1.598 0 O-C-N 120.988 -1.07 . . . . 6.4100000000000001 109.284 179.783 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' D' D ' 321' ' ' LYS . . . . . . . . . . . . . 22.3 mttt -81.22 113.77 43.88 Favored Pre-proline 0 N--CA 1.492 1.626 0 O-C-N 120.843 -1.161 . . . . 6.1100000000000003 109.462 179.987 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' D' D ' 322' ' ' PRO . . . . . 0.495 ' HD3' ' O ' ' D' ' 320' ' ' LYS . 0.9 OUTLIER -66.64 128.27 18.74 Favored 'Trans proline' 0 C--N 1.311 -1.405 0 C-N-CA 121.931 1.754 . . . . 2.8199999999999998 109.985 179.98 . . . . . . . . 3 3 . 1 . 027 nuclear build full ' D' D ' 323' ' ' LEU . . . . . . . . . . . . . 90.7 mt -81.12 91.15 6.09 Favored 'General case' 0 C--N 1.303 -1.454 0 O-C-N 121.223 -0.923 . . . . 2.8300000000000001 109.472 -179.892 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' D' D ' 324' ' ' ASP . . . . . . . . . . . . . 44.8 m-20 -82.62 103.46 12.16 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.203 -0.936 . . . . 1.54 109.037 179.701 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' D' D ' 325' ' ' GLY . . . . . 0.573 ' O ' ' CD2' ' D' ' 327' ' ' TYR . . . -69.24 -166.22 4.67 Favored Glycine 0 N--CA 1.489 2.18 0 N-CA-C 109.242 -1.543 . . . . 0.58999999999999997 109.242 -179.947 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' D' D ' 326' ' ' GLU . . . . . . . . . . . . . 5.6 mm-40 -59.83 160.22 7.91 Favored 'General case' 0 N--CA 1.489 1.476 0 O-C-N 121.171 -1.193 . . . . 2.1299999999999999 109.039 179.664 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' D' D ' 327' ' ' TYR . . . . . 0.573 ' CD2' ' O ' ' D' ' 325' ' ' GLY . 41.2 m-85 -149.54 107.25 3.67 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.106 -0.996 . . . . 0.46999999999999997 109.75 -179.899 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' D' D ' 328' ' ' PHE . . . . . . . . . . . . . 45.9 m-85 -112.99 -166.06 1.05 Allowed 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.336 -0.852 . . . . 0.29999999999999999 109.458 179.708 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' D' D ' 329' ' ' THR . . . . . . . . . . . . . 30.8 p -153.07 170.46 20.41 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.167 -0.958 . . . . 0.22 109.348 179.879 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' D' D ' 330' ' ' LEU . . . . . 0.603 HD11 HD22 ' B' ' 345' ' ' ASN . 32.4 tp -150.46 130.41 13.4 Favored 'General case' 0 C--N 1.304 -1.41 0 O-C-N 121.125 -0.984 . . . . 0.28000000000000003 109.911 -179.973 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' D' D ' 331' ' ' GLN . . . . . . . . . . . . . 11.0 tp60 -88.41 108.56 19.43 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.427 -0.795 . . . . 0.93000000000000005 108.961 179.526 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' D' D ' 332' ' ' ILE . . . . . . . . . . . . . 25.3 mt -103.0 106.41 20.01 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.617 0 O-C-N 121.045 -1.034 . . . . 0.25 109.831 -179.632 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' D' D ' 333' ' ' ARG . . . . . . . . . . . . . 60.6 mtt180 -72.46 148.35 45.21 Favored 'General case' 0 N--CA 1.488 1.452 0 O-C-N 121.403 -0.811 . . . . 2.9300000000000002 109.574 179.956 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' D' D ' 334' ' ' GLY . . . . . . . . . . . . . . . 83.47 130.43 1.71 Allowed Glycine 0 N--CA 1.492 2.37 0 N-CA-C 109.834 -1.306 . . . . 0.40999999999999998 109.834 179.676 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' D' D ' 335' ' ' ARG . . . . . . . . . . . . . 19.5 ttt180 -79.82 -32.81 40.67 Favored 'General case' 0 N--CA 1.489 1.478 0 O-C-N 121.293 -1.122 . . . . 3.0299999999999998 109.499 179.851 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' D' D ' 336' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -57.44 -63.49 1.21 Allowed 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.272 -0.892 . . . . 2.2599999999999998 109.636 -179.91 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' D' D ' 337' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -60.45 -29.88 69.3 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.112 -0.992 . . . . 2.9199999999999999 109.694 -179.983 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' D' D ' 338' ' ' PHE . . . . . . . . . . . . . 69.2 t80 -55.23 -56.7 16.95 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.224 -0.922 . . . . 0.37 109.648 -179.722 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' D' D ' 339' ' ' GLU . . . . . . . . . . . . . 52.9 mt-10 -52.53 -35.62 53.81 Favored 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.278 -0.889 . . . . 1.99 109.948 -179.824 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' D' D ' 340' ' ' MET . . . . . . . . . . . . . 42.4 ttp -63.94 -45.98 86.74 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.25 -0.906 . . . . 0.31 109.916 -179.615 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' D' D ' 341' ' ' PHE . . . . . . . . . . . . . 40.1 m-85 -63.44 -45.53 90.47 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.306 -0.871 . . . . 0.17999999999999999 110.005 -179.464 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' D' D ' 342' ' ' ARG . . . . . . . . . . . . . 22.1 ttt180 -49.4 -43.5 44.47 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.172 -0.955 . . . . 2.4100000000000001 110.145 -179.401 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' D' D ' 343' ' ' GLU . . . . . . . . . . . . . 2.1 tp10 -57.98 -45.44 86.75 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.138 -0.976 . . . . 2.3500000000000001 109.96 -179.263 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' D' D ' 344' ' ' LEU . . . . . . . . . . . . . 70.9 mt -62.5 -42.28 99.4 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.257 -0.902 . . . . 0.19 109.956 -179.661 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' D' D ' 345' ' ' ASN . . . . . 0.587 HD22 HD11 ' B' ' 330' ' ' LEU . 63.5 t-20 -56.27 -49.56 73.87 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.145 -0.972 . . . . 1.0900000000000001 109.471 -179.723 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' D' D ' 346' ' ' GLU . . . . . . . . . . . . . 4.1 tp10 -62.64 -34.96 78.13 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.269 -0.894 . . . . 1.6899999999999999 110.116 -179.932 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' D' D ' 347' ' ' ALA . . . . . 0.732 ' HB1' ' HB1' ' C' ' 347' ' ' ALA . . . -59.44 -56.04 27.09 Favored 'General case' 0 N--CA 1.493 1.692 0 O-C-N 120.984 -1.072 . . . . 0.17999999999999999 110.104 -179.611 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' D' D ' 348' ' ' LEU . . . . . 0.583 HD22 ' N ' ' D' ' 348' ' ' LEU . 3.9 mm? -60.67 -44.84 95.99 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.156 -0.965 . . . . 0.31 109.789 -179.761 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' D' D ' 349' ' ' GLU . . . . . . . . . . . . . 2.5 mt-10 -57.71 -32.62 67.58 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.421 -0.8 . . . . 1.95 109.97 -179.45 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' D' D ' 350' ' ' LEU . . . . . 0.911 HD13 ' CD2' ' C' ' 350' ' ' LEU . 4.9 tt -63.8 -46.75 83.74 Favored 'General case' 0 N--CA 1.489 1.479 0 O-C-N 120.927 -1.108 . . . . 0.42999999999999999 109.365 -179.79 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' D' D ' 351' ' ' LYS . . . . . . . . . . . . . 39.0 tttt -59.29 -36.7 76.07 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.443 -0.786 . . . . 1.3999999999999999 109.413 -179.935 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' D' D ' 352' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -58.31 -43.08 87.99 Favored 'General case' 0 N--CA 1.489 1.475 0 O-C-N 121.34 -0.85 . . . . 1.1699999999999999 109.634 -179.961 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' D' D ' 353' ' ' ALA . . . . . . . . . . . . . . . -67.59 -19.06 65.2 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.201 -0.937 . . . . 0.58999999999999997 110.091 -179.413 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' D' D ' 354' ' ' GLN . . . . . . . . . . . . . 5.9 tt0 -82.41 -11.59 58.45 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.285 -0.885 . . . . 1.4399999999999999 109.554 -179.744 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' D' D ' 355' ' ' ALA . . . . . . . . . . . . . . . -73.18 -1.34 17.24 Favored 'General case' 0 N--CA 1.489 1.492 0 O-C-N 121.271 -0.893 . . . . 0.97999999999999998 109.703 179.742 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' D' D ' 356' ' ' GLY . . . . . . . . . . . . . . . -77.9 -5.83 86.92 Favored Glycine 0 N--CA 1.491 2.337 0 N-CA-C 110.055 -1.218 . . . . 1.28 110.055 -179.646 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' D' D ' 357' ' ' LYS . . . . . . . . . . . . . 26.7 mttt -87.36 143.21 27.36 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.112 -1.228 . . . . 4.0899999999999999 109.251 179.716 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' D' D ' 358' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -48.13 165.83 0.23 Allowed Pre-proline 0 N--CA 1.491 1.614 0 O-C-N 121.259 -0.9 . . . . 5.71 109.326 -179.943 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' D' D ' 359' ' ' PRO . . . . . . . . . . . . . 1.9 Cg_endo -62.19 134.42 48.88 Favored 'Trans proline' 0 C--N 1.308 -1.577 0 C-N-CA 122.291 1.994 . . . . 4.9699999999999998 110.049 179.879 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' D' D ' 360' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.321 0 CA-C-O 118.054 -1.414 . . . . 6.9699999999999998 109.649 179.99 . . . . . . . . 0 0 . 1 . 028 nuclear build full ' A' A ' 319' ' ' LYS . . . . . 0.425 ' O ' ' O ' ' A' ' 320' ' ' LYS . 3.1 mmtt . . . . . 0 N--CA 1.491 1.582 0 N-CA-C 109.38 -0.6 . . . . 7.5499999999999998 109.38 . . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 320' ' ' LYS . . . . . 0.425 ' O ' ' O ' ' A' ' 319' ' ' LYS . 1.1 tptt 62.31 131.75 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.142 -0.974 . . . . 6.4299999999999997 109.868 179.701 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 321' ' ' LYS . . . . . . . . . . . . . 8.4 mttt -157.43 141.9 11.86 Favored Pre-proline 0 N--CA 1.487 1.407 0 O-C-N 121.243 -0.911 . . . . 6.1299999999999999 109.575 -179.889 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 322' ' ' PRO . . . . . . . . . . . . . 1.6 Cg_endo -64.24 -80.83 0.01 OUTLIER 'Trans proline' 0 C--N 1.309 -1.513 0 C-N-CA 121.944 1.763 . . . . 2.8300000000000001 109.656 179.727 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 323' ' ' LEU . . . . . . . . . . . . . 22.2 mt -79.66 114.09 18.31 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.292 -0.88 . . . . 2.8300000000000001 109.119 179.782 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 324' ' ' ASP . . . . . . . . . . . . . 41.4 m-20 -79.64 147.8 31.88 Favored 'General case' 0 N--CA 1.489 1.477 0 O-C-N 121.195 -0.94 . . . . 1.53 109.407 -179.774 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 325' ' ' GLY . . . . . . . . . . . . . . . -67.66 167.34 41.42 Favored Glycine 0 N--CA 1.49 2.256 0 N-CA-C 109.269 -1.533 . . . . 0.60999999999999999 109.269 -179.937 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 326' ' ' GLU . . . . . . . . . . . . . 32.2 mm-40 -57.08 174.26 0.18 Allowed 'General case' 0 N--CA 1.488 1.447 0 O-C-N 121.04 -1.27 . . . . 2.1299999999999999 109.594 -179.776 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 327' ' ' TYR . . . . . 0.424 ' CE1' ' HG2' ' C' ' 333' ' ' ARG . 39.4 m-85 -148.24 110.99 4.77 Favored 'General case' 0 C--N 1.303 -1.416 0 O-C-N 121.246 -0.909 . . . . 0.47999999999999998 109.759 179.998 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 328' ' ' PHE . . . . . . . . . . . . . 29.5 m-85 -113.9 -171.78 1.96 Allowed 'General case' 0 C--N 1.301 -1.533 0 O-C-N 121.428 -0.795 . . . . 0.31 109.395 179.753 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 329' ' ' THR . . . . . . . . . . . . . 3.3 p -149.16 167.0 27.14 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.307 -0.871 . . . . 0.22 109.059 179.898 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 330' ' ' LEU . . . . . 0.413 ' O ' ' HA ' ' C' ' 329' ' ' THR . 63.3 tp -149.82 129.29 13.01 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.313 -0.867 . . . . 0.28000000000000003 109.762 -179.576 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 331' ' ' GLN . . . . . . . . . . . . . 1.1 tp60 -87.32 113.2 22.83 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.394 -0.816 . . . . 0.91000000000000003 109.418 179.701 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 332' ' ' ILE . . . . . 0.665 HG21 ' HA ' ' A' ' 338' ' ' PHE . 69.7 mt -102.19 107.63 22.16 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.527 0 O-C-N 121.112 -0.993 . . . . 0.26000000000000001 109.611 -179.959 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 333' ' ' ARG . . . . . 0.462 ' HG2' ' CE1' ' C' ' 327' ' ' TYR . 76.1 mtt180 -72.51 143.75 48.25 Favored 'General case' 0 C--N 1.303 -1.445 0 O-C-N 121.492 -0.755 . . . . 2.9199999999999999 109.456 179.925 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 334' ' ' GLY . . . . . . . . . . . . . . . 85.43 128.26 1.98 Allowed Glycine 0 N--CA 1.49 2.252 0 N-CA-C 109.596 -1.402 . . . . 0.40000000000000002 109.596 179.949 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 335' ' ' ARG . . . . . . . . . . . . . 9.2 ttp180 -77.06 -33.36 57.22 Favored 'General case' 0 C--N 1.303 -1.433 0 O-C-N 121.388 -1.066 . . . . 3.0099999999999998 109.197 179.903 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 336' ' ' GLU . . . . . . . . . . . . . 15.1 mt-10 -59.19 -63.89 1.14 Allowed 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.326 -0.859 . . . . 2.29 109.936 -179.781 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 337' ' ' ARG . . . . . 0.46 ' CG ' ' NH1' ' A' ' 337' ' ' ARG . 0.0 OUTLIER -59.25 -29.83 67.83 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 120.985 -1.072 . . . . 2.9300000000000002 109.496 -179.791 . . . . . . . . 3 3 . 1 . 028 nuclear build full ' A' A ' 338' ' ' PHE . . . . . 0.665 ' HA ' HG21 ' A' ' 332' ' ' ILE . 66.5 t80 -55.3 -54.14 47.22 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.199 -0.938 . . . . 0.38 109.544 179.867 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 339' ' ' GLU . . . . . . . . . . . . . 44.6 mt-10 -53.89 -35.37 61.51 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.26 -0.9 . . . . 1.97 109.91 179.979 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 340' ' ' MET . . . . . . . . . . . . . 6.7 ttp -63.46 -52.74 60.12 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.17 -0.956 . . . . 0.31 110.442 -179.075 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 341' ' ' PHE . . . . . . . . . . . . . 51.7 m-85 -60.74 -42.38 97.22 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.05 -1.031 . . . . 0.17999999999999999 109.816 -179.353 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 342' ' ' ARG . . . . . . . . . . . . . 60.6 ttt180 -50.86 -43.34 59.31 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.357 -0.84 . . . . 2.4199999999999999 109.884 -179.73 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 343' ' ' GLU . . . . . . . . . . . . . 3.9 tt0 -59.67 -45.99 90.4 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.178 -0.951 . . . . 2.3500000000000001 109.954 -179.553 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 344' ' ' LEU . . . . . 0.456 HD22 ' CD2' ' B' ' 344' ' ' LEU . 42.8 mt -61.3 -38.69 87.72 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.248 -0.907 . . . . 0.17999999999999999 109.889 -179.625 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 345' ' ' ASN . . . . . . . . . . . . . 64.2 t-20 -57.77 -49.64 75.9 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.202 -0.936 . . . . 1.0900000000000001 110.002 -179.773 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 346' ' ' GLU . . . . . . . . . . . . . 45.8 tt0 -60.78 -33.1 72.47 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.103 -0.998 . . . . 1.6499999999999999 109.837 -179.666 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 347' ' ' ALA . . . . . 0.973 ' HB1' ' HB1' ' B' ' 347' ' ' ALA . . . -59.7 -55.4 34.81 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.058 -1.026 . . . . 0.17999999999999999 110.013 -179.618 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 348' ' ' LEU . . . . . 0.629 HD22 ' N ' ' A' ' 348' ' ' LEU . 3.9 mm? -62.7 -40.22 96.46 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.167 -0.958 . . . . 0.29999999999999999 109.909 -179.455 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 349' ' ' GLU . . . . . 0.449 ' OE2' ' HD3' ' C' ' 333' ' ' ARG . 7.3 mm-40 -57.65 -39.48 77.11 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.218 -0.926 . . . . 1.9399999999999999 109.792 -179.431 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 350' ' ' LEU . . . . . 0.705 HD13 HD22 ' B' ' 350' ' ' LEU . 7.6 tt -61.86 -44.59 96.52 Favored 'General case' 0 N--CA 1.488 1.463 0 O-C-N 121.321 -0.862 . . . . 0.46000000000000002 109.334 -179.972 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 351' ' ' LYS . . . . . . . . . . . . . 42.0 tttt -58.85 -43.5 90.81 Favored 'General case' 0 N--CA 1.488 1.468 0 O-C-N 121.326 -0.859 . . . . 1.3999999999999999 109.235 179.98 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 352' ' ' ASP . . . . . . . . . . . . . 7.3 m-20 -56.65 -55.37 34.93 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.346 -0.846 . . . . 1.1599999999999999 109.676 -179.976 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 353' ' ' ALA . . . . . . . . . . . . . . . -69.02 -11.45 60.8 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.23 -0.919 . . . . 0.63 109.386 179.937 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 354' ' ' GLN . . . . . 0.409 ' HB2' ' O ' ' A' ' 350' ' ' LEU . 11.2 tt0 -84.51 -14.62 48.51 Favored 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.181 -0.95 . . . . 1.47 109.488 -179.699 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 355' ' ' ALA . . . . . . . . . . . . . . . -73.08 -9.68 58.99 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.265 -0.897 . . . . 1.01 109.528 179.905 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 356' ' ' GLY . . . . . . . . . . . . . . . -79.94 -3.54 89.38 Favored Glycine 0 N--CA 1.491 2.357 0 N-CA-C 109.684 -1.366 . . . . 1.3 109.684 -179.932 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 357' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -87.09 101.11 13.16 Favored 'General case' 0 N--CA 1.489 1.492 0 O-C-N 121.241 -1.153 . . . . 4.0999999999999996 109.541 179.971 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 358' ' ' GLU . . . . . 0.457 ' HB2' ' HD2' ' A' ' 359' ' ' PRO . 26.4 pt-20 -51.05 157.6 1.41 Allowed Pre-proline 0 N--CA 1.491 1.595 0 O-C-N 121.114 -0.991 . . . . 5.75 109.313 179.933 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 359' ' ' PRO . . . . . 0.457 ' HD2' ' HB2' ' A' ' 358' ' ' GLU . 2.4 Cg_endo -60.95 86.32 0.08 OUTLIER 'Trans proline' 0 C--N 1.307 -1.608 0 C-N-CA 121.972 1.781 . . . . 5.0 110.225 179.736 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 360' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.493 2.462 0 CA-C-O 117.981 -1.455 . . . . 6.9699999999999998 109.719 -179.921 . . . . . . . . 0 0 . 1 . 028 nuclear build full ' B' B ' 319' ' ' LYS . . . . . 0.452 ' O ' ' O ' ' B' ' 320' ' ' LYS . 3.2 mmtt . . . . . 0 N--CA 1.488 1.434 0 N-CA-C 109.195 -0.668 . . . . 7.5499999999999998 109.195 . . . . . . . . . 1 1 . 1 . 028 nuclear build full ' B' B ' 320' ' ' LYS . . . . . 0.452 ' O ' ' O ' ' B' ' 319' ' ' LYS . 1.5 tptt 61.62 132.94 0.01 OUTLIER 'General case' 0 C--N 1.302 -1.496 0 O-C-N 121.294 -0.879 . . . . 6.4400000000000004 109.737 179.977 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' B' B ' 321' ' ' LYS . . . . . . . . . . . . . 8.4 mttt -158.2 140.67 10.43 Favored Pre-proline 0 N--CA 1.489 1.505 0 O-C-N 121.322 -0.861 . . . . 6.1299999999999999 109.63 -179.884 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' B' B ' 322' ' ' PRO . . . . . . . . . . . . . 1.5 Cg_endo -63.2 -81.03 0.01 OUTLIER 'Trans proline' 0 C--N 1.31 -1.49 0 C-N-CA 122.301 2.001 . . . . 2.8199999999999998 109.54 179.471 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' B' B ' 323' ' ' LEU . . . . . . . . . . . . . 22.1 mt -79.68 114.16 18.39 Favored 'General case' 0 N--CA 1.489 1.484 0 O-C-N 121.161 -0.962 . . . . 2.8399999999999999 109.28 179.814 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' B' B ' 324' ' ' ASP . . . . . . . . . . . . . 40.0 m-20 -79.66 145.34 33.06 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.294 -0.879 . . . . 1.53 109.657 179.938 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' B' B ' 325' ' ' GLY . . . . . . . . . . . . . . . -65.26 167.35 32.05 Favored Glycine 0 N--CA 1.491 2.344 0 N-CA-C 109.602 -1.399 . . . . 0.58999999999999997 109.602 179.901 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' B' B ' 326' ' ' GLU . . . . . . . . . . . . . 30.9 mm-40 -57.16 174.07 0.2 Allowed 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.103 -1.233 . . . . 2.1299999999999999 109.522 -179.895 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' B' B ' 327' ' ' TYR . . . . . . . . . . . . . 38.0 m-85 -148.62 110.51 4.55 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.324 -0.86 . . . . 0.47999999999999998 109.764 -179.695 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' B' B ' 328' ' ' PHE . . . . . 0.442 ' CZ ' ' HB2' ' D' ' 335' ' ' ARG . 30.7 m-85 -114.3 -172.9 2.19 Favored 'General case' 0 N--CA 1.489 1.491 0 O-C-N 121.53 -0.731 . . . . 0.32000000000000001 109.626 179.862 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' B' B ' 329' ' ' THR . . . . . 0.418 ' HA ' ' O ' ' D' ' 330' ' ' LEU . 3.2 p -148.36 167.19 25.89 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.096 -1.002 . . . . 0.23000000000000001 109.143 -179.905 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' B' B ' 330' ' ' LEU . . . . . . . . . . . . . 62.0 tp -150.17 129.6 12.97 Favored 'General case' 0 C--N 1.303 -1.438 0 O-C-N 121.238 -0.914 . . . . 0.28000000000000003 109.617 -179.501 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' B' B ' 331' ' ' GLN . . . . . . . . . . . . . 1.1 tp60 -87.47 114.17 23.84 Favored 'General case' 0 C--N 1.304 -1.412 0 O-C-N 121.3 -0.875 . . . . 0.91000000000000003 109.007 179.608 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' B' B ' 332' ' ' ILE . . . . . 0.643 HG21 ' HA ' ' B' ' 338' ' ' PHE . 70.1 mt -102.87 106.75 20.59 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.465 0 O-C-N 121.227 -0.921 . . . . 0.23999999999999999 109.256 -179.749 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' B' B ' 333' ' ' ARG . . . . . . . . . . . . . 74.9 mtt180 -71.78 144.42 49.2 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.157 -0.964 . . . . 2.9300000000000002 109.458 -179.871 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' B' B ' 334' ' ' GLY . . . . . . . . . . . . . . . 84.75 128.39 1.79 Allowed Glycine 0 N--CA 1.489 2.229 0 N-CA-C 109.741 -1.344 . . . . 0.40000000000000002 109.741 179.886 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' B' B ' 335' ' ' ARG . . . . . . . . . . . . . 8.5 ttp180 -77.42 -32.96 55.02 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.321 -1.106 . . . . 3.0099999999999998 109.449 179.866 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' B' B ' 336' ' ' GLU . . . . . . . . . . . . . 14.1 mt-10 -59.77 -62.8 1.61 Allowed 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.242 -0.911 . . . . 2.2799999999999998 109.843 -179.69 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' B' B ' 337' ' ' ARG . . . . . 0.476 HH11 ' CG ' ' B' ' 337' ' ' ARG . 0.0 OUTLIER -59.96 -30.04 68.83 Favored 'General case' 0 N--CA 1.488 1.472 0 O-C-N 121.166 -0.959 . . . . 2.9300000000000002 109.354 -179.794 . . . . . . . . 3 3 . 1 . 028 nuclear build full ' B' B ' 338' ' ' PHE . . . . . 0.643 ' HA ' HG21 ' B' ' 332' ' ' ILE . 66.8 t80 -55.39 -53.75 52.31 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.146 -0.971 . . . . 0.37 109.629 179.9 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' B' B ' 339' ' ' GLU . . . . . . . . . . . . . 49.3 mt-10 -53.84 -35.83 61.91 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.134 -0.979 . . . . 1.98 109.976 179.827 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' B' B ' 340' ' ' MET . . . . . . . . . . . . . 6.2 ttp -63.12 -52.21 63.48 Favored 'General case' 0 N--CA 1.495 1.785 0 O-C-N 121.196 -0.94 . . . . 0.32000000000000001 110.649 -179.141 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' B' B ' 341' ' ' PHE . . . . . . . . . . . . . 49.5 m-85 -60.93 -43.49 98.57 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.13 -0.981 . . . . 0.17999999999999999 109.59 -179.494 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' B' B ' 342' ' ' ARG . . . . . . . . . . . . . 61.7 ttt180 -49.99 -43.38 50.45 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.433 -0.792 . . . . 2.4199999999999999 109.993 -179.841 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' B' B ' 343' ' ' GLU . . . . . . . . . . . . . 3.7 tt0 -59.88 -45.86 91.16 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.232 -0.918 . . . . 2.3500000000000001 110.14 -179.536 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' B' B ' 344' ' ' LEU . . . . . 0.456 ' CD2' HD22 ' A' ' 344' ' ' LEU . 43.5 mt -61.84 -37.95 86.36 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.189 -0.945 . . . . 0.17999999999999999 110.024 -179.621 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' B' B ' 345' ' ' ASN . . . . . 0.51 ' C ' HD21 ' B' ' 345' ' ' ASN . 0.4 OUTLIER -58.23 -49.05 78.45 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.291 -0.88 . . . . 1.0900000000000001 109.879 -179.708 . . . . . . . . 3 3 . 1 . 028 nuclear build full ' B' B ' 346' ' ' GLU . . . . . . . . . . . . . 46.8 tt0 -60.98 -32.95 72.5 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.209 -0.932 . . . . 1.6599999999999999 109.819 -179.669 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' B' B ' 347' ' ' ALA . . . . . 0.973 ' HB1' ' HB1' ' A' ' 347' ' ' ALA . . . -60.03 -56.18 24.87 Favored 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.101 -1.0 . . . . 0.17000000000000001 110.009 -179.598 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' B' B ' 348' ' ' LEU . . . . . 0.642 HD22 ' N ' ' B' ' 348' ' ' LEU . 3.9 mm? -62.25 -40.36 95.94 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.284 -0.885 . . . . 0.28999999999999998 109.866 -179.567 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' B' B ' 349' ' ' GLU . . . . . . . . . . . . . 7.2 mm-40 -57.43 -39.17 75.65 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 121.211 -0.93 . . . . 1.95 109.913 -179.648 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' B' B ' 350' ' ' LEU . . . . . 0.705 HD22 HD13 ' A' ' 350' ' ' LEU . 7.7 tt -62.35 -45.29 93.84 Favored 'General case' 0 N--CA 1.488 1.456 0 O-C-N 121.201 -0.937 . . . . 0.45000000000000001 109.242 -179.786 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' B' B ' 351' ' ' LYS . . . . . . . . . . . . . 39.2 tttt -58.16 -43.94 87.69 Favored 'General case' 0 C--N 1.302 -1.457 0 O-C-N 121.297 -0.877 . . . . 1.3799999999999999 109.286 179.975 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' B' B ' 352' ' ' ASP . . . . . . . . . . . . . 7.4 m-20 -56.13 -55.72 29.56 Favored 'General case' 0 N--CA 1.488 1.439 0 O-C-N 121.279 -0.888 . . . . 1.1599999999999999 109.526 -179.953 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' B' B ' 353' ' ' ALA . . . . . . . . . . . . . . . -68.38 -12.35 60.98 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.153 -0.967 . . . . 0.60999999999999999 109.777 179.977 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' B' B ' 354' ' ' GLN . . . . . . . . . . . . . 13.2 tt0 -84.08 -13.58 52.68 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.326 -0.859 . . . . 1.45 109.683 -179.772 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' B' B ' 355' ' ' ALA . . . . . . . . . . . . . . . -73.41 -10.27 59.56 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.181 -0.949 . . . . 0.97999999999999998 109.67 179.783 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' B' B ' 356' ' ' GLY . . . . . . . . . . . . . . . -80.15 -3.31 89.59 Favored Glycine 0 N--CA 1.49 2.275 0 N-CA-C 109.498 -1.441 . . . . 1.29 109.498 -179.995 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' B' B ' 357' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -87.0 100.47 12.64 Favored 'General case' 0 N--CA 1.487 1.425 0 O-C-N 121.322 -1.105 . . . . 4.0899999999999999 109.399 179.828 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' B' B ' 358' ' ' GLU . . . . . 0.453 ' HB2' ' HD2' ' B' ' 359' ' ' PRO . 27.1 pt-20 -50.84 157.57 1.33 Allowed Pre-proline 0 C--N 1.302 -1.475 0 O-C-N 121.177 -0.952 . . . . 5.7199999999999998 109.347 179.872 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' B' B ' 359' ' ' PRO . . . . . 0.453 ' HD2' ' HB2' ' B' ' 358' ' ' GLU . 3.3 Cg_exo -60.55 85.04 0.08 OUTLIER 'Trans proline' 0 C--N 1.309 -1.546 0 C-N-CA 122.202 1.934 . . . . 4.9800000000000004 110.171 179.82 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' B' B ' 360' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.487 2.055 0 CA-C-O 117.934 -1.481 . . . . 6.9800000000000004 109.622 -179.946 . . . . . . . . 0 0 . 1 . 028 nuclear build full ' C' C ' 319' ' ' LYS . . . . . 0.44 ' O ' ' O ' ' C' ' 320' ' ' LYS . 0.0 OUTLIER . . . . . 0 N--CA 1.489 1.487 0 N-CA-C 109.391 -0.596 . . . . 6.8200000000000003 109.391 . . . . . . . . . 2 2 . 1 . 028 nuclear build full ' C' C ' 320' ' ' LYS . . . . . 0.44 ' O ' ' O ' ' C' ' 319' ' ' LYS . 0.6 OUTLIER 61.93 126.16 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.267 -0.895 . . . . 6.4900000000000002 109.125 -179.825 . . . . . . . . 3 3 . 1 . 028 nuclear build full ' C' C ' 321' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -157.24 154.31 25.59 Favored Pre-proline 0 N--CA 1.489 1.507 0 O-C-N 121.205 -0.934 . . . . 6.4000000000000004 109.702 -179.713 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' C' C ' 322' ' ' PRO . . . . . . . . . . . . . 1.6 Cg_endo -63.17 -81.77 0.01 OUTLIER 'Trans proline' 0 C--N 1.311 -1.438 0 C-N-CA 122.346 2.031 . . . . 3.4199999999999999 110.388 179.834 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' C' C ' 323' ' ' LEU . . . . . 0.448 HD23 ' HA ' ' C' ' 323' ' ' LEU . 21.2 mt -82.69 104.14 12.72 Favored 'General case' 0 N--CA 1.495 1.779 0 O-C-N 121.234 -0.916 . . . . 3.9500000000000002 109.698 -179.964 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' C' C ' 324' ' ' ASP . . . . . . . . . . . . . 4.8 m-20 -79.82 139.22 37.29 Favored 'General case' 0 C--N 1.303 -1.449 0 O-C-N 121.275 -0.891 . . . . 1.6299999999999999 109.575 179.855 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' C' C ' 325' ' ' GLY . . . . . 0.466 ' O ' ' CD2' ' C' ' 327' ' ' TYR . . . -67.8 171.06 35.25 Favored Glycine 0 N--CA 1.491 2.335 0 N-CA-C 109.502 -1.439 . . . . 0.72999999999999998 109.502 -179.897 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' C' C ' 326' ' ' GLU . . . . . 0.51 ' HB3' ' CE2' ' C' ' 328' ' ' PHE . 13.5 mm-40 -58.11 166.78 1.46 Allowed 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.124 -1.221 . . . . 2.1699999999999999 109.398 -179.905 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' C' C ' 327' ' ' TYR . . . . . 0.466 ' CD2' ' O ' ' C' ' 325' ' ' GLY . 38.4 m-85 -147.22 99.09 3.11 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.184 -0.948 . . . . 0.47999999999999998 109.475 179.965 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' C' C ' 328' ' ' PHE . . . . . 0.51 ' CE2' ' HB3' ' C' ' 326' ' ' GLU . 95.0 m-85 -106.85 -167.03 1.23 Allowed 'General case' 0 N--CA 1.487 1.406 0 O-C-N 121.485 -0.759 . . . . 0.33000000000000002 109.055 179.914 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' C' C ' 329' ' ' THR . . . . . 0.413 ' HA ' ' O ' ' A' ' 330' ' ' LEU . 41.5 p -150.98 169.0 22.86 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.31 -0.869 . . . . 0.23000000000000001 109.353 179.967 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' C' C ' 330' ' ' LEU . . . . . 0.401 HD12 ' HA ' ' C' ' 330' ' ' LEU . 29.0 tp -148.72 127.52 12.58 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.214 -0.929 . . . . 0.28000000000000003 109.622 -179.853 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' C' C ' 331' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -87.62 111.64 21.47 Favored 'General case' 0 N--CA 1.489 1.479 0 O-C-N 121.308 -0.87 . . . . 1.48 109.367 179.806 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' C' C ' 332' ' ' ILE . . . . . 0.439 HD12 ' CD1' ' C' ' 338' ' ' PHE . 7.3 mt -103.9 108.04 23.67 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.448 0 O-C-N 121.183 -0.948 . . . . 0.23999999999999999 109.436 179.748 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' C' C ' 333' ' ' ARG . . . . . 0.468 ' NH1' ' HG2' ' C' ' 333' ' ' ARG . 0.0 OUTLIER -73.47 158.39 35.02 Favored 'General case' 0 C--N 1.303 -1.424 0 O-C-N 121.293 -0.879 . . . . 2.7400000000000002 108.871 179.516 . . . . . . . . 3 3 . 1 . 028 nuclear build full ' C' C ' 334' ' ' GLY . . . . . . . . . . . . . . . 74.04 125.94 0.13 Allowed Glycine 0 N--CA 1.491 2.303 0 N-CA-C 109.452 -1.459 . . . . 0.34999999999999998 109.452 -179.929 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' C' C ' 335' ' ' ARG . . . . . 0.521 ' HG3' ' NH1' ' C' ' 335' ' ' ARG . 0.0 OUTLIER -74.75 -33.32 62.31 Favored 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.117 -1.226 . . . . 2.5299999999999998 109.775 -179.861 . . . . . . . . 3 3 . 1 . 028 nuclear build full ' C' C ' 336' ' ' GLU . . . . . . . . . . . . . 1.3 mt-10 -57.49 -59.84 4.55 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.115 -0.991 . . . . 2.6200000000000001 109.678 -179.88 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' C' C ' 337' ' ' ARG . . . . . . . . . . . . . 1.7 mpt_? -61.16 -32.97 72.69 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.252 -0.905 . . . . 2.8100000000000001 109.982 -179.688 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' C' C ' 338' ' ' PHE . . . . . 0.439 ' CD1' HD12 ' C' ' 332' ' ' ILE . 63.7 t80 -55.49 -61.62 2.22 Favored 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.041 -1.037 . . . . 0.40000000000000002 109.615 -179.797 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' C' C ' 339' ' ' GLU . . . . . . . . . . . . . 1.1 mm-40 -49.38 -36.64 22.39 Favored 'General case' 0 C--N 1.3 -1.547 0 O-C-N 121.407 -0.808 . . . . 2.0499999999999998 110.358 -179.114 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' C' C ' 340' ' ' MET . . . . . . . . . . . . . 37.9 ttp -63.9 -48.5 76.37 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.036 -1.04 . . . . 0.32000000000000001 110.051 -179.212 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' C' C ' 341' ' ' PHE . . . . . . . . . . . . . 38.8 m-85 -61.37 -45.92 92.35 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 120.951 -1.093 . . . . 0.17999999999999999 109.539 -179.763 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' C' C ' 342' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -47.63 -38.42 14.67 Favored 'General case' 0 N--CA 1.489 1.491 0 O-C-N 121.252 -0.905 . . . . 2.9100000000000001 109.959 -179.804 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' C' C ' 343' ' ' GLU . . . . . . . . . . . . . 29.0 tp10 -59.04 -50.96 72.09 Favored 'General case' 0 N--CA 1.488 1.47 0 O-C-N 121.182 -0.949 . . . . 2.1400000000000001 109.598 -179.906 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' C' C ' 344' ' ' LEU . . . . . . . . . . . . . 70.8 mt -62.37 -31.55 72.22 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.364 -0.835 . . . . 0.22 109.56 179.931 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' C' C ' 345' ' ' ASN . . . . . . . . . . . . . 18.7 t-20 -57.07 -58.36 8.52 Favored 'General case' 0 N--CA 1.487 1.412 0 O-C-N 121.254 -0.904 . . . . 1.0800000000000001 109.564 179.928 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' C' C ' 346' ' ' GLU . . . . . . . . . . . . . 8.4 tm-20 -61.44 -27.87 68.87 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.46 -0.775 . . . . 2.21 110.028 -179.731 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' C' C ' 347' ' ' ALA . . . . . 0.652 ' HB1' ' HB1' ' D' ' 347' ' ' ALA . . . -62.93 -61.79 2.16 Favored 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.024 -1.048 . . . . 0.17999999999999999 110.16 -179.651 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' C' C ' 348' ' ' LEU . . . . . 0.567 ' N ' HD22 ' C' ' 348' ' ' LEU . 4.2 mm? -60.59 -42.87 97.62 Favored 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.209 -0.932 . . . . 0.32000000000000001 109.707 -179.72 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' C' C ' 349' ' ' GLU . . . . . . . . . . . . . 3.7 mm-40 -58.49 -35.98 73.06 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.11 -0.994 . . . . 2.1899999999999999 109.834 -179.729 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' C' C ' 350' ' ' LEU . . . . . 0.626 ' CD2' HD13 ' D' ' 350' ' ' LEU . 4.1 tt -65.16 -39.59 93.18 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.048 -1.033 . . . . 0.46000000000000002 109.043 179.766 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' C' C ' 351' ' ' LYS . . . . . . . . . . . . . 4.1 tttm -59.25 -40.82 87.19 Favored 'General case' 0 N--CA 1.488 1.452 0 O-C-N 121.394 -0.816 . . . . 1.3500000000000001 109.108 179.914 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' C' C ' 352' ' ' ASP . . . . . . . . . . . . . 41.8 m-20 -57.73 -48.91 78.25 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.41 -0.806 . . . . 1.1899999999999999 109.519 -179.996 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' C' C ' 353' ' ' ALA . . . . . . . . . . . . . . . -67.61 -16.01 63.95 Favored 'General case' 0 N--CA 1.487 1.42 0 O-C-N 121.42 -0.8 . . . . 0.56999999999999995 109.537 -179.873 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' C' C ' 354' ' ' GLN . . . . . 0.409 ' O ' ' HG2' ' C' ' 354' ' ' GLN . 41.8 tt0 -84.78 -13.72 50.32 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 120.945 -1.097 . . . . 1.47 109.664 179.938 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' C' C ' 355' ' ' ALA . . . . . . . . . . . . . . . -73.33 -11.21 60.41 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.284 -0.885 . . . . 0.93000000000000005 109.672 -179.871 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' C' C ' 356' ' ' GLY . . . . . . . . . . . . . . . -77.95 0.73 71.35 Favored Glycine 0 N--CA 1.491 2.32 0 N-CA-C 109.561 -1.415 . . . . 1.3300000000000001 109.561 -179.882 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' C' C ' 357' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -87.21 116.66 25.44 Favored 'General case' 0 N--CA 1.488 1.452 0 O-C-N 121.418 -1.048 . . . . 4.0099999999999998 109.34 -179.899 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' C' C ' 358' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -49.91 164.95 0.33 Allowed Pre-proline 0 C--N 1.302 -1.482 0 O-C-N 121.345 -0.847 . . . . 5.75 109.319 -179.996 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' C' C ' 359' ' ' PRO . . . . . . . . . . . . . 2.2 Cg_endo -62.08 -165.58 0.05 OUTLIER 'Trans proline' 0 C--N 1.307 -1.655 0 C-N-CA 122.098 1.865 . . . . 4.9400000000000004 109.959 179.808 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' C' C ' 360' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.24 0 CA-C-O 117.961 -1.466 . . . . 6.5 109.717 -179.905 . . . . . . . . 0 0 . 1 . 028 nuclear build full ' D' D ' 319' ' ' LYS . . . . . 0.428 ' O ' ' O ' ' D' ' 320' ' ' LYS . 2.9 mmtt . . . . . 0 N--CA 1.488 1.445 0 CA-C-O 121.275 0.559 . . . . 7.5300000000000002 109.533 . . . . . . . . . 1 1 . 1 . 028 nuclear build full ' D' D ' 320' ' ' LYS . . . . . 0.428 ' O ' ' O ' ' D' ' 319' ' ' LYS . 1.8 tptt 62.67 132.44 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.194 -0.942 . . . . 6.4100000000000001 109.465 179.956 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' D' D ' 321' ' ' LYS . . . . . . . . . . . . . 11.2 mttt -157.88 141.5 11.22 Favored Pre-proline 0 N--CA 1.492 1.637 0 O-C-N 121.319 -0.863 . . . . 6.1100000000000003 109.585 179.96 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' D' D ' 322' ' ' PRO . . . . . . . . . . . . . 1.8 Cg_endo -63.82 -80.34 0.01 OUTLIER 'Trans proline' 0 C--N 1.313 -1.296 0 C-N-CA 122.254 1.969 . . . . 2.8199999999999998 109.5 179.698 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' D' D ' 323' ' ' LEU . . . . . . . . . . . . . 24.1 mt -80.06 115.02 19.39 Favored 'General case' 0 N--CA 1.489 1.494 0 O-C-N 121.263 -0.898 . . . . 2.8300000000000001 109.001 179.797 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' D' D ' 324' ' ' ASP . . . . . . . . . . . . . 36.4 m-20 -80.05 146.77 31.78 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.167 -0.958 . . . . 1.54 109.418 179.97 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' D' D ' 325' ' ' GLY . . . . . . . . . . . . . . . -66.61 167.91 36.5 Favored Glycine 0 N--CA 1.489 2.212 0 N-CA-C 109.441 -1.464 . . . . 0.58999999999999997 109.441 179.89 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' D' D ' 326' ' ' GLU . . . . . . . . . . . . . 32.9 mm-40 -57.2 173.92 0.21 Allowed 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.21 -1.171 . . . . 2.1299999999999999 109.464 -179.813 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' D' D ' 327' ' ' TYR . . . . . . . . . . . . . 39.1 m-85 -148.45 110.67 4.63 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.187 -0.945 . . . . 0.46999999999999997 109.574 179.916 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' D' D ' 328' ' ' PHE . . . . . 0.404 ' CD1' ' N ' ' D' ' 328' ' ' PHE . 32.9 m-85 -114.06 -171.66 1.95 Allowed 'General case' 0 N--CA 1.488 1.437 0 O-C-N 121.297 -0.877 . . . . 0.29999999999999999 109.402 179.925 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' D' D ' 329' ' ' THR . . . . . . . . . . . . . 3.2 p -149.73 165.95 30.87 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.457 -0.777 . . . . 0.22 109.058 179.944 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' D' D ' 330' ' ' LEU . . . . . 0.418 ' O ' ' HA ' ' B' ' 329' ' ' THR . 63.0 tp -149.46 130.17 14.11 Favored 'General case' 0 C--N 1.303 -1.414 0 O-C-N 121.14 -0.975 . . . . 0.28000000000000003 109.783 -179.534 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' D' D ' 331' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -87.27 113.12 22.72 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.396 -0.815 . . . . 0.93000000000000005 109.302 179.838 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' D' D ' 332' ' ' ILE . . . . . 0.665 HG21 ' HA ' ' D' ' 338' ' ' PHE . 64.5 mt -101.89 106.09 19.11 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.41 0 O-C-N 121.15 -0.969 . . . . 0.25 109.467 -179.877 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' D' D ' 333' ' ' ARG . . . . . . . . . . . . . 72.6 mtt180 -71.74 142.54 49.77 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.476 -0.765 . . . . 2.9300000000000002 109.552 179.952 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' D' D ' 334' ' ' GLY . . . . . . . . . . . . . . . 86.76 127.71 2.3 Favored Glycine 0 N--CA 1.489 2.209 0 N-CA-C 109.56 -1.416 . . . . 0.40999999999999998 109.56 179.732 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' D' D ' 335' ' ' ARG . . . . . 0.442 ' HB2' ' CZ ' ' B' ' 328' ' ' PHE . 7.8 ttp180 -76.96 -33.66 57.65 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.129 -1.218 . . . . 3.0299999999999998 109.31 -179.938 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' D' D ' 336' ' ' GLU . . . . . . . . . . . . . 12.3 mt-10 -58.6 -63.06 1.42 Allowed 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.414 -0.804 . . . . 2.2599999999999998 110.093 -179.854 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' D' D ' 337' ' ' ARG . . . . . 0.456 ' CG ' ' NH1' ' D' ' 337' ' ' ARG . 0.0 OUTLIER -60.42 -29.25 68.87 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.085 -1.009 . . . . 2.9199999999999999 109.307 -179.868 . . . . . . . . 3 3 . 1 . 028 nuclear build full ' D' D ' 338' ' ' PHE . . . . . 0.665 ' HA ' HG21 ' D' ' 332' ' ' ILE . 66.6 t80 -55.83 -53.98 50.13 Favored 'General case' 0 N--CA 1.489 1.492 0 O-C-N 121.247 -0.908 . . . . 0.37 109.288 179.98 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' D' D ' 339' ' ' GLU . . . . . . . . . . . . . 53.4 mt-10 -53.94 -34.97 61.18 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.199 -0.938 . . . . 1.99 110.081 179.94 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' D' D ' 340' ' ' MET . . . . . . . . . . . . . 5.3 ttp -63.68 -52.75 59.26 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.258 -0.901 . . . . 0.31 110.263 -179.112 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' D' D ' 341' ' ' PHE . . . . . . . . . . . . . 50.5 m-85 -60.35 -42.86 96.6 Favored 'General case' 0 N--CA 1.496 1.827 0 O-C-N 121.087 -1.008 . . . . 0.17999999999999999 109.807 -179.656 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' D' D ' 342' ' ' ARG . . . . . . . . . . . . . 62.2 ttt180 -50.66 -43.27 57.32 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.369 -0.832 . . . . 2.4100000000000001 110.123 -179.844 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' D' D ' 343' ' ' GLU . . . . . . . . . . . . . 3.3 tt0 -59.68 -46.66 88.39 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.272 -0.893 . . . . 2.3500000000000001 109.851 -179.712 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' D' D ' 344' ' ' LEU . . . . . . . . . . . . . 43.4 mt -61.07 -39.24 89.12 Favored 'General case' 0 N--CA 1.489 1.525 0 O-C-N 121.207 -0.933 . . . . 0.19 110.004 -179.465 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' D' D ' 345' ' ' ASN . . . . . . . . . . . . . 61.8 t-20 -56.99 -48.95 77.22 Favored 'General case' 0 N--CA 1.488 1.438 0 O-C-N 121.177 -0.952 . . . . 1.0900000000000001 109.943 -179.768 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' D' D ' 346' ' ' GLU . . . . . . . . . . . . . 46.4 tt0 -61.15 -32.69 72.4 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 120.918 -1.114 . . . . 1.6899999999999999 110.037 -179.52 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' D' D ' 347' ' ' ALA . . . . . 0.652 ' HB1' ' HB1' ' C' ' 347' ' ' ALA . . . -60.12 -56.5 20.86 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.073 -1.017 . . . . 0.17999999999999999 110.104 -179.752 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' D' D ' 348' ' ' LEU . . . . . 0.642 HD22 ' N ' ' D' ' 348' ' ' LEU . 3.9 mm? -62.43 -40.35 96.28 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.141 -0.974 . . . . 0.31 109.881 -179.509 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' D' D ' 349' ' ' GLU . . . . . . . . . . . . . 10.3 mm-40 -57.3 -39.74 76.39 Favored 'General case' 0 N--CA 1.495 1.777 0 O-C-N 121.304 -0.872 . . . . 1.95 109.858 -179.568 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' D' D ' 350' ' ' LEU . . . . . 0.626 HD13 ' CD2' ' C' ' 350' ' ' LEU . 7.9 tt -61.89 -45.71 92.56 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.285 -0.885 . . . . 0.42999999999999999 109.317 179.936 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' D' D ' 351' ' ' LYS . . . . . . . . . . . . . 34.4 tttt -58.05 -42.95 86.5 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.418 -0.802 . . . . 1.3999999999999999 109.453 179.851 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' D' D ' 352' ' ' ASP . . . . . . . . . . . . . 8.0 m-20 -57.01 -54.88 41.69 Favored 'General case' 0 N--CA 1.488 1.448 0 O-C-N 121.262 -0.899 . . . . 1.1699999999999999 109.473 -179.993 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' D' D ' 353' ' ' ALA . . . . . . . . . . . . . . . -69.2 -12.36 61.61 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.326 -0.859 . . . . 0.58999999999999997 109.705 179.923 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' D' D ' 354' ' ' GLN . . . . . . . . . . . . . 13.5 tt0 -83.85 -13.42 53.7 Favored 'General case' 0 N--CA 1.488 1.472 0 O-C-N 121.161 -0.962 . . . . 1.4399999999999999 109.802 -179.918 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' D' D ' 355' ' ' ALA . . . . . . . . . . . . . . . -73.8 -10.05 59.28 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.125 -0.984 . . . . 0.97999999999999998 109.62 179.842 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' D' D ' 356' ' ' GLY . . . . . . . . . . . . . . . -80.49 -3.36 90.04 Favored Glycine 0 N--CA 1.49 2.234 0 N-CA-C 109.428 -1.469 . . . . 1.28 109.428 -179.778 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' D' D ' 357' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -87.0 100.14 12.4 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.368 -1.077 . . . . 4.0899999999999999 109.37 179.984 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' D' D ' 358' ' ' GLU . . . . . 0.452 ' HB2' ' HD2' ' D' ' 359' ' ' PRO . 27.3 pt-20 -50.5 157.32 1.28 Allowed Pre-proline 0 N--CA 1.49 1.566 0 O-C-N 121.162 -0.961 . . . . 5.71 109.465 -179.997 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' D' D ' 359' ' ' PRO . . . . . 0.452 ' HD2' ' HB2' ' D' ' 358' ' ' GLU . 3.1 Cg_exo -60.74 85.52 0.08 OUTLIER 'Trans proline' 0 C--N 1.31 -1.498 0 C-N-CA 122.122 1.882 . . . . 4.9699999999999998 110.102 179.802 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' D' D ' 360' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.488 2.155 0 N-CA-C 109.249 -1.541 . . . . 6.9699999999999998 109.249 179.959 . . . . . . . . 0 0 . 1 . 029 nuclear build full ' A' A ' 319' ' ' LYS . . . . . . . . . . . . . 7.9 tttt . . . . . 0 N--CA 1.492 1.647 0 N-CA-C 109.446 -0.576 . . . . 7.5499999999999998 109.446 . . . . . . . . . 0 0 . 1 . 029 nuclear build full ' A' A ' 320' ' ' LYS . . . . . . . . . . . . . 11.1 mttt 58.51 -159.69 0.28 Allowed 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.205 -0.934 . . . . 6.4299999999999997 109.599 -179.916 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 321' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -158.63 110.77 1.64 Allowed Pre-proline 0 N--CA 1.49 1.566 0 O-C-N 121.293 -0.88 . . . . 6.1299999999999999 109.391 -179.891 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 322' ' ' PRO . . . . . . . . . . . . . 6.1 Cg_exo -57.85 179.38 0.15 Allowed 'Trans proline' 0 C--N 1.311 -1.43 0 C-N-CA 121.778 1.652 . . . . 2.8300000000000001 109.991 179.68 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 323' ' ' LEU . . . . . . . . . . . . . 21.0 mt -80.17 118.96 22.32 Favored 'General case' 0 N--CA 1.489 1.488 0 O-C-N 121.209 -0.932 . . . . 2.8300000000000001 109.624 -179.78 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 324' ' ' ASP . . . . . . . . . . . . . 31.2 m-20 -78.8 -168.36 1.4 Allowed 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.272 -0.892 . . . . 1.53 109.081 179.814 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 325' ' ' GLY . . . . . . . . . . . . . . . -68.73 175.68 30.15 Favored Glycine 0 N--CA 1.49 2.245 0 N-CA-C 109.494 -1.442 . . . . 0.60999999999999999 109.494 -179.931 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 326' ' ' GLU . . . . . . . . . . . . . 2.4 mt-10 -56.89 -174.54 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.216 -1.167 . . . . 2.1299999999999999 109.151 179.93 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 327' ' ' TYR . . . . . 0.554 ' CE1' ' HG2' ' C' ' 333' ' ' ARG . 46.3 m-85 -150.29 108.56 3.77 Favored 'General case' 0 N--CA 1.488 1.463 0 O-C-N 121.152 -0.967 . . . . 0.47999999999999998 109.788 -179.888 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 328' ' ' PHE . . . . . 0.469 ' CZ ' ' HG3' ' C' ' 335' ' ' ARG . 86.6 m-85 -108.45 -161.86 0.79 Allowed 'General case' 0 N--CA 1.488 1.47 0 O-C-N 121.308 -0.87 . . . . 0.31 109.377 179.936 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 329' ' ' THR . . . . . 0.442 HG23 ' O ' ' A' ' 328' ' ' PHE . 24.2 p -155.27 167.69 29.53 Favored 'General case' 0 N--CA 1.488 1.469 0 O-C-N 121.272 -0.892 . . . . 0.22 109.193 179.913 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 330' ' ' LEU . . . . . 0.426 ' O ' ' HA ' ' C' ' 329' ' ' THR . 24.4 tp -150.06 125.4 10.15 Favored 'General case' 0 N--CA 1.489 1.486 0 O-C-N 121.212 -0.93 . . . . 0.28000000000000003 109.594 -179.924 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 331' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -87.01 115.69 24.56 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.316 -0.865 . . . . 0.91000000000000003 109.209 179.857 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 332' ' ' ILE . . . . . 0.719 HG21 ' HA ' ' A' ' 338' ' ' PHE . 68.6 mt -103.61 113.98 41.96 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.511 0 O-C-N 121.217 -0.927 . . . . 0.26000000000000001 109.588 -179.871 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 333' ' ' ARG . . . . . 0.416 ' HG2' ' CE1' ' C' ' 327' ' ' TYR . 31.6 mtt180 -72.74 151.84 41.94 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.313 -0.867 . . . . 2.9199999999999999 109.404 179.9 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 334' ' ' GLY . . . . . . . . . . . . . . . 73.92 131.47 0.21 Allowed Glycine 0 N--CA 1.492 2.374 0 N-CA-C 109.589 -1.404 . . . . 0.40000000000000002 109.589 -179.967 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 335' ' ' ARG . . . . . 0.429 ' HA ' ' CE1' ' C' ' 328' ' ' PHE . 0.1 OUTLIER -77.59 -35.29 53.06 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.283 -1.128 . . . . 3.0099999999999998 109.463 -179.994 . . . . . . . . 3 3 . 1 . 029 nuclear build full ' A' A ' 336' ' ' GLU . . . . . . . . . . . . . 45.3 mt-10 -57.59 -61.5 2.46 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.259 -0.901 . . . . 2.29 109.723 -179.843 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 337' ' ' ARG . . . . . 0.917 ' CZ ' HD12 ' C' ' 348' ' ' LEU . 1.9 mtp180 -60.07 -31.35 69.91 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.273 -0.892 . . . . 2.9300000000000002 109.571 -179.877 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 338' ' ' PHE . . . . . 0.719 ' HA ' HG21 ' A' ' 332' ' ' ILE . 44.5 t80 -54.89 -61.1 2.53 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.297 -0.877 . . . . 0.38 109.284 179.835 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 339' ' ' GLU . . . . . . . . . . . . . 93.4 mt-10 -51.43 -27.8 11.23 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.273 -0.892 . . . . 1.97 109.586 -179.941 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 340' ' ' MET . . . . . 0.411 ' HB3' ' O ' ' A' ' 337' ' ' ARG . 26.9 ttp -64.74 -54.26 34.29 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.241 -0.912 . . . . 0.31 109.716 -179.903 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 341' ' ' PHE . . . . . 0.432 ' HB2' HD13 ' A' ' 332' ' ' ILE . 47.5 m-85 -61.79 -41.77 98.15 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.24 -0.912 . . . . 0.17999999999999999 109.656 -179.746 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 342' ' ' ARG . . . . . . . . . . . . . 4.4 ttt180 -49.2 -42.2 39.44 Favored 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.3 -0.875 . . . . 2.4199999999999999 109.524 179.988 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 343' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -59.2 -46.66 87.85 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.175 -0.953 . . . . 2.3500000000000001 109.735 -179.835 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 344' ' ' LEU . . . . . . . . . . . . . 36.6 mt -61.85 -31.82 72.11 Favored 'General case' 0 N--CA 1.489 1.486 0 O-C-N 121.144 -0.972 . . . . 0.17999999999999999 109.559 -179.91 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 345' ' ' ASN . . . . . . . . . . . . . 26.5 t-20 -57.95 -57.31 13.37 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.231 -0.918 . . . . 1.0900000000000001 109.683 -179.867 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 346' ' ' GLU . . . . . . . . . . . . . 20.3 tt0 -60.66 -28.32 68.5 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.306 -0.871 . . . . 1.6499999999999999 109.912 -179.571 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 347' ' ' ALA . . . . . 0.726 ' HB1' ' HB1' ' B' ' 347' ' ' ALA . . . -60.47 -58.95 6.32 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.225 -0.922 . . . . 0.17999999999999999 109.933 -179.805 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 348' ' ' LEU . . . . . 0.621 HD22 ' N ' ' A' ' 348' ' ' LEU . 4.0 mm? -62.23 -46.83 87.12 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.196 -0.94 . . . . 0.29999999999999999 110.007 -179.482 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 349' ' ' GLU . . . . . . . . . . . . . 2.3 mt-10 -58.21 -29.05 65.37 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.22 -0.925 . . . . 1.9399999999999999 109.965 -179.459 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 350' ' ' LEU . . . . . 0.787 ' CD1' HD22 ' B' ' 350' ' ' LEU . 3.4 tt -64.17 -50.93 66.2 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.118 -0.989 . . . . 0.46000000000000002 109.22 179.957 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 351' ' ' LYS . . . . . . . . . . . . . 24.7 tttt -60.03 -38.54 83.03 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.372 -0.83 . . . . 1.3999999999999999 109.375 179.965 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 352' ' ' ASP . . . . . 0.43 ' OD1' ' NH2' ' C' ' 337' ' ' ARG . 16.9 m-20 -56.95 -44.78 82.91 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.206 -0.934 . . . . 1.1599999999999999 109.756 179.997 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 353' ' ' ALA . . . . . . . . . . . . . . . -67.01 -20.1 65.81 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.29 -0.881 . . . . 0.63 109.798 -179.624 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 354' ' ' GLN . . . . . . . . . . . . . 1.5 mt-30 -84.02 -12.97 54.39 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.06 -1.025 . . . . 1.47 109.561 -179.999 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 355' ' ' ALA . . . . . . . . . . . . . . . -72.6 -7.65 51.28 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.213 -0.929 . . . . 1.01 109.591 179.951 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 356' ' ' GLY . . . . . . . . . . . . . . . -79.94 3.93 68.26 Favored Glycine 0 N--CA 1.49 2.266 0 N-CA-C 109.767 -1.333 . . . . 1.3 109.767 -179.86 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 357' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -86.94 105.58 17.2 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.12 -1.223 . . . . 4.0999999999999996 109.536 -179.869 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 358' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -49.16 160.9 0.48 Allowed Pre-proline 0 N--CA 1.49 1.55 0 O-C-N 121.196 -0.94 . . . . 5.75 109.264 179.819 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 359' ' ' PRO . . . . . . . . . . . . . 3.7 Cg_exo -60.64 165.53 11.42 Favored 'Trans proline' 0 C--N 1.308 -1.581 0 C-N-CA 122.122 1.882 . . . . 5.0 109.963 179.782 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 360' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.264 0 CA-C-O 118.049 -1.417 . . . . 6.9699999999999998 109.576 -179.908 . . . . . . . . 0 0 . 1 . 029 nuclear build full ' B' B ' 319' ' ' LYS . . . . . . . . . . . . . 8.6 tttt . . . . . 0 N--CA 1.49 1.529 0 N-CA-C 109.455 -0.572 . . . . 7.5499999999999998 109.455 . . . . . . . . . 0 0 . 1 . 029 nuclear build full ' B' B ' 320' ' ' LYS . . . . . . . . . . . . . 11.2 mttt 58.49 -159.85 0.27 Allowed 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.185 -0.947 . . . . 6.4400000000000004 109.469 179.982 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' B' B ' 321' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -158.38 111.1 1.69 Allowed Pre-proline 0 N--CA 1.489 1.488 0 O-C-N 121.201 -0.937 . . . . 6.1299999999999999 109.537 -179.948 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' B' B ' 322' ' ' PRO . . . . . . . . . . . . . 6.2 Cg_exo -58.12 178.99 0.18 Allowed 'Trans proline' 0 C--N 1.31 -1.473 0 C-N-CA 121.849 1.699 . . . . 2.8199999999999998 109.893 179.791 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' B' B ' 323' ' ' LEU . . . . . . . . . . . . . 21.1 mt -79.76 118.74 21.83 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.124 -0.985 . . . . 2.8399999999999999 109.736 -179.802 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' B' B ' 324' ' ' ASP . . . . . . . . . . . . . 31.0 m-20 -78.61 -169.27 1.65 Allowed 'General case' 0 N--CA 1.488 1.474 0 O-C-N 121.272 -0.892 . . . . 1.53 109.172 179.782 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' B' B ' 325' ' ' GLY . . . . . . . . . . . . . . . -67.75 175.19 27.24 Favored Glycine 0 N--CA 1.489 2.206 0 N-CA-C 109.631 -1.388 . . . . 0.58999999999999997 109.631 179.956 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' B' B ' 326' ' ' GLU . . . . . . . . . . . . . 2.4 mt-10 -56.63 -174.66 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.188 -1.184 . . . . 2.1299999999999999 109.158 179.941 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' B' B ' 327' ' ' TYR . . . . . 0.442 ' CE1' ' HG2' ' D' ' 333' ' ' ARG . 46.9 m-85 -150.24 108.55 3.77 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.163 -0.96 . . . . 0.47999999999999998 109.815 -179.902 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' B' B ' 328' ' ' PHE . . . . . 0.438 ' O ' HG23 ' B' ' 329' ' ' THR . 86.5 m-85 -108.45 -162.18 0.81 Allowed 'General case' 0 N--CA 1.489 1.48 0 O-C-N 121.267 -0.895 . . . . 0.32000000000000001 109.404 179.817 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' B' B ' 329' ' ' THR . . . . . 0.438 HG23 ' O ' ' B' ' 328' ' ' PHE . 24.2 p -155.11 167.52 30.09 Favored 'General case' 0 N--CA 1.489 1.491 0 O-C-N 121.27 -0.893 . . . . 0.23000000000000001 109.283 179.795 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' B' B ' 330' ' ' LEU . . . . . 0.467 ' O ' ' HA ' ' D' ' 329' ' ' THR . 24.3 tp -149.79 125.74 10.55 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.171 -0.955 . . . . 0.28000000000000003 109.531 -179.846 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' B' B ' 331' ' ' GLN . . . . . . . . . . . . . 1.3 tt0 -87.28 115.6 24.79 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.256 -0.902 . . . . 0.91000000000000003 109.289 179.832 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' B' B ' 332' ' ' ILE . . . . . 0.746 HG21 ' HA ' ' B' ' 338' ' ' PHE . 68.4 mt -103.47 114.47 43.17 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.521 0 O-C-N 121.136 -0.978 . . . . 0.23999999999999999 109.644 -179.971 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' B' B ' 333' ' ' ARG . . . . . 0.472 ' HG2' ' CE1' ' D' ' 327' ' ' TYR . 32.6 mtt180 -73.15 151.86 41.38 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.253 -0.904 . . . . 2.9300000000000002 109.429 179.887 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' B' B ' 334' ' ' GLY . . . . . . . . . . . . . . . 73.88 131.2 0.2 Allowed Glycine 0 N--CA 1.491 2.327 0 N-CA-C 109.523 -1.431 . . . . 0.40000000000000002 109.523 179.959 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' B' B ' 335' ' ' ARG . . . . . 0.423 ' HA ' ' CE1' ' D' ' 328' ' ' PHE . 0.1 OUTLIER -77.36 -35.34 54.62 Favored 'General case' 0 N--CA 1.488 1.47 0 O-C-N 121.294 -1.121 . . . . 3.0099999999999998 109.477 -179.979 . . . . . . . . 3 3 . 1 . 029 nuclear build full ' B' B ' 336' ' ' GLU . . . . . . . . . . . . . 46.3 mt-10 -57.22 -61.79 2.22 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.295 -0.878 . . . . 2.2799999999999998 109.656 -179.926 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' B' B ' 337' ' ' ARG . . . . . 0.487 ' NH2' HD12 ' D' ' 348' ' ' LEU . 1.9 mtp180 -60.14 -30.99 69.67 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.249 -0.907 . . . . 2.9300000000000002 109.611 -179.698 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' B' B ' 338' ' ' PHE . . . . . 0.746 ' HA ' HG21 ' B' ' 332' ' ' ILE . 44.8 t80 -55.21 -60.94 2.7 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.235 -0.916 . . . . 0.37 109.293 179.872 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' B' B ' 339' ' ' GLU . . . . . . . . . . . . . 93.4 mt-10 -51.4 -27.81 11.06 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.271 -0.893 . . . . 1.98 109.483 179.952 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' B' B ' 340' ' ' MET . . . . . 0.409 ' HB3' ' O ' ' B' ' 337' ' ' ARG . 27.4 ttp -64.75 -54.21 34.91 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.351 -0.843 . . . . 0.32000000000000001 109.698 -179.852 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' B' B ' 341' ' ' PHE . . . . . 0.427 ' HB2' HD13 ' B' ' 332' ' ' ILE . 46.9 m-85 -61.79 -42.07 98.53 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.317 -0.865 . . . . 0.17999999999999999 109.656 -179.69 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' B' B ' 342' ' ' ARG . . . . . . . . . . . . . 4.3 ttt180 -49.01 -42.12 36.91 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.219 -0.926 . . . . 2.4199999999999999 109.552 -179.95 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' B' B ' 343' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -59.24 -46.63 87.96 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.278 -0.889 . . . . 2.3500000000000001 109.681 -179.797 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' B' B ' 344' ' ' LEU . . . . . . . . . . . . . 36.2 mt -61.87 -31.93 72.24 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.178 -0.951 . . . . 0.17999999999999999 109.559 -179.928 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' B' B ' 345' ' ' ASN . . . . . . . . . . . . . 27.1 t-20 -57.69 -57.67 11.7 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.326 -0.858 . . . . 1.0900000000000001 109.759 -179.909 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' B' B ' 346' ' ' GLU . . . . . . . . . . . . . 20.4 tt0 -60.36 -28.29 68.07 Favored 'General case' 0 N--CA 1.489 1.525 0 O-C-N 121.385 -0.822 . . . . 1.6599999999999999 109.916 -179.589 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' B' B ' 347' ' ' ALA . . . . . 0.726 ' HB1' ' HB1' ' A' ' 347' ' ' ALA . . . -60.7 -58.71 7.31 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.12 -0.988 . . . . 0.17000000000000001 109.894 -179.732 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' B' B ' 348' ' ' LEU . . . . . 0.626 HD22 ' N ' ' B' ' 348' ' ' LEU . 4.0 mm? -62.1 -47.2 85.67 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.23 -0.918 . . . . 0.28999999999999998 109.955 -179.563 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' B' B ' 349' ' ' GLU . . . . . . . . . . . . . 2.3 mt-10 -57.95 -29.05 64.87 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.233 -0.917 . . . . 1.95 109.967 -179.458 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' B' B ' 350' ' ' LEU . . . . . 0.787 HD22 ' CD1' ' A' ' 350' ' ' LEU . 3.5 tt -64.17 -51.11 65.38 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.15 -0.969 . . . . 0.45000000000000001 109.207 179.871 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' B' B ' 351' ' ' LYS . . . . . . . . . . . . . 24.1 tttt -59.81 -38.43 81.95 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.403 -0.811 . . . . 1.3799999999999999 109.41 -179.938 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' B' B ' 352' ' ' ASP . . . . . . . . . . . . . 18.1 m-20 -57.07 -44.88 83.51 Favored 'General case' 0 N--CA 1.491 1.625 0 O-C-N 121.334 -0.854 . . . . 1.1599999999999999 109.773 -179.971 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' B' B ' 353' ' ' ALA . . . . . . . . . . . . . . . -66.88 -19.9 65.82 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.208 -0.933 . . . . 0.60999999999999999 109.742 -179.572 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' B' B ' 354' ' ' GLN . . . . . . . . . . . . . 1.6 mt-30 -84.23 -13.11 53.53 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.215 -0.928 . . . . 1.45 109.527 -179.973 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' B' B ' 355' ' ' ALA . . . . . . . . . . . . . . . -72.76 -7.27 49.8 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.247 -0.908 . . . . 0.97999999999999998 109.63 179.967 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' B' B ' 356' ' ' GLY . . . . . . . . . . . . . . . -80.14 3.86 69.61 Favored Glycine 0 N--CA 1.491 2.333 0 N-CA-C 109.795 -1.322 . . . . 1.29 109.795 -179.92 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' B' B ' 357' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -87.07 105.63 17.3 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.213 -1.169 . . . . 4.0899999999999999 109.526 -179.869 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' B' B ' 358' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -49.33 161.03 0.49 Allowed Pre-proline 0 N--CA 1.489 1.489 0 O-C-N 121.203 -0.936 . . . . 5.7199999999999998 109.273 179.863 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' B' B ' 359' ' ' PRO . . . . . . . . . . . . . 4.1 Cg_exo -60.53 166.16 10.17 Favored 'Trans proline' 0 C--N 1.31 -1.49 0 C-N-CA 122.101 1.868 . . . . 4.9800000000000004 110.046 179.854 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' B' B ' 360' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.232 0 CA-C-O 118.005 -1.442 . . . . 6.9800000000000004 109.607 -179.993 . . . . . . . . 0 0 . 1 . 029 nuclear build full ' C' C ' 319' ' ' LYS . . . . . . . . . . . . . 63.0 mttt . . . . . 0 N--CA 1.49 1.566 0 N-CA-C 109.412 -0.588 . . . . 6.8200000000000003 109.412 . . . . . . . . . 0 0 . 1 . 029 nuclear build full ' C' C ' 320' ' ' LYS . . . . . 0.434 ' HB3' ' HD3' ' C' ' 322' ' ' PRO . 0.0 OUTLIER 57.35 -172.16 0.09 Allowed 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.161 -0.962 . . . . 6.4900000000000002 108.996 -179.74 . . . . . . . . 3 3 . 1 . 029 nuclear build full ' C' C ' 321' ' ' LYS . . . . . 0.484 ' N ' ' HD3' ' C' ' 322' ' ' PRO . 0.0 OUTLIER -158.62 62.3 2.2 Favored Pre-proline 0 N--CA 1.49 1.533 0 O-C-N 121.018 -1.051 . . . . 6.4000000000000004 110.043 -179.9 . . . . . . . . 3 3 . 1 . 029 nuclear build full ' C' C ' 322' ' ' PRO . . . . . 0.484 ' HD3' ' N ' ' C' ' 321' ' ' LYS . 1.7 Cg_endo -62.73 -82.08 0.01 OUTLIER 'Trans proline' 0 C--N 1.309 -1.511 0 C-N-CA 122.051 1.834 . . . . 3.4199999999999999 110.029 179.745 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' C' C ' 323' ' ' LEU . . . . . 0.452 HD23 ' HA ' ' C' ' 323' ' ' LEU . 44.7 mt -83.99 98.12 9.64 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.095 -1.003 . . . . 3.9500000000000002 109.485 179.762 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' C' C ' 324' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -82.09 149.63 27.92 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.185 -0.947 . . . . 1.6299999999999999 109.677 -179.847 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' C' C ' 325' ' ' GLY . . . . . 0.534 ' O ' ' CE2' ' C' ' 327' ' ' TYR . . . -69.26 169.97 42.59 Favored Glycine 0 N--CA 1.49 2.285 0 N-CA-C 109.416 -1.474 . . . . 0.72999999999999998 109.416 179.718 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' C' C ' 326' ' ' GLU . . . . . . . . . . . . . 80.2 mm-40 -56.49 178.31 0.05 Allowed 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.171 -1.193 . . . . 2.1699999999999999 109.146 179.901 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' C' C ' 327' ' ' TYR . . . . . 0.534 ' CE2' ' O ' ' C' ' 325' ' ' GLY . 55.5 m-85 -149.57 107.14 3.65 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.058 -1.026 . . . . 0.47999999999999998 109.816 -179.744 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' C' C ' 328' ' ' PHE . . . . . 0.441 ' O ' HG23 ' C' ' 329' ' ' THR . 80.8 m-85 -107.16 -162.86 0.87 Allowed 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.126 -0.984 . . . . 0.33000000000000002 109.36 179.663 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' C' C ' 329' ' ' THR . . . . . 0.441 HG23 ' O ' ' C' ' 328' ' ' PHE . 34.0 p -155.23 163.31 40.35 Favored 'General case' 0 N--CA 1.489 1.497 0 O-C-N 121.272 -0.892 . . . . 0.23000000000000001 109.259 179.915 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' C' C ' 330' ' ' LEU . . . . . . . . . . . . . 48.5 tp -149.55 128.56 12.67 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.235 -0.916 . . . . 0.28000000000000003 109.555 -179.767 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' C' C ' 331' ' ' GLN . . . . . . . . . . . . . 1.1 tt0 -86.29 117.72 25.28 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.231 -0.918 . . . . 1.48 109.251 179.881 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' C' C ' 332' ' ' ILE . . . . . 0.708 HG21 ' HA ' ' C' ' 338' ' ' PHE . 40.6 mt -103.38 112.36 36.57 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.557 0 O-C-N 121.244 -0.91 . . . . 0.23999999999999999 109.714 -179.805 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' C' C ' 333' ' ' ARG . . . . . 0.554 ' HG2' ' CE1' ' A' ' 327' ' ' TYR . 0.1 OUTLIER -74.25 136.34 42.69 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.303 -0.873 . . . . 2.7400000000000002 109.546 179.847 . . . . . . . . 3 3 . 1 . 029 nuclear build full ' C' C ' 334' ' ' GLY . . . . . . . . . . . . . . . 87.52 132.81 3.79 Favored Glycine 0 N--CA 1.492 2.388 0 N-CA-C 109.741 -1.344 . . . . 0.34999999999999998 109.741 179.692 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' C' C ' 335' ' ' ARG . . . . . 0.469 ' HG3' ' CZ ' ' A' ' 328' ' ' PHE . 1.8 tmm_? -80.43 -38.06 30.84 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.292 -1.122 . . . . 2.5299999999999998 109.724 -179.971 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' C' C ' 336' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -56.44 -58.22 8.95 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.13 -0.981 . . . . 2.6200000000000001 109.67 -179.831 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' C' C ' 337' ' ' ARG . . . . . 0.43 ' NH2' ' OD1' ' A' ' 352' ' ' ASP . 0.4 OUTLIER -60.63 -30.14 69.68 Favored 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.28 -0.887 . . . . 2.8100000000000001 109.657 -179.803 . . . . . . . . 3 3 . 1 . 029 nuclear build full ' C' C ' 338' ' ' PHE . . . . . 0.708 ' HA ' HG21 ' C' ' 332' ' ' ILE . 61.1 t80 -56.01 -55.91 27.06 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.152 -0.968 . . . . 0.40000000000000002 109.87 -179.841 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' C' C ' 339' ' ' GLU . . . . . . . . . . . . . 5.1 mt-10 -50.16 -34.14 21.39 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.11 -0.994 . . . . 2.0499999999999998 109.887 -179.735 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' C' C ' 340' ' ' MET . . . . . . . . . . . . . 3.5 ttt -62.98 -50.2 71.7 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.118 -0.989 . . . . 0.32000000000000001 109.889 -179.702 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' C' C ' 341' ' ' PHE . . . . . . . . . . . . . 37.1 m-85 -62.14 -49.62 75.15 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.087 -1.008 . . . . 0.17999999999999999 110.113 -179.664 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' C' C ' 342' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -47.86 -38.71 16.79 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.222 -0.924 . . . . 2.9100000000000001 110.011 -179.655 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' C' C ' 343' ' ' GLU . . . . . . . . . . . . . 2.5 tt0 -58.27 -49.47 77.03 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.143 -0.973 . . . . 2.1400000000000001 109.579 -179.823 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' C' C ' 344' ' ' LEU . . . . . 0.56 HD22 ' CD2' ' D' ' 344' ' ' LEU . 81.3 mt -63.52 -33.52 75.76 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.257 -0.902 . . . . 0.22 109.836 -179.971 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' C' C ' 345' ' ' ASN . . . . . 0.418 ' C ' ' OD1' ' C' ' 345' ' ' ASN . 16.6 t-20 -57.5 -58.76 6.86 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.192 -0.942 . . . . 1.0800000000000001 109.732 -179.791 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' C' C ' 346' ' ' GLU . . . . . . . . . . . . . 1.3 tt0 -60.46 -26.61 66.89 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.192 -0.943 . . . . 2.21 109.57 -179.603 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' C' C ' 347' ' ' ALA . . . . . 0.81 ' HB1' ' HB1' ' D' ' 347' ' ' ALA . . . -62.9 -56.69 15.0 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.185 -0.947 . . . . 0.17999999999999999 109.738 179.923 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' C' C ' 348' ' ' LEU . . . . . 0.917 HD12 ' CZ ' ' A' ' 337' ' ' ARG . 4.2 mm? -61.73 -47.97 82.82 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.245 -0.909 . . . . 0.32000000000000001 110.061 -179.672 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' C' C ' 349' ' ' GLU . . . . . . . . . . . . . 47.9 mm-40 -57.78 -34.6 69.75 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.25 -0.906 . . . . 2.1899999999999999 110.269 -179.229 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' C' C ' 350' ' ' LEU . . . . . 0.795 HD22 ' CD1' ' D' ' 350' ' ' LEU . 5.4 tt -63.98 -45.88 87.07 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.11 -0.994 . . . . 0.46000000000000002 109.221 -179.887 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' C' C ' 351' ' ' LYS . . . . . . . . . . . . . 12.7 tttp -60.15 -46.45 89.62 Favored 'General case' 0 N--CA 1.488 1.426 0 O-C-N 121.455 -0.778 . . . . 1.3500000000000001 109.381 179.892 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' C' C ' 352' ' ' ASP . . . . . . . . . . . . . 76.6 m-20 -57.7 -37.93 74.34 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.351 -0.843 . . . . 1.1899999999999999 109.565 -179.967 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' C' C ' 353' ' ' ALA . . . . . . . . . . . . . . . -67.67 -24.68 65.45 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.287 -0.883 . . . . 0.56999999999999995 109.767 -179.809 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' C' C ' 354' ' ' GLN . . . . . . . . . . . . . 29.6 mt-30 -80.43 -5.55 56.7 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.198 -0.939 . . . . 1.47 109.512 179.89 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' C' C ' 355' ' ' ALA . . . . . . . . . . . . . . . -71.06 -3.39 19.49 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.174 -0.954 . . . . 0.93000000000000005 109.794 179.992 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' C' C ' 356' ' ' GLY . . . . . . . . . . . . . . . -74.44 -45.0 25.49 Favored Glycine 0 N--CA 1.49 2.271 0 N-CA-C 109.643 -1.383 . . . . 1.3300000000000001 109.643 -179.821 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' C' C ' 357' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -86.95 119.96 27.71 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.25 -1.147 . . . . 4.0099999999999998 109.397 -179.98 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' C' C ' 358' ' ' GLU . . . . . 0.581 ' N ' ' HD2' ' C' ' 359' ' ' PRO . 7.8 tt0 -48.87 -52.22 48.14 Favored Pre-proline 0 N--CA 1.488 1.435 0 O-C-N 121.169 -0.957 . . . . 5.75 109.688 -179.953 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' C' C ' 359' ' ' PRO . . . . . 0.581 ' HD2' ' N ' ' C' ' 358' ' ' GLU . 1.9 Cg_endo -62.81 170.03 7.86 Favored 'Trans proline' 0 C--N 1.313 -1.296 0 C-N-CA 121.72 1.613 . . . . 4.9400000000000004 110.036 179.709 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' C' C ' 360' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.243 0 CA-C-O 117.916 -1.491 . . . . 6.5 109.621 179.983 . . . . . . . . 0 0 . 1 . 029 nuclear build full ' D' D ' 319' ' ' LYS . . . . . . . . . . . . . 8.2 tttt . . . . . 0 N--CA 1.491 1.6 0 N-CA-C 109.487 -0.56 . . . . 7.5300000000000002 109.487 . . . . . . . . . 0 0 . 1 . 029 nuclear build full ' D' D ' 320' ' ' LYS . . . . . . . . . . . . . 11.1 mttt 58.3 -159.21 0.28 Allowed 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.281 -0.887 . . . . 6.4100000000000001 109.398 -179.963 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' D' D ' 321' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -158.94 110.88 1.58 Allowed Pre-proline 0 N--CA 1.49 1.55 0 O-C-N 121.335 -0.853 . . . . 6.1100000000000003 109.536 -179.878 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' D' D ' 322' ' ' PRO . . . . . . . . . . . . . 6.2 Cg_exo -57.85 179.8 0.14 Allowed 'Trans proline' 0 C--N 1.312 -1.361 0 C-N-CA 121.828 1.686 . . . . 2.8199999999999998 110.049 179.759 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' D' D ' 323' ' ' LEU . . . . . . . . . . . . . 20.2 mt -80.3 118.77 22.25 Favored 'General case' 0 N--CA 1.489 1.499 0 O-C-N 121.125 -0.984 . . . . 2.8300000000000001 109.722 -179.811 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' D' D ' 324' ' ' ASP . . . . . . . . . . . . . 29.0 m-20 -78.46 -168.79 1.46 Allowed 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.298 -0.876 . . . . 1.54 109.274 179.738 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' D' D ' 325' ' ' GLY . . . . . . . . . . . . . . . -68.25 175.1 29.35 Favored Glycine 0 N--CA 1.49 2.245 0 N-CA-C 109.471 -1.452 . . . . 0.58999999999999997 109.471 179.969 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' D' D ' 326' ' ' GLU . . . . . . . . . . . . . 2.4 mt-10 -56.68 -174.79 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.181 -1.188 . . . . 2.1299999999999999 109.287 179.954 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' D' D ' 327' ' ' TYR . . . . . 0.472 ' CE1' ' HG2' ' B' ' 333' ' ' ARG . 47.2 m-85 -150.12 108.42 3.77 Favored 'General case' 0 N--CA 1.489 1.485 0 O-C-N 121.162 -0.961 . . . . 0.46999999999999997 109.818 -179.803 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' D' D ' 328' ' ' PHE . . . . . 0.457 ' O ' HG23 ' D' ' 329' ' ' THR . 87.4 m-85 -108.25 -161.96 0.8 Allowed 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.302 -0.874 . . . . 0.29999999999999999 109.433 179.771 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' D' D ' 329' ' ' THR . . . . . 0.467 ' HA ' ' O ' ' B' ' 330' ' ' LEU . 23.6 p -155.24 167.64 29.71 Favored 'General case' 0 N--CA 1.489 1.49 0 O-C-N 121.253 -0.905 . . . . 0.22 109.244 179.864 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' D' D ' 330' ' ' LEU . . . . . 0.436 ' O ' ' HA ' ' B' ' 329' ' ' THR . 24.0 tp -149.98 125.51 10.27 Favored 'General case' 0 N--CA 1.489 1.478 0 O-C-N 121.195 -0.941 . . . . 0.28000000000000003 109.605 -179.951 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' D' D ' 331' ' ' GLN . . . . . . . . . . . . . 1.3 tt0 -87.03 115.6 24.52 Favored 'General case' 0 N--CA 1.488 1.471 0 O-C-N 121.245 -0.909 . . . . 0.93000000000000005 109.23 179.837 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' D' D ' 332' ' ' ILE . . . . . 0.731 HG21 ' HA ' ' D' ' 338' ' ' PHE . 69.9 mt -103.55 114.24 42.59 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.507 0 O-C-N 121.177 -0.952 . . . . 0.25 109.537 -179.898 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' D' D ' 333' ' ' ARG . . . . . 0.442 ' HG2' ' CE1' ' B' ' 327' ' ' TYR . 32.9 mtt180 -72.83 151.98 41.76 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.321 -0.862 . . . . 2.9300000000000002 109.391 179.835 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' D' D ' 334' ' ' GLY . . . . . . . . . . . . . . . 73.64 131.38 0.19 Allowed Glycine 0 N--CA 1.491 2.33 0 N-CA-C 109.546 -1.422 . . . . 0.40999999999999998 109.546 179.902 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' D' D ' 335' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -77.45 -35.36 53.99 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.269 -1.136 . . . . 3.0299999999999998 109.453 -179.986 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' D' D ' 336' ' ' GLU . . . . . . . . . . . . . 47.8 mt-10 -57.33 -61.6 2.36 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.251 -0.906 . . . . 2.2599999999999998 109.647 -179.909 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' D' D ' 337' ' ' ARG . . . . . 0.495 ' NH2' HD12 ' B' ' 348' ' ' LEU . 1.9 mtp180 -60.18 -31.03 69.73 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.304 -0.873 . . . . 2.9199999999999999 109.64 -179.755 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' D' D ' 338' ' ' PHE . . . . . 0.731 ' HA ' HG21 ' D' ' 332' ' ' ILE . 45.2 t80 -55.18 -60.72 3.0 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.301 -0.874 . . . . 0.37 109.279 179.909 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' D' D ' 339' ' ' GLU . . . . . . . . . . . . . 92.9 mt-10 -51.62 -27.86 12.58 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.401 -0.812 . . . . 1.99 109.565 179.988 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' D' D ' 340' ' ' MET . . . . . 0.4 ' HB3' ' O ' ' D' ' 337' ' ' ARG . 28.0 ttp -64.73 -54.2 35.26 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.204 -0.935 . . . . 0.31 109.748 -179.953 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' D' D ' 341' ' ' PHE . . . . . 0.434 ' HB2' HD13 ' D' ' 332' ' ' ILE . 47.3 m-85 -61.78 -41.92 98.34 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.222 -0.924 . . . . 0.17999999999999999 109.713 -179.728 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' D' D ' 342' ' ' ARG . . . . . . . . . . . . . 4.5 ttt180 -49.25 -41.77 38.61 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.264 -0.898 . . . . 2.4100000000000001 109.563 -179.972 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' D' D ' 343' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -59.59 -46.64 88.34 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.361 -0.837 . . . . 2.3500000000000001 109.63 -179.839 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' D' D ' 344' ' ' LEU . . . . . 0.56 ' CD2' HD22 ' C' ' 344' ' ' LEU . 36.7 mt -61.99 -31.63 72.01 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.132 -0.98 . . . . 0.19 109.515 -179.939 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' D' D ' 345' ' ' ASN . . . . . . . . . . . . . 26.7 t-20 -58.07 -57.15 14.09 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.174 -0.954 . . . . 1.0900000000000001 109.736 -179.868 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' D' D ' 346' ' ' GLU . . . . . . . . . . . . . 19.3 tt0 -60.75 -28.28 68.58 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.358 -0.839 . . . . 1.6899999999999999 109.916 -179.542 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' D' D ' 347' ' ' ALA . . . . . 0.81 ' HB1' ' HB1' ' C' ' 347' ' ' ALA . . . -60.89 -58.56 7.91 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.189 -0.944 . . . . 0.17999999999999999 109.83 -179.71 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' D' D ' 348' ' ' LEU . . . . . 0.637 HD22 ' N ' ' D' ' 348' ' ' LEU . 4.0 mm? -62.22 -47.01 86.3 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.19 -0.944 . . . . 0.31 109.98 -179.514 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' D' D ' 349' ' ' GLU . . . . . . . . . . . . . 2.4 mt-10 -58.25 -29.03 65.44 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.168 -0.957 . . . . 1.95 110.04 -179.493 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' D' D ' 350' ' ' LEU . . . . . 0.795 ' CD1' HD22 ' C' ' 350' ' ' LEU . 3.5 tt -63.98 -50.87 66.86 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.141 -0.974 . . . . 0.42999999999999999 109.235 179.818 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' D' D ' 351' ' ' LYS . . . . . . . . . . . . . 24.2 tttt -59.94 -38.53 82.67 Favored 'General case' 0 N--CA 1.489 1.487 0 O-C-N 121.44 -0.787 . . . . 1.3999999999999999 109.47 179.915 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' D' D ' 352' ' ' ASP . . . . . . . . . . . . . 19.9 m-20 -57.19 -44.34 83.5 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.202 -0.936 . . . . 1.1699999999999999 109.797 -179.94 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' D' D ' 353' ' ' ALA . . . . . . . . . . . . . . . -67.26 -20.2 65.62 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.232 -0.917 . . . . 0.58999999999999997 109.743 -179.652 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' D' D ' 354' ' ' GLN . . . . . . . . . . . . . 6.9 mt-30 -84.08 -12.97 54.22 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.115 -0.991 . . . . 1.4399999999999999 109.554 -179.925 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' D' D ' 355' ' ' ALA . . . . . . . . . . . . . . . -72.99 -7.26 50.37 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.232 -0.917 . . . . 0.97999999999999998 109.61 179.925 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' D' D ' 356' ' ' GLY . . . . . . . . . . . . . . . -80.23 3.78 70.38 Favored Glycine 0 N--CA 1.491 2.349 0 N-CA-C 109.712 -1.355 . . . . 1.28 109.712 -179.888 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' D' D ' 357' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -87.0 105.71 17.33 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.244 -1.15 . . . . 4.0899999999999999 109.597 -179.884 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' D' D ' 358' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -49.2 161.12 0.47 Allowed Pre-proline 0 N--CA 1.49 1.555 0 O-C-N 121.265 -0.897 . . . . 5.71 109.273 179.949 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' D' D ' 359' ' ' PRO . . . . . . . . . . . . . 3.4 Cg_exo -60.61 166.19 10.26 Favored 'Trans proline' 0 C--N 1.31 -1.476 0 C-N-CA 122.15 1.9 . . . . 4.9699999999999998 109.959 179.771 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' D' D ' 360' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.294 0 CA-C-O 118.045 -1.42 . . . . 6.9699999999999998 109.557 179.956 . . . . . . . . 0 0 . 1 . 030 nuclear build full ' A' A ' 319' ' ' LYS . . . . . 0.414 ' O ' ' O ' ' A' ' 320' ' ' LYS . 26.7 mttp . . . . . 0 N--CA 1.49 1.528 0 N-CA-C 109.443 -0.576 . . . . 7.5499999999999998 109.443 . . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 320' ' ' LYS . . . . . 0.414 ' O ' ' O ' ' A' ' 319' ' ' LYS . 0.4 OUTLIER 62.63 121.85 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.241 -0.912 . . . . 6.4299999999999997 109.583 179.891 . . . . . . . . 3 3 . 1 . 030 nuclear build full ' A' A ' 321' ' ' LYS . . . . . 0.462 ' O ' ' CG ' ' A' ' 321' ' ' LYS . 0.0 OUTLIER -156.68 88.84 2.7 Favored Pre-proline 0 N--CA 1.49 1.535 0 N-CA-C 108.877 -0.786 . . . . 6.1299999999999999 108.877 179.812 . . . . . . . . 3 3 . 1 . 030 nuclear build full ' A' A ' 322' ' ' PRO . . . . . . . . . . . . . 3.5 Cg_exo -59.11 133.33 52.42 Favored 'Trans proline' 0 C--N 1.311 -1.412 0 C-N-CA 122.126 1.884 . . . . 2.8300000000000001 110.202 -179.448 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 323' ' ' LEU . . . . . . . . . . . . . 17.9 mt -80.51 124.94 29.36 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.326 -0.859 . . . . 2.8300000000000001 109.264 -179.859 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 324' ' ' ASP . . . . . . . . . . . . . 3.8 m-20 -80.19 104.46 10.76 Favored 'General case' 0 N--CA 1.488 1.446 0 C-N-CA 119.813 -0.755 . . . . 1.53 109.308 -179.931 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 325' ' ' GLY . . . . . 0.573 ' O ' ' CD2' ' A' ' 327' ' ' TYR . . . -68.84 -164.55 3.5 Favored Glycine 0 N--CA 1.49 2.239 0 N-CA-C 109.494 -1.443 . . . . 0.60999999999999999 109.494 -179.837 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 326' ' ' GLU . . . . . . . . . . . . . 8.6 mt-10 -59.73 165.21 3.18 Favored 'General case' 0 C--N 1.303 -1.446 0 O-C-N 121.316 -1.108 . . . . 2.1299999999999999 109.457 -179.744 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 327' ' ' TYR . . . . . 0.573 ' CD2' ' O ' ' A' ' 325' ' ' GLY . 44.9 m-85 -149.08 107.96 3.87 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.082 -1.011 . . . . 0.47999999999999998 109.885 -179.529 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 328' ' ' PHE . . . . . . . . . . . . . 18.4 m-85 -112.88 -166.72 1.1 Allowed 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.341 -0.849 . . . . 0.31 109.389 179.912 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 329' ' ' THR . . . . . . . . . . . . . 13.6 p -153.88 169.53 23.19 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.431 -0.793 . . . . 0.22 109.012 179.98 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 330' ' ' LEU . . . . . . . . . . . . . 18.2 tp -151.51 134.23 15.61 Favored 'General case' 0 C--N 1.302 -1.457 0 O-C-N 121.176 -0.952 . . . . 0.28000000000000003 109.561 179.758 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 331' ' ' GLN . . . . . . . . . . . . . 2.1 tp60 -86.66 114.19 23.16 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.204 -0.935 . . . . 0.91000000000000003 109.413 179.835 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 332' ' ' ILE . . . . . 0.907 HG21 ' HA ' ' A' ' 338' ' ' PHE . 64.0 mt -103.17 101.65 12.5 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.392 0 O-C-N 121.323 -0.861 . . . . 0.26000000000000001 109.331 179.835 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 333' ' ' ARG . . . . . . . . . . . . . 57.3 mtt180 -71.86 152.72 42.4 Favored 'General case' 0 N--CA 1.487 1.409 0 O-C-N 121.403 -0.81 . . . . 2.9199999999999999 109.829 -179.516 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 334' ' ' GLY . . . . . . . . . . . . . . . 76.27 131.36 0.39 Allowed Glycine 0 N--CA 1.489 2.224 0 N-CA-C 109.813 -1.315 . . . . 0.40000000000000002 109.813 179.974 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 335' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -74.61 -34.85 62.91 Favored 'General case' 0 N--CA 1.488 1.449 0 O-C-N 121.181 -1.188 . . . . 3.0099999999999998 109.743 -179.867 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 336' ' ' GLU . . . . . . . . . . . . . 15.1 mt-10 -58.82 -58.35 9.0 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.195 -0.941 . . . . 2.29 109.777 -179.864 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 337' ' ' ARG . . . . . 0.428 ' CZ ' HD12 ' C' ' 348' ' ' LEU . 5.8 mmt180 -60.73 -36.2 78.26 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.082 -1.011 . . . . 2.9300000000000002 109.754 -179.783 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 338' ' ' PHE . . . . . 0.907 ' HA ' HG21 ' A' ' 332' ' ' ILE . 59.7 t80 -53.89 -60.89 2.74 Favored 'General case' 0 C--N 1.302 -1.486 0 O-C-N 120.95 -1.094 . . . . 0.38 109.419 179.978 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 339' ' ' GLU . . . . . . . . . . . . . 73.8 mt-10 -49.44 -36.31 22.05 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.384 -0.823 . . . . 1.97 110.64 -179.432 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 340' ' ' MET . . . . . . . . . . . . . 48.2 ttp -63.28 -49.65 73.21 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 120.979 -1.076 . . . . 0.31 110.145 -179.417 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 341' ' ' PHE . . . . . . . . . . . . . 52.7 m-85 -62.52 -46.17 89.62 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.308 -0.87 . . . . 0.17999999999999999 109.636 -179.546 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 342' ' ' ARG . . . . . . . . . . . . . 12.6 ttp180 -47.43 -43.89 24.27 Favored 'General case' 0 N--CA 1.493 1.711 0 O-C-N 121.401 -0.812 . . . . 2.4199999999999999 109.928 -179.579 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 343' ' ' GLU . . . . . . . . . . . . . 29.1 tt0 -58.6 -48.51 80.71 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.372 -0.83 . . . . 2.3500000000000001 109.869 -179.517 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 344' ' ' LEU . . . . . 0.439 ' O ' ' HB3' ' A' ' 347' ' ' ALA . 55.3 mt -60.97 -30.79 70.47 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.196 -0.94 . . . . 0.17999999999999999 109.566 -179.671 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 345' ' ' ASN . . . . . . . . . . . . . 11.3 t-20 -57.8 -59.59 5.0 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.252 -0.905 . . . . 1.0900000000000001 109.635 -179.943 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 346' ' ' GLU . . . . . . . . . . . . . 79.4 tt0 -60.01 -24.78 64.76 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.148 -0.97 . . . . 1.6499999999999999 109.652 -179.767 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 347' ' ' ALA . . . . . 0.6 ' HB1' ' HB1' ' B' ' 347' ' ' ALA . . . -61.84 -61.61 2.38 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.376 -0.827 . . . . 0.17999999999999999 109.75 179.809 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 348' ' ' LEU . . . . . 0.621 HD22 ' N ' ' A' ' 348' ' ' LEU . 3.8 mm? -61.39 -46.67 89.19 Favored 'General case' 0 N--CA 1.495 1.812 0 O-C-N 121.31 -0.869 . . . . 0.29999999999999999 109.868 -179.604 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 349' ' ' GLU . . . . . . . . . . . . . 25.8 mm-40 -56.44 -34.0 66.4 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.235 -0.916 . . . . 1.9399999999999999 109.736 -179.456 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 350' ' ' LEU . . . . . 0.55 HD23 ' O ' ' A' ' 350' ' ' LEU . 5.8 tt -62.5 -47.03 85.76 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.197 -0.939 . . . . 0.46000000000000002 109.02 -179.936 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 351' ' ' LYS . . . . . . . . . . . . . 6.3 tttt -57.44 -43.36 83.83 Favored 'General case' 0 C--N 1.302 -1.489 0 O-C-N 121.329 -0.857 . . . . 1.3999999999999999 109.385 179.621 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 352' ' ' ASP . . . . . . . . . . . . . 23.1 m-20 -55.87 -40.1 72.46 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.275 -0.891 . . . . 1.1599999999999999 109.397 179.857 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 353' ' ' ALA . . . . . . . . . . . . . . . -69.01 -26.65 65.11 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.37 -0.831 . . . . 0.63 109.736 -179.901 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 354' ' ' GLN . . . . . . . . . . . . . 4.5 tt0 -80.57 -4.62 54.74 Favored 'General case' 0 N--CA 1.495 1.782 0 O-C-N 121.116 -0.99 . . . . 1.47 109.877 -179.893 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 355' ' ' ALA . . . . . . . . . . . . . . . -69.77 -89.42 0.02 OUTLIER 'General case' 0 N--CA 1.494 1.753 0 O-C-N 121.304 -0.873 . . . . 1.01 109.214 179.875 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 356' ' ' GLY . . . . . . . . . . . . . . . -67.47 103.72 1.01 Allowed Glycine 0 N--CA 1.488 2.121 0 N-CA-C 109.418 -1.473 . . . . 1.3 109.418 179.74 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 357' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -85.99 122.08 29.53 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.277 -1.131 . . . . 4.0999999999999996 109.536 -179.967 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 358' ' ' GLU . . . . . . . . . . . . . 6.5 mm-40 -49.15 118.03 7.23 Favored Pre-proline 0 N--CA 1.494 1.772 0 O-C-N 121.438 -0.789 . . . . 5.75 109.577 -179.83 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 359' ' ' PRO . . . . . . . . . . . . . 2.8 Cg_endo -61.85 145.28 97.16 Favored 'Trans proline' 0 C--N 1.313 -1.318 0 C-N-CA 121.98 1.787 . . . . 5.0 109.982 179.935 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 360' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.252 0 N-CA-C 109.532 -1.427 . . . . 6.9699999999999998 109.532 179.815 . . . . . . . . 0 0 . 1 . 030 nuclear build full ' B' B ' 319' ' ' LYS . . . . . . . . . . . . . 25.4 mttp . . . . . 0 N--CA 1.495 1.809 0 N-CA-C 109.149 -0.685 . . . . 7.5499999999999998 109.149 . . . . . . . . . 0 0 . 1 . 030 nuclear build full ' B' B ' 320' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER 63.74 119.22 0.02 OUTLIER 'General case' 0 C--N 1.3 -1.551 0 O-C-N 121.24 -0.912 . . . . 6.4400000000000004 109.734 179.783 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' B' B ' 321' ' ' LYS . . . . . 0.496 ' CD ' ' O ' ' B' ' 321' ' ' LYS . 0.0 OUTLIER -156.44 87.73 2.87 Favored Pre-proline 0 N--CA 1.489 1.5 0 O-C-N 121.355 -0.841 . . . . 6.1299999999999999 108.992 179.884 . . . . . . . . 3 3 . 1 . 030 nuclear build full ' B' B ' 322' ' ' PRO . . . . . . . . . . . . . 4.2 Cg_exo -58.83 134.22 58.96 Favored 'Trans proline' 0 C--N 1.31 -1.461 0 C-N-CA 122.151 1.901 . . . . 2.8199999999999998 110.335 -179.705 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' B' B ' 323' ' ' LEU . . . . . . . . . . . . . 17.2 mt -81.33 124.59 29.49 Favored 'General case' 0 C--N 1.301 -1.526 0 O-C-N 121.349 -0.844 . . . . 2.8399999999999999 109.332 -179.687 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' B' B ' 324' ' ' ASP . . . . . . . . . . . . . 2.9 m-20 -79.67 104.48 10.29 Favored 'General case' 0 N--CA 1.487 1.385 0 O-C-N 121.374 -0.829 . . . . 1.53 109.444 179.981 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' B' B ' 325' ' ' GLY . . . . . 0.567 ' O ' ' CD2' ' B' ' 327' ' ' TYR . . . -67.88 -165.24 2.97 Favored Glycine 0 N--CA 1.489 2.176 0 N-CA-C 109.404 -1.478 . . . . 0.58999999999999997 109.404 179.942 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' B' B ' 326' ' ' GLU . . . . . . . . . . . . . 6.2 mt-10 -59.23 165.84 2.46 Favored 'General case' 0 N--CA 1.489 1.48 0 O-C-N 121.218 -1.166 . . . . 2.1299999999999999 109.282 179.795 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' B' B ' 327' ' ' TYR . . . . . 0.567 ' CD2' ' O ' ' B' ' 325' ' ' GLY . 41.3 m-85 -149.37 108.94 3.99 Favored 'General case' 0 C--N 1.303 -1.429 0 O-C-N 121.324 -0.86 . . . . 0.47999999999999998 109.684 -179.843 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' B' B ' 328' ' ' PHE . . . . . . . . . . . . . 18.9 m-85 -113.0 -166.96 1.13 Allowed 'General case' 0 C--N 1.302 -1.476 0 O-C-N 121.273 -0.892 . . . . 0.32000000000000001 109.366 179.964 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' B' B ' 329' ' ' THR . . . . . . . . . . . . . 16.5 p -153.9 169.2 24.01 Favored 'General case' 0 N--CA 1.488 1.463 0 O-C-N 121.351 -0.843 . . . . 0.23000000000000001 108.994 179.611 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' B' B ' 330' ' ' LEU . . . . . 0.4 ' O ' ' HA ' ' D' ' 329' ' ' THR . 18.1 tp -151.53 134.42 15.73 Favored 'General case' 0 N--CA 1.491 1.625 0 O-C-N 121.334 -0.854 . . . . 0.28000000000000003 109.673 179.796 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' B' B ' 331' ' ' GLN . . . . . . . . . . . . . 2.1 tp60 -86.94 114.58 23.69 Favored 'General case' 0 C--N 1.302 -1.47 0 O-C-N 121.416 -0.803 . . . . 0.91000000000000003 109.66 179.672 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' B' B ' 332' ' ' ILE . . . . . 0.877 HG21 ' HA ' ' B' ' 338' ' ' PHE . 58.0 mt -103.03 101.93 12.89 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.458 0 O-C-N 121.245 -0.909 . . . . 0.23999999999999999 109.181 179.751 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' B' B ' 333' ' ' ARG . . . . . . . . . . . . . 54.7 mtt180 -72.1 152.14 42.56 Favored 'General case' 0 N--CA 1.488 1.456 0 O-C-N 121.259 -0.901 . . . . 2.9300000000000002 109.613 -179.71 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' B' B ' 334' ' ' GLY . . . . . . . . . . . . . . . 77.51 130.42 0.49 Allowed Glycine 0 N--CA 1.491 2.33 0 N-CA-C 109.795 -1.322 . . . . 0.40000000000000002 109.795 179.735 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' B' B ' 335' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -74.22 -34.56 63.73 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.165 -1.197 . . . . 3.0099999999999998 109.759 179.9 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' B' B ' 336' ' ' GLU . . . . . . . . . . . . . 11.4 mt-10 -59.22 -58.28 9.34 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.199 -0.938 . . . . 2.2799999999999998 109.688 -179.697 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' B' B ' 337' ' ' ARG . . . . . . . . . . . . . 5.1 mmt180 -60.81 -36.13 78.28 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.441 -0.787 . . . . 2.9300000000000002 109.655 -179.674 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' B' B ' 338' ' ' PHE . . . . . 0.877 ' HA ' HG21 ' B' ' 332' ' ' ILE . 62.7 t80 -54.23 -60.07 3.83 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.233 -0.917 . . . . 0.37 109.435 179.884 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' B' B ' 339' ' ' GLU . . . . . . . . . . . . . 80.8 mt-10 -49.9 -36.56 27.91 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.262 -0.899 . . . . 1.98 110.379 -179.64 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' B' B ' 340' ' ' MET . . . . . . . . . . . . . 47.9 ttp -63.38 -50.32 70.35 Favored 'General case' 0 N--CA 1.494 1.76 0 O-C-N 121.088 -1.008 . . . . 0.32000000000000001 110.278 -179.387 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' B' B ' 341' ' ' PHE . . . . . . . . . . . . . 54.5 m-85 -62.24 -45.72 92.05 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.128 -0.983 . . . . 0.17999999999999999 109.998 -179.707 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' B' B ' 342' ' ' ARG . . . . . . . . . . . . . 13.0 ttp180 -47.59 -43.75 25.81 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.329 -0.857 . . . . 2.4199999999999999 109.849 -179.931 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' B' B ' 343' ' ' GLU . . . . . . . . . . . . . 30.6 tt0 -58.84 -48.91 79.67 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.417 -0.802 . . . . 2.3500000000000001 109.68 -179.578 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' B' B ' 344' ' ' LEU . . . . . 0.408 ' O ' ' HB3' ' B' ' 347' ' ' ALA . 52.9 mt -60.97 -29.96 69.97 Favored 'General case' 0 N--CA 1.489 1.486 0 O-C-N 121.021 -1.049 . . . . 0.17999999999999999 109.576 -179.538 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' B' B ' 345' ' ' ASN . . . . . . . . . . . . . 11.2 t-20 -58.13 -59.99 4.44 Favored 'General case' 0 N--CA 1.489 1.493 0 O-C-N 121.248 -0.908 . . . . 1.0900000000000001 109.702 179.875 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' B' B ' 346' ' ' GLU . . . . . . . . . . . . . 86.1 tt0 -60.16 -24.14 64.5 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.253 -0.904 . . . . 1.6599999999999999 109.382 -179.724 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' B' B ' 347' ' ' ALA . . . . . 0.6 ' HB1' ' HB1' ' A' ' 347' ' ' ALA . . . -62.18 -61.8 2.21 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.147 -0.97 . . . . 0.17000000000000001 109.967 -179.829 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' B' B ' 348' ' ' LEU . . . . . 0.62 HD22 ' N ' ' B' ' 348' ' ' LEU . 3.8 mm? -61.26 -45.77 93.14 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.325 -0.86 . . . . 0.28999999999999998 109.824 -179.722 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' B' B ' 349' ' ' GLU . . . . . . . . . . . . . 27.6 mm-40 -56.68 -33.49 66.47 Favored 'General case' 0 N--CA 1.494 1.762 0 O-C-N 121.399 -0.813 . . . . 1.95 109.832 -179.399 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' B' B ' 350' ' ' LEU . . . . . 0.591 HD23 ' O ' ' B' ' 350' ' ' LEU . 5.7 tt -63.53 -46.75 84.59 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.381 -0.824 . . . . 0.45000000000000001 108.847 -179.943 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' B' B ' 351' ' ' LYS . . . . . . . . . . . . . 5.7 tttt -57.62 -44.04 85.25 Favored 'General case' 0 C--N 1.302 -1.481 0 O-C-N 121.449 -0.782 . . . . 1.3799999999999999 109.022 179.584 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' B' B ' 352' ' ' ASP . . . . . . . . . . . . . 25.2 m-20 -55.3 -39.55 70.05 Favored 'General case' 0 N--CA 1.488 1.456 0 O-C-N 121.389 -0.82 . . . . 1.1599999999999999 109.502 179.82 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' B' B ' 353' ' ' ALA . . . . . . . . . . . . . . . -69.53 -26.45 64.53 Favored 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.454 -0.779 . . . . 0.60999999999999999 109.889 -179.898 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' B' B ' 354' ' ' GLN . . . . . 0.501 ' OE1' HD11 ' A' ' 350' ' ' LEU . 4.3 tt0 -81.25 -3.94 53.96 Favored 'General case' 0 C--N 1.302 -1.479 0 O-C-N 120.954 -1.091 . . . . 1.45 109.798 -179.91 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' B' B ' 355' ' ' ALA . . . . . . . . . . . . . . . -68.95 -89.53 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.158 -0.963 . . . . 0.97999999999999998 109.533 179.965 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' B' B ' 356' ' ' GLY . . . . . . . . . . . . . . . -68.26 105.15 1.35 Allowed Glycine 0 N--CA 1.488 2.101 0 N-CA-C 109.394 -1.482 . . . . 1.29 109.394 179.997 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' B' B ' 357' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -86.5 122.93 31.12 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.19 -1.182 . . . . 4.0899999999999999 109.682 -179.896 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' B' B ' 358' ' ' GLU . . . . . . . . . . . . . 6.0 mm-40 -49.52 117.94 7.61 Favored Pre-proline 0 N--CA 1.491 1.607 0 O-C-N 121.336 -0.852 . . . . 5.7199999999999998 109.676 179.955 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' B' B ' 359' ' ' PRO . . . . . . . . . . . . . 2.6 Cg_endo -61.66 149.18 90.96 Favored 'Trans proline' 0 C--N 1.314 -1.277 0 C-N-CA 122.063 1.842 . . . . 4.9800000000000004 109.979 179.824 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' B' B ' 360' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.493 2.461 0 CA-C-O 117.945 -1.475 . . . . 6.9800000000000004 109.586 -179.986 . . . . . . . . 0 0 . 1 . 030 nuclear build full ' C' C ' 319' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.494 1.733 0 N-CA-C 109.185 -0.672 . . . . 6.8200000000000003 109.185 . . . . . . . . . 1 1 . 1 . 030 nuclear build full ' C' C ' 320' ' ' LYS . . . . . . . . . . . . . 6.7 tttt 62.41 81.34 0.2 Allowed 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.24 -0.913 . . . . 6.4900000000000002 109.105 -179.657 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' C' C ' 321' ' ' LYS . . . . . . . . . . . . . 2.6 mttt -156.71 69.16 4.63 Favored Pre-proline 0 N--CA 1.493 1.686 0 O-C-N 121.075 -1.016 . . . . 6.4000000000000004 109.704 -179.762 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' C' C ' 322' ' ' PRO . . . . . . . . . . . . . 6.0 Cg_exo -58.51 97.76 0.09 OUTLIER 'Trans proline' 0 C--N 1.31 -1.467 0 C-N-CA 122.277 1.984 . . . . 3.4199999999999999 109.759 179.926 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' C' C ' 323' ' ' LEU . . . . . . . . . . . . . 26.8 mt -81.09 129.03 34.37 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.326 -0.859 . . . . 3.9500000000000002 109.871 -179.511 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' C' C ' 324' ' ' ASP . . . . . . . . . . . . . 94.7 m-20 -80.32 103.45 10.2 Favored 'General case' 0 N--CA 1.489 1.5 0 O-C-N 121.337 -0.852 . . . . 1.6299999999999999 109.652 179.767 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' C' C ' 325' ' ' GLY . . . . . 0.578 ' O ' ' CD2' ' C' ' 327' ' ' TYR . . . -70.44 -161.17 3.53 Favored Glycine 0 N--CA 1.493 2.481 0 N-CA-C 109.52 -1.432 . . . . 0.72999999999999998 109.52 179.792 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' C' C ' 326' ' ' GLU . . . . . . . . . . . . . 2.9 mp0 -60.2 163.51 4.89 Favored 'General case' 0 C--N 1.303 -1.422 0 O-C-N 121.239 -1.154 . . . . 2.1699999999999999 109.433 179.838 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' C' C ' 327' ' ' TYR . . . . . 0.578 ' CD2' ' O ' ' C' ' 325' ' ' GLY . 49.5 m-85 -150.75 114.19 4.89 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.062 -1.024 . . . . 0.47999999999999998 109.835 179.752 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' C' C ' 328' ' ' PHE . . . . . 0.458 ' O ' HG23 ' C' ' 329' ' ' THR . 79.5 m-85 -113.38 -167.81 1.25 Allowed 'General case' 0 N--CA 1.488 1.466 0 O-C-N 121.217 -0.927 . . . . 0.33000000000000002 109.491 179.542 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' C' C ' 329' ' ' THR . . . . . 0.458 HG23 ' O ' ' C' ' 328' ' ' PHE . 4.4 p -153.91 161.84 41.69 Favored 'General case' 0 C--N 1.301 -1.508 0 O-C-N 121.068 -1.02 . . . . 0.23000000000000001 109.536 -179.881 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' C' C ' 330' ' ' LEU . . . . . . . . . . . . . 15.0 tp -149.24 129.43 13.65 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.291 -0.881 . . . . 0.28000000000000003 109.671 -179.703 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' C' C ' 331' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -87.15 119.88 27.85 Favored 'General case' 0 N--CA 1.487 1.4 0 O-C-N 121.334 -0.854 . . . . 1.48 109.229 179.632 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' C' C ' 332' ' ' ILE . . . . . 0.719 HG21 ' HA ' ' C' ' 338' ' ' PHE . 14.1 mt -103.23 105.89 19.12 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.574 0 O-C-N 121.18 -0.95 . . . . 0.23999999999999999 109.299 179.915 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' C' C ' 333' ' ' ARG . . . . . 0.573 ' HG2' ' CE1' ' A' ' 327' ' ' TYR . 8.3 mtt180 -72.65 134.9 45.32 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.228 -0.92 . . . . 2.7400000000000002 109.155 179.624 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' C' C ' 334' ' ' GLY . . . . . . . . . . . . . . . 92.78 134.79 6.94 Favored Glycine 0 N--CA 1.489 2.176 0 N-CA-C 109.714 -1.354 . . . . 0.34999999999999998 109.714 179.959 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' C' C ' 335' ' ' ARG . . . . . 0.408 ' O ' ' HB3' ' C' ' 338' ' ' PHE . 6.7 tpt180 -80.33 -34.25 36.83 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.502 -0.999 . . . . 2.5299999999999998 109.319 179.922 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' C' C ' 336' ' ' GLU . . . . . . . . . . . . . 1.3 tt0 -57.96 -61.45 2.53 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.189 -0.945 . . . . 2.6200000000000001 109.69 -179.974 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' C' C ' 337' ' ' ARG . . . . . . . . . . . . . 3.0 mtt180 -59.19 -28.57 66.76 Favored 'General case' 0 N--CA 1.487 1.384 0 O-C-N 121.065 -1.022 . . . . 2.8100000000000001 109.553 -179.91 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' C' C ' 338' ' ' PHE . . . . . 0.719 ' HA ' HG21 ' C' ' 332' ' ' ILE . 48.4 t80 -55.21 -62.4 1.69 Allowed 'General case' 0 N--CA 1.487 1.389 0 O-C-N 121.275 -0.891 . . . . 0.40000000000000002 109.61 179.887 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' C' C ' 339' ' ' GLU . . . . . . . . . . . . . 1.3 mm-40 -49.79 -31.44 11.63 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 120.994 -1.066 . . . . 2.0499999999999998 109.662 -179.819 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' C' C ' 340' ' ' MET . . . . . . . . . . . . . 24.2 ttp -63.27 -57.38 10.62 Favored 'General case' 0 N--CA 1.488 1.462 0 O-C-N 121.271 -0.893 . . . . 0.32000000000000001 110.35 -179.429 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' C' C ' 341' ' ' PHE . . . . . 0.444 ' HB2' ' CD1' ' C' ' 332' ' ' ILE . 51.7 m-85 -61.57 -47.87 83.54 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.004 -1.06 . . . . 0.17999999999999999 109.715 -179.575 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' C' C ' 342' ' ' ARG . . . . . 0.439 HH11 ' CG ' ' C' ' 342' ' ' ARG . 0.0 OUTLIER -47.15 -40.93 16.76 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.556 -0.715 . . . . 2.9100000000000001 109.947 -179.983 . . . . . . . . 3 3 . 1 . 030 nuclear build full ' C' C ' 343' ' ' GLU . . . . . 0.442 ' HA ' ' OE1' ' C' ' 343' ' ' GLU . 4.6 tp10 -60.1 -48.73 80.51 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.236 -0.915 . . . . 2.1400000000000001 109.611 -179.951 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' C' C ' 344' ' ' LEU . . . . . . . . . . . . . 28.7 mt -62.18 -31.1 71.57 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.324 -0.86 . . . . 0.22 109.47 -179.899 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' C' C ' 345' ' ' ASN . . . . . . . . . . . . . 8.8 t-20 -57.57 -50.53 72.79 Favored 'General case' 0 C--N 1.301 -1.529 0 O-C-N 121.16 -0.962 . . . . 1.0800000000000001 109.258 -179.928 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' C' C ' 346' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -63.9 -33.43 75.69 Favored 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.247 -0.908 . . . . 2.21 109.85 -179.849 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' C' C ' 347' ' ' ALA . . . . . 0.422 ' HB1' ' HB1' ' D' ' 347' ' ' ALA . . . -61.26 -60.1 4.27 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.225 -0.922 . . . . 0.17999999999999999 110.285 -179.459 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' C' C ' 348' ' ' LEU . . . . . 0.543 ' N ' HD22 ' C' ' 348' ' ' LEU . 3.8 mm? -59.0 -44.45 91.67 Favored 'General case' 0 N--CA 1.488 1.472 0 O-C-N 121.154 -0.966 . . . . 0.32000000000000001 109.814 -179.025 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' C' C ' 349' ' ' GLU . . . . . . . . . . . . . 20.2 mt-10 -58.61 -34.4 71.1 Favored 'General case' 0 N--CA 1.489 1.525 0 O-C-N 121.094 -1.004 . . . . 2.1899999999999999 109.735 -179.751 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' C' C ' 350' ' ' LEU . . . . . 0.74 ' CD2' HD13 ' D' ' 350' ' ' LEU . 4.9 tt -64.07 -46.78 82.79 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.304 -0.872 . . . . 0.46000000000000002 109.459 -179.713 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' C' C ' 351' ' ' LYS . . . . . 0.539 ' N ' HD23 ' C' ' 350' ' ' LEU . 3.5 tttt -61.16 -44.02 97.97 Favored 'General case' 0 C--N 1.301 -1.531 0 O-C-N 121.408 -0.807 . . . . 1.3500000000000001 109.587 -179.79 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' C' C ' 352' ' ' ASP . . . . . . . . . . . . . 56.2 m-20 -55.76 -47.0 77.75 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.353 -0.842 . . . . 1.1899999999999999 109.951 -179.696 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' C' C ' 353' ' ' ALA . . . . . . . . . . . . . . . -68.31 -19.26 64.66 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.309 -0.869 . . . . 0.56999999999999995 109.709 -179.578 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' C' C ' 354' ' ' GLN . . . . . . . . . . . . . 9.0 mt-30 -80.45 -3.42 49.79 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.07 -1.019 . . . . 1.47 109.449 179.659 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' C' C ' 355' ' ' ALA . . . . . . . . . . . . . . . -68.02 -87.98 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.353 -0.842 . . . . 0.93000000000000005 109.878 -179.664 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' C' C ' 356' ' ' GLY . . . . . . . . . . . . . . . -77.83 89.98 1.07 Allowed Glycine 0 N--CA 1.492 2.425 0 N-CA-C 109.669 -1.372 . . . . 1.3300000000000001 109.669 -179.926 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' C' C ' 357' ' ' LYS . . . . . . . . . . . . . 8.8 tptp -88.09 133.57 33.96 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.41 -1.053 . . . . 4.0099999999999998 109.26 179.816 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' C' C ' 358' ' ' GLU . . . . . 0.447 ' HG2' ' HD2' ' C' ' 359' ' ' PRO . 0.1 OUTLIER -50.11 134.12 22.91 Favored Pre-proline 0 C--N 1.304 -1.385 0 O-C-N 121.402 -0.811 . . . . 5.75 109.303 179.864 . . . . . . . . 3 3 . 1 . 030 nuclear build full ' C' C ' 359' ' ' PRO . . . . . 0.447 ' HD2' ' HG2' ' C' ' 358' ' ' GLU . 2.8 Cg_endo -63.07 112.38 1.67 Allowed 'Trans proline' 0 C--N 1.312 -1.383 0 C-N-CA 122.029 1.819 . . . . 4.9400000000000004 110.015 179.96 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' C' C ' 360' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.364 0 N-CA-C 109.213 -1.555 . . . . 6.5 109.213 179.837 . . . . . . . . 0 0 . 1 . 030 nuclear build full ' D' D ' 319' ' ' LYS . . . . . . . . . . . . . 20.9 mttp . . . . . 0 N--CA 1.491 1.596 0 CA-C-O 121.227 0.537 . . . . 7.5300000000000002 109.681 . . . . . . . . . 0 0 . 1 . 030 nuclear build full ' D' D ' 320' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER 64.32 120.83 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.424 -0.797 . . . . 6.4100000000000001 109.218 179.828 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' D' D ' 321' ' ' LYS . . . . . 0.488 ' CG ' ' O ' ' D' ' 321' ' ' LYS . 0.0 OUTLIER -157.21 87.69 2.65 Favored Pre-proline 0 N--CA 1.492 1.64 0 O-C-N 121.168 -0.957 . . . . 6.1100000000000003 109.268 179.989 . . . . . . . . 3 3 . 1 . 030 nuclear build full ' D' D ' 322' ' ' PRO . . . . . . . . . . . . . 4.2 Cg_exo -58.45 135.77 69.96 Favored 'Trans proline' 0 C--N 1.307 -1.644 0 C-N-CA 122.16 1.906 . . . . 2.8199999999999998 110.426 -179.407 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' D' D ' 323' ' ' LEU . . . . . . . . . . . . . 19.1 mt -82.32 125.37 30.91 Favored 'General case' 0 C--N 1.303 -1.454 0 O-C-N 121.336 -0.852 . . . . 2.8300000000000001 109.499 -179.805 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' D' D ' 324' ' ' ASP . . . . . . . . . . . . . 2.5 m-20 -80.35 103.82 10.48 Favored 'General case' 0 C--N 1.304 -1.409 0 C-N-CA 119.726 -0.79 . . . . 1.54 109.026 -179.999 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' D' D ' 325' ' ' GLY . . . . . 0.561 ' O ' ' CD2' ' D' ' 327' ' ' TYR . . . -68.51 -163.86 2.97 Favored Glycine 0 N--CA 1.493 2.49 0 N-CA-C 109.582 -1.407 . . . . 0.58999999999999997 109.582 -179.955 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' D' D ' 326' ' ' GLU . . . . . . . . . . . . . 5.7 mt-10 -59.28 164.78 3.01 Favored 'General case' 0 N--CA 1.489 1.501 0 O-C-N 121.283 -1.128 . . . . 2.1299999999999999 109.496 -179.864 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' D' D ' 327' ' ' TYR . . . . . 0.561 ' CD2' ' O ' ' D' ' 325' ' ' GLY . 41.3 m-85 -148.35 109.13 4.22 Favored 'General case' 0 C--N 1.302 -1.484 0 O-C-N 121.072 -1.018 . . . . 0.46999999999999997 109.407 179.949 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' D' D ' 328' ' ' PHE . . . . . . . . . . . . . 18.6 m-85 -113.9 -167.88 1.27 Allowed 'General case' 0 N--CA 1.489 1.49 0 O-C-N 121.158 -0.964 . . . . 0.29999999999999999 109.125 -179.802 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' D' D ' 329' ' ' THR . . . . . 0.4 ' HA ' ' O ' ' B' ' 330' ' ' LEU . 15.2 p -153.58 169.35 23.44 Favored 'General case' 0 C--N 1.302 -1.49 0 O-C-N 121.373 -0.829 . . . . 0.22 108.855 -179.902 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' D' D ' 330' ' ' LEU . . . . . . . . . . . . . 20.7 tp -151.78 134.48 15.54 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.44 -0.788 . . . . 0.28000000000000003 109.686 -179.909 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' D' D ' 331' ' ' GLN . . . . . . . . . . . . . 3.3 tp60 -87.19 114.54 23.89 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.526 -0.733 . . . . 0.93000000000000005 109.583 179.714 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' D' D ' 332' ' ' ILE . . . . . 0.844 HG21 ' HA ' ' D' ' 338' ' ' PHE . 57.8 mt -103.25 101.68 12.54 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.475 0 O-C-N 121.348 -0.845 . . . . 0.25 109.079 179.85 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' D' D ' 333' ' ' ARG . . . . . . . . . . . . . 47.0 mtt180 -72.17 153.42 41.64 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.322 -0.861 . . . . 2.9300000000000002 109.733 -179.72 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' D' D ' 334' ' ' GLY . . . . . . . . . . . . . . . 76.38 131.33 0.4 Allowed Glycine 0 N--CA 1.492 2.378 0 N-CA-C 109.588 -1.405 . . . . 0.40999999999999998 109.588 179.672 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' D' D ' 335' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -75.31 -35.15 61.29 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.222 -1.164 . . . . 3.0299999999999998 109.762 179.994 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' D' D ' 336' ' ' GLU . . . . . . . . . . . . . 9.7 mt-10 -58.46 -58.01 10.42 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.131 -0.981 . . . . 2.2599999999999998 109.716 -179.937 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' D' D ' 337' ' ' ARG . . . . . . . . . . . . . 5.9 mmt180 -60.81 -35.46 76.57 Favored 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.099 -1.001 . . . . 2.9199999999999999 109.865 179.927 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' D' D ' 338' ' ' PHE . . . . . 0.844 ' HA ' HG21 ' D' ' 332' ' ' ILE . 65.6 t80 -54.99 -59.47 4.7 Favored 'General case' 0 N--CA 1.487 1.376 0 O-C-N 121.082 -1.011 . . . . 0.37 109.364 179.998 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' D' D ' 339' ' ' GLU . . . . . . . . . . . . . 78.1 mt-10 -50.09 -36.5 29.7 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.592 -0.693 . . . . 1.99 110.485 -179.43 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' D' D ' 340' ' ' MET . . . . . . . . . . . . . 43.5 ttp -64.39 -50.49 67.45 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.078 -1.014 . . . . 0.31 110.278 -179.266 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' D' D ' 341' ' ' PHE . . . . . . . . . . . . . 53.9 m-85 -61.81 -45.53 93.43 Favored 'General case' 0 C--N 1.298 -1.631 0 O-C-N 120.925 -1.109 . . . . 0.17999999999999999 110.249 -179.408 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' D' D ' 342' ' ' ARG . . . . . . . . . . . . . 11.6 ttp180 -48.12 -43.91 31.48 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.157 -0.964 . . . . 2.4100000000000001 109.896 -179.656 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' D' D ' 343' ' ' GLU . . . . . . . . . . . . . 27.7 tt0 -58.24 -48.26 80.95 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.246 -0.909 . . . . 2.3500000000000001 109.7 -179.539 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' D' D ' 344' ' ' LEU . . . . . . . . . . . . . 46.4 mt -61.47 -30.31 70.52 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.074 -1.016 . . . . 0.19 109.551 -179.872 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' D' D ' 345' ' ' ASN . . . . . . . . . . . . . 12.6 t-20 -57.82 -59.11 5.73 Favored 'General case' 0 C--N 1.305 -1.367 0 O-C-N 121.148 -0.97 . . . . 1.0900000000000001 109.587 -179.931 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' D' D ' 346' ' ' GLU . . . . . . . . . . . . . 83.4 tt0 -60.52 -25.22 65.95 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.327 -0.858 . . . . 1.6899999999999999 109.692 -179.755 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' D' D ' 347' ' ' ALA . . . . . 0.422 ' HB1' ' HB1' ' C' ' 347' ' ' ALA . . . -61.71 -60.89 2.99 Favored 'General case' 0 C--N 1.301 -1.515 0 O-C-N 121.171 -0.956 . . . . 0.17999999999999999 109.773 -179.77 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' D' D ' 348' ' ' LEU . . . . . 0.627 HD22 ' N ' ' D' ' 348' ' ' LEU . 3.8 mm? -61.84 -46.33 89.92 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.35 -0.843 . . . . 0.31 109.716 -179.239 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' D' D ' 349' ' ' GLU . . . . . . . . . . . . . 21.1 mm-40 -56.85 -31.67 65.03 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.374 -0.829 . . . . 1.95 109.904 -179.516 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' D' D ' 350' ' ' LEU . . . . . 0.74 HD13 ' CD2' ' C' ' 350' ' ' LEU . 5.8 tt -64.75 -47.12 79.37 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.466 -0.771 . . . . 0.42999999999999999 108.957 179.787 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' D' D ' 351' ' ' LYS . . . . . . . . . . . . . 6.1 tttt -57.71 -43.67 85.36 Favored 'General case' 0 N--CA 1.489 1.513 0 N-CA-C 109.047 -0.723 . . . . 1.3999999999999999 109.047 179.755 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' D' D ' 352' ' ' ASP . . . . . . . . . . . . . 15.7 m-20 -55.05 -39.87 69.66 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.362 -0.836 . . . . 1.1699999999999999 109.603 179.904 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' D' D ' 353' ' ' ALA . . . . . . . . . . . . . . . -69.0 -27.12 65.41 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.465 -0.772 . . . . 0.58999999999999997 109.848 -179.927 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' D' D ' 354' ' ' GLN . . . . . . . . . . . . . 4.2 tt0 -80.66 -4.46 54.34 Favored 'General case' 0 N--CA 1.488 1.468 0 O-C-N 120.946 -1.096 . . . . 1.4399999999999999 109.997 -179.636 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' D' D ' 355' ' ' ALA . . . . . . . . . . . . . . . -69.49 -88.06 0.02 OUTLIER 'General case' 0 N--CA 1.496 1.856 0 O-C-N 121.252 -0.905 . . . . 0.97999999999999998 109.603 -179.998 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' D' D ' 356' ' ' GLY . . . . . . . . . . . . . . . -68.35 104.76 1.26 Allowed Glycine 0 N--CA 1.489 2.214 0 N-CA-C 109.208 -1.557 . . . . 1.28 109.208 179.84 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' D' D ' 357' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -86.68 124.36 32.86 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.108 -1.231 . . . . 4.0899999999999999 109.606 -179.612 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' D' D ' 358' ' ' GLU . . . . . . . . . . . . . 5.3 mm-40 -50.09 118.5 9.08 Favored Pre-proline 0 N--CA 1.489 1.501 0 O-C-N 121.266 -0.897 . . . . 5.71 109.639 179.995 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' D' D ' 359' ' ' PRO . . . . . . . . . . . . . 2.5 Cg_endo -62.43 150.11 88.52 Favored 'Trans proline' 0 C--N 1.313 -1.338 0 C-N-CA 121.95 1.767 . . . . 4.9699999999999998 109.919 179.559 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' D' D ' 360' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.488 2.149 0 CA-C-O 117.958 -1.468 . . . . 6.9699999999999998 109.536 179.978 . . . . . . . . 0 0 . 1 . 031 nuclear build full ' A' A ' 319' ' ' LYS . . . . . . . . . . . . . 5.8 mtpt . . . . . 0 N--CA 1.492 1.661 0 N-CA-C 109.474 -0.565 . . . . 7.5499999999999998 109.474 . . . . . . . . . 0 0 . 1 . 031 nuclear build full ' A' A ' 320' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER 64.28 137.14 0.02 OUTLIER 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.162 -0.961 . . . . 6.4299999999999997 109.67 -179.978 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 321' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -159.24 71.61 3.45 Favored Pre-proline 0 N--CA 1.489 1.517 0 O-C-N 121.317 -0.864 . . . . 6.1299999999999999 109.212 179.822 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 322' ' ' PRO . . . . . . . . . . . . . 3.5 Cg_exo -60.88 128.42 25.45 Favored 'Trans proline' 0 C--N 1.308 -1.572 0 C-N-CA 122.278 1.985 . . . . 2.8300000000000001 109.795 -179.754 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 323' ' ' LEU . . . . . . . . . . . . . 15.2 mt -79.32 124.88 28.82 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.291 -0.88 . . . . 2.8300000000000001 109.411 -179.676 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 324' ' ' ASP . . . . . 0.509 ' CB ' ' OH ' ' A' ' 327' ' ' TYR . 11.9 m-20 -80.21 155.29 27.45 Favored 'General case' 0 C--N 1.304 -1.405 0 O-C-N 121.281 -0.887 . . . . 1.53 108.995 179.894 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 325' ' ' GLY . . . . . . . . . . . . . . . -70.42 -161.2 3.53 Favored Glycine 0 N--CA 1.488 2.162 0 N-CA-C 109.137 -1.585 . . . . 0.60999999999999999 109.137 179.887 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 326' ' ' GLU . . . . . . . . . . . . . 2.6 mt-10 -59.19 -166.56 0.01 OUTLIER 'General case' 0 N--CA 1.488 1.47 0 O-C-N 121.153 -1.204 . . . . 2.1299999999999999 109.042 179.677 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 327' ' ' TYR . . . . . 0.509 ' OH ' ' CB ' ' A' ' 324' ' ' ASP . 33.6 m-85 -148.5 112.42 5.14 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.212 -0.93 . . . . 0.47999999999999998 109.722 179.901 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 328' ' ' PHE . . . . . 0.405 ' O ' HG23 ' A' ' 329' ' ' THR . 85.1 m-85 -114.78 -168.12 1.33 Allowed 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.452 -0.78 . . . . 0.31 109.45 179.972 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 329' ' ' THR . . . . . 0.405 HG23 ' O ' ' A' ' 328' ' ' PHE . 37.0 p -154.18 157.93 39.56 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.206 -0.934 . . . . 0.22 109.315 -179.971 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 330' ' ' LEU . . . . . . . . . . . . . 21.9 tp -150.73 128.81 11.85 Favored 'General case' 0 N--CA 1.488 1.465 0 O-C-N 121.213 -0.929 . . . . 0.28000000000000003 109.888 -179.546 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 331' ' ' GLN . . . . . . . . . . . . . 1.3 tt0 -86.92 117.06 25.4 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.242 -0.911 . . . . 0.91000000000000003 109.095 179.673 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 332' ' ' ILE . . . . . 0.585 HG21 ' HA ' ' A' ' 338' ' ' PHE . 96.2 mt -103.43 106.49 20.24 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.565 0 O-C-N 121.114 -0.991 . . . . 0.26000000000000001 109.96 -179.576 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 333' ' ' ARG . . . . . 0.598 ' HG2' ' CE1' ' C' ' 327' ' ' TYR . 1.6 mtp180 -73.15 154.21 40.42 Favored 'General case' 0 C--N 1.303 -1.439 0 O-C-N 121.466 -0.771 . . . . 2.9199999999999999 109.429 179.781 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 334' ' ' GLY . . . . . . . . . . . . . . . 79.62 129.67 0.73 Allowed Glycine 0 N--CA 1.492 2.397 0 N-CA-C 109.882 -1.287 . . . . 0.40000000000000002 109.882 179.621 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 335' ' ' ARG . . . . . 0.529 ' NH1' ' HG2' ' A' ' 335' ' ' ARG . 21.6 ttt-85 -79.8 -38.24 33.46 Favored 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.355 -1.085 . . . . 3.0099999999999998 109.229 179.627 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 336' ' ' GLU . . . . . . . . . . . . . 21.4 mt-10 -58.69 -59.14 5.88 Favored 'General case' 0 N--CA 1.488 1.436 0 O-C-N 121.399 -0.813 . . . . 2.29 109.59 -179.996 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 337' ' ' ARG . . . . . . . . . . . . . 2.5 mmt180 -60.17 -30.62 69.46 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.292 -0.88 . . . . 2.9300000000000002 109.3 -179.981 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 338' ' ' PHE . . . . . 0.585 ' HA ' HG21 ' A' ' 332' ' ' ILE . 64.3 t80 -55.48 -58.1 9.14 Favored 'General case' 0 N--CA 1.488 1.474 0 O-C-N 121.171 -0.955 . . . . 0.38 109.278 179.826 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 339' ' ' GLU . . . . . . . . . . . . . 7.2 mt-10 -51.92 -30.95 26.58 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.139 -0.975 . . . . 1.97 109.99 -179.847 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 340' ' ' MET . . . . . . . . . . . . . 16.0 ttp -64.67 -54.4 32.34 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.166 -0.959 . . . . 0.31 109.885 -179.6 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 341' ' ' PHE . . . . . . . . . . . . . 35.7 m-85 -62.61 -52.77 62.08 Favored 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.3 -0.875 . . . . 0.17999999999999999 110.024 -179.6 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 342' ' ' ARG . . . . . . . . . . . . . 12.9 ttp180 -47.93 -41.17 24.07 Favored 'General case' 0 N--CA 1.489 1.481 0 O-C-N 121.234 -0.916 . . . . 2.4199999999999999 109.946 -179.576 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 343' ' ' GLU . . . . . . . . . . . . . 42.9 tt0 -59.17 -45.11 91.86 Favored 'General case' 0 N--CA 1.494 1.74 0 O-C-N 121.156 -0.965 . . . . 2.3500000000000001 109.741 -179.859 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 344' ' ' LEU . . . . . 0.611 HD22 HD22 ' B' ' 344' ' ' LEU . 39.8 mt -62.81 -41.63 99.37 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.118 -0.989 . . . . 0.17999999999999999 109.781 -179.864 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 345' ' ' ASN . . . . . 0.541 HD22 HD11 ' C' ' 330' ' ' LEU . 33.2 t-20 -56.16 -45.46 79.67 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.113 -0.992 . . . . 1.0900000000000001 109.464 -179.826 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 346' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -60.88 -36.08 78.28 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.255 -0.903 . . . . 1.6499999999999999 109.746 -179.949 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 347' ' ' ALA . . . . . 0.992 ' HB1' ' HB1' ' B' ' 347' ' ' ALA . . . -60.54 -52.32 65.7 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.164 -0.96 . . . . 0.17999999999999999 110.27 -179.646 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 348' ' ' LEU . . . . . 0.59 HD22 ' N ' ' A' ' 348' ' ' LEU . 3.9 mm? -60.78 -49.74 76.28 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.196 -0.94 . . . . 0.29999999999999999 109.888 -179.403 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 349' ' ' GLU . . . . . . . . . . . . . 53.3 mt-10 -57.49 -31.08 65.65 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.233 -0.917 . . . . 1.9399999999999999 110.038 -179.332 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 350' ' ' LEU . . . . . 0.76 HD23 ' O ' ' A' ' 350' ' ' LEU . 4.7 tt -63.81 -41.28 97.92 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.075 -1.016 . . . . 0.46000000000000002 109.054 179.92 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 351' ' ' LYS . . . . . . . . . . . . . 6.3 tttt -59.65 -44.94 93.34 Favored 'General case' 0 C--N 1.302 -1.497 0 O-C-N 121.342 -0.849 . . . . 1.3999999999999999 109.647 179.94 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 352' ' ' ASP . . . . . . . . . . . . . 63.8 m-20 -54.48 -43.33 71.65 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.162 -0.962 . . . . 1.1599999999999999 109.623 -179.917 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 353' ' ' ALA . . . . . . . . . . . . . . . -67.61 -28.91 68.15 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.194 -0.941 . . . . 0.63 109.599 -179.687 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 354' ' ' GLN . . . . . 0.533 ' OE1' HD11 ' B' ' 350' ' ' LEU . 3.8 mt-30 -81.39 5.7 16.71 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.211 -0.93 . . . . 1.47 109.378 179.853 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 355' ' ' ALA . . . . . . . . . . . . . . . -69.32 -83.77 0.03 OUTLIER 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.054 -1.029 . . . . 1.01 109.622 -179.845 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 356' ' ' GLY . . . . . . . . . . . . . . . -71.73 88.1 0.45 Allowed Glycine 0 N--CA 1.491 2.351 0 N-CA-C 109.928 -1.269 . . . . 1.3 109.928 -179.744 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 357' ' ' LYS . . . . . . . . . . . . . 24.3 ttmt -88.16 141.73 28.33 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.205 -1.174 . . . . 4.0999999999999996 109.491 179.63 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 358' ' ' GLU . . . . . 0.421 ' CG ' ' HD2' ' A' ' 359' ' ' PRO . 0.9 OUTLIER -51.0 167.15 0.28 Allowed Pre-proline 0 N--CA 1.49 1.555 0 O-C-N 121.299 -0.876 . . . . 5.75 109.445 -179.981 . . . . . . . . 3 3 . 1 . 031 nuclear build full ' A' A ' 359' ' ' PRO . . . . . 0.421 ' HD2' ' CG ' ' A' ' 358' ' ' GLU . 2.4 Cg_endo -61.87 -75.38 0.02 OUTLIER 'Trans proline' 0 C--N 1.309 -1.54 0 C-N-CA 122.306 2.004 . . . . 5.0 110.138 179.744 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 360' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.345 0 N-CA-C 109.297 -1.521 . . . . 6.9699999999999998 109.297 179.832 . . . . . . . . 0 0 . 1 . 031 nuclear build full ' B' B ' 319' ' ' LYS . . . . . . . . . . . . . 5.9 mtpt . . . . . 0 N--CA 1.492 1.668 0 N-CA-C 109.449 -0.575 . . . . 7.5499999999999998 109.449 . . . . . . . . . 0 0 . 1 . 031 nuclear build full ' B' B ' 320' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER 63.71 138.11 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.228 -0.92 . . . . 6.4400000000000004 109.56 -179.949 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' B' B ' 321' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -159.75 71.58 3.23 Favored Pre-proline 0 C--N 1.301 -1.514 0 O-C-N 121.3 -0.875 . . . . 6.1299999999999999 109.141 179.701 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' B' B ' 322' ' ' PRO . . . . . . . . . . . . . 3.4 Cg_exo -61.2 128.2 24.41 Favored 'Trans proline' 0 C--N 1.308 -1.6 0 C-N-CA 122.014 1.809 . . . . 2.8199999999999998 109.797 -179.59 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' B' B ' 323' ' ' LEU . . . . . . . . . . . . . 14.8 mt -78.92 123.84 27.65 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.144 -0.973 . . . . 2.8399999999999999 109.676 -179.749 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' B' B ' 324' ' ' ASP . . . . . 0.528 ' CB ' ' OH ' ' B' ' 327' ' ' TYR . 13.2 m-20 -79.19 155.35 28.68 Favored 'General case' 0 C--N 1.305 -1.368 0 O-C-N 121.186 -0.946 . . . . 1.53 109.003 179.804 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' B' B ' 325' ' ' GLY . . . . . . . . . . . . . . . -70.91 -162.22 4.46 Favored Glycine 0 N--CA 1.488 2.123 0 N-CA-C 109.147 -1.581 . . . . 0.58999999999999997 109.147 179.778 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' B' B ' 326' ' ' GLU . . . . . . . . . . . . . 2.6 mt-10 -58.08 -166.42 0.0 OUTLIER 'General case' 0 N--CA 1.488 1.471 0 O-C-N 121.188 -1.183 . . . . 2.1299999999999999 109.314 179.949 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' B' B ' 327' ' ' TYR . . . . . 0.627 ' CE1' ' HG2' ' D' ' 333' ' ' ARG . 35.9 m-85 -148.57 112.44 5.13 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.42 -0.8 . . . . 0.47999999999999998 109.671 179.74 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' B' B ' 328' ' ' PHE . . . . . 0.487 ' CE2' ' HA ' ' D' ' 335' ' ' ARG . 85.4 m-85 -114.94 -168.88 1.45 Allowed 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.429 -0.794 . . . . 0.32000000000000001 109.287 179.756 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' B' B ' 329' ' ' THR . . . . . . . . . . . . . 37.9 p -153.53 158.53 41.41 Favored 'General case' 0 N--CA 1.489 1.495 0 O-C-N 121.243 -0.911 . . . . 0.23000000000000001 109.262 179.989 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' B' B ' 330' ' ' LEU . . . . . . . . . . . . . 20.5 tp -151.11 129.61 12.16 Favored 'General case' 0 C--N 1.303 -1.429 0 O-C-N 121.275 -0.891 . . . . 0.28000000000000003 109.628 -179.758 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' B' B ' 331' ' ' GLN . . . . . . . . . . . . . 1.4 tt0 -87.42 117.73 26.39 Favored 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.289 -0.882 . . . . 0.91000000000000003 108.863 179.475 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' B' B ' 332' ' ' ILE . . . . . 0.561 HG21 ' HA ' ' B' ' 338' ' ' PHE . 95.4 mt -103.97 106.71 20.77 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.597 0 O-C-N 121.178 -0.951 . . . . 0.23999999999999999 110.048 -179.724 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' B' B ' 333' ' ' ARG . . . . . 0.541 ' HG2' ' CE1' ' D' ' 327' ' ' TYR . 1.7 mtp180 -73.38 154.84 39.88 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.268 -0.895 . . . . 2.9300000000000002 109.536 179.751 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' B' B ' 334' ' ' GLY . . . . . . . . . . . . . . . 77.99 128.63 0.46 Allowed Glycine 0 N--CA 1.491 2.303 0 N-CA-C 109.987 -1.245 . . . . 0.40000000000000002 109.987 179.82 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' B' B ' 335' ' ' ARG . . . . . 0.538 ' NH1' ' HG2' ' B' ' 335' ' ' ARG . 23.1 ttt-85 -78.77 -38.72 37.88 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.285 -1.127 . . . . 3.0099999999999998 109.293 179.787 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' B' B ' 336' ' ' GLU . . . . . . . . . . . . . 22.1 mt-10 -57.73 -59.1 5.72 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.317 -0.864 . . . . 2.2799999999999998 109.563 179.935 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' B' B ' 337' ' ' ARG . . . . . . . . . . . . . 2.5 mmt180 -60.54 -30.43 69.76 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.207 -0.933 . . . . 2.9300000000000002 109.34 -179.886 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' B' B ' 338' ' ' PHE . . . . . 0.561 ' HA ' HG21 ' B' ' 332' ' ' ILE . 65.8 t80 -55.52 -57.73 10.71 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.332 -0.855 . . . . 0.37 109.379 179.723 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' B' B ' 339' ' ' GLU . . . . . . . . . . . . . 7.9 mt-10 -52.38 -31.06 32.05 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.218 -0.926 . . . . 1.98 109.755 -179.848 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' B' B ' 340' ' ' MET . . . . . . . . . . . . . 17.5 ttp -64.3 -54.54 31.63 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.246 -0.909 . . . . 0.32000000000000001 109.88 -179.5 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' B' B ' 341' ' ' PHE . . . . . . . . . . . . . 36.4 m-85 -62.73 -53.34 55.92 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.389 -0.819 . . . . 0.17999999999999999 109.857 -179.579 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' B' B ' 342' ' ' ARG . . . . . . . . . . . . . 13.6 ttp180 -47.2 -41.37 18.04 Favored 'General case' 0 C--N 1.301 -1.511 0 O-C-N 121.274 -0.891 . . . . 2.4199999999999999 109.99 -179.6 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' B' B ' 343' ' ' GLU . . . . . . . . . . . . . 41.0 tt0 -58.77 -45.61 89.37 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.013 -1.054 . . . . 2.3500000000000001 109.704 -179.719 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' B' B ' 344' ' ' LEU . . . . . 0.611 HD22 HD22 ' A' ' 344' ' ' LEU . 41.1 mt -62.8 -40.93 98.86 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.237 -0.914 . . . . 0.17999999999999999 110.078 -179.586 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' B' B ' 345' ' ' ASN . . . . . . . . . . . . . 33.9 t-20 -56.84 -44.99 82.64 Favored 'General case' 0 C--N 1.301 -1.522 0 O-C-N 121.242 -0.911 . . . . 1.0900000000000001 109.449 -179.877 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' B' B ' 346' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -61.36 -35.43 77.43 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.191 -0.943 . . . . 1.6599999999999999 109.73 -179.924 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' B' B ' 347' ' ' ALA . . . . . 0.992 ' HB1' ' HB1' ' A' ' 347' ' ' ALA . . . -61.3 -51.98 66.6 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.24 -0.913 . . . . 0.17000000000000001 110.078 -179.48 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' B' B ' 348' ' ' LEU . . . . . 0.604 HD22 ' N ' ' B' ' 348' ' ' LEU . 3.9 mm? -61.0 -49.62 76.69 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.085 -1.009 . . . . 0.28999999999999998 109.933 -179.494 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' B' B ' 349' ' ' GLU . . . . . . . . . . . . . 53.7 mt-10 -57.7 -31.61 66.56 Favored 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.243 -0.91 . . . . 1.95 109.897 -179.335 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' B' B ' 350' ' ' LEU . . . . . 0.765 HD23 ' O ' ' B' ' 350' ' ' LEU . 4.7 tt -62.98 -41.88 99.68 Favored 'General case' 0 N--CA 1.488 1.474 0 O-C-N 120.981 -1.074 . . . . 0.45000000000000001 109.108 179.857 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' B' B ' 351' ' ' LYS . . . . . . . . . . . . . 6.3 tttt -59.0 -44.67 91.7 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.311 -0.868 . . . . 1.3799999999999999 109.715 179.908 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' B' B ' 352' ' ' ASP . . . . . . . . . . . . . 65.4 m-20 -54.74 -43.59 72.82 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.195 -0.941 . . . . 1.1599999999999999 109.776 -179.695 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' B' B ' 353' ' ' ALA . . . . . . . . . . . . . . . -67.49 -28.86 68.19 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.216 -0.927 . . . . 0.60999999999999999 109.366 -179.955 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' B' B ' 354' ' ' GLN . . . . . 0.599 ' OE1' HD11 ' A' ' 350' ' ' LEU . 3.7 mt-30 -80.8 4.46 19.03 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.287 -0.883 . . . . 1.45 109.661 179.862 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' B' B ' 355' ' ' ALA . . . . . . . . . . . . . . . -68.59 -85.31 0.02 OUTLIER 'General case' 0 N--CA 1.487 1.416 0 O-C-N 121.177 -0.952 . . . . 0.97999999999999998 109.44 -179.924 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' B' B ' 356' ' ' GLY . . . . . . . . . . . . . . . -70.06 87.9 0.31 Allowed Glycine 0 N--CA 1.492 2.427 0 N-CA-C 110.177 -1.169 . . . . 1.29 110.177 -179.668 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' B' B ' 357' ' ' LYS . . . . . . . . . . . . . 24.3 ttmt -88.3 140.72 29.19 Favored 'General case' 0 N--CA 1.493 1.692 0 O-C-N 121.169 -1.195 . . . . 4.0899999999999999 109.625 179.627 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' B' B ' 358' ' ' GLU . . . . . 0.413 ' CB ' ' HD2' ' B' ' 359' ' ' PRO . 1.1 mt-10 -49.98 167.15 0.25 Allowed Pre-proline 0 N--CA 1.492 1.674 0 O-C-N 121.188 -0.945 . . . . 5.7199999999999998 109.341 179.753 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' B' B ' 359' ' ' PRO . . . . . 0.413 ' HD2' ' CB ' ' B' ' 358' ' ' GLU . 2.5 Cg_endo -61.94 -73.33 0.02 OUTLIER 'Trans proline' 0 C--N 1.308 -1.572 0 C-N-CA 122.572 2.182 . . . . 4.9800000000000004 110.25 179.919 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' B' B ' 360' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.233 0 CA-C-O 117.978 -1.456 . . . . 6.9800000000000004 109.509 179.99 . . . . . . . . 0 0 . 1 . 031 nuclear build full ' C' C ' 319' ' ' LYS . . . . . 0.416 ' O ' ' HB2' ' C' ' 320' ' ' LYS . 0.1 OUTLIER . . . . . 0 N--CA 1.491 1.581 0 CA-C-O 121.284 0.564 . . . . 6.8200000000000003 109.552 . . . . . . . . . 2 2 . 1 . 031 nuclear build full ' C' C ' 320' ' ' LYS . . . . . 0.434 ' HD3' ' HA ' ' C' ' 320' ' ' LYS . 38.2 mmtt 59.91 54.01 4.46 Favored 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.376 -0.828 . . . . 6.4900000000000002 109.404 179.816 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' C' C ' 321' ' ' LYS . . . . . 0.425 ' O ' ' OD1' ' C' ' 324' ' ' ASP . 17.0 mttt -82.15 116.63 64.65 Favored Pre-proline 0 N--CA 1.492 1.653 0 O-C-N 121.283 -0.886 . . . . 6.4000000000000004 109.453 -179.944 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' C' C ' 322' ' ' PRO . . . . . . . . . . . . . 2.5 Cg_endo -68.38 -3.74 11.53 Favored 'Trans proline' 0 C--N 1.313 -1.323 0 C-N-CA 121.932 1.754 . . . . 3.4199999999999999 110.586 -179.88 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' C' C ' 323' ' ' LEU . . . . . . . . . . . . . 33.3 mt -85.06 55.34 3.45 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.146 -0.971 . . . . 3.9500000000000002 109.659 -179.991 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' C' C ' 324' ' ' ASP . . . . . 0.477 ' CB ' ' OH ' ' C' ' 327' ' ' TYR . 8.2 m-20 -82.05 139.09 34.67 Favored 'General case' 0 N--CA 1.489 1.479 0 O-C-N 121.117 -0.989 . . . . 1.6299999999999999 109.492 -179.931 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' C' C ' 325' ' ' GLY . . . . . . . . . . . . . . . -68.59 -161.97 2.36 Favored Glycine 0 N--CA 1.489 2.18 0 N-CA-C 109.117 -1.593 . . . . 0.72999999999999998 109.117 179.699 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' C' C ' 326' ' ' GLU . . . . . . . . . . . . . 1.9 mm-40 -58.21 -168.69 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.282 -1.128 . . . . 2.1699999999999999 109.432 -179.962 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' C' C ' 327' ' ' TYR . . . . . 0.598 ' CE1' ' HG2' ' A' ' 333' ' ' ARG . 32.7 m-85 -148.2 101.34 3.26 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.193 -0.942 . . . . 0.47999999999999998 109.629 179.864 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' C' C ' 328' ' ' PHE . . . . . 0.432 ' O ' HG23 ' C' ' 329' ' ' THR . 92.8 m-85 -108.17 -164.37 0.95 Allowed 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.258 -0.901 . . . . 0.33000000000000002 109.414 179.878 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' C' C ' 329' ' ' THR . . . . . 0.432 HG23 ' O ' ' C' ' 328' ' ' PHE . 3.0 p -154.19 157.5 38.92 Favored 'General case' 0 C--N 1.303 -1.426 0 O-C-N 121.405 -0.809 . . . . 0.23000000000000001 109.039 -179.968 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' C' C ' 330' ' ' LEU . . . . . 0.541 HD11 HD22 ' A' ' 345' ' ' ASN . 19.8 tp -148.38 127.27 12.68 Favored 'General case' 0 N--CA 1.489 1.48 0 O-C-N 121.234 -0.916 . . . . 0.28000000000000003 109.687 -179.735 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' C' C ' 331' ' ' GLN . . . . . . . . . . . . . 1.1 tt0 -86.82 120.06 27.7 Favored 'General case' 0 N--CA 1.487 1.41 0 N-CA-C 108.587 -0.894 . . . . 1.48 108.587 179.286 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' C' C ' 332' ' ' ILE . . . . . 0.668 HG21 ' HA ' ' C' ' 338' ' ' PHE . 15.0 mt -102.84 103.11 14.58 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.588 0 O-C-N 121.178 -0.951 . . . . 0.23999999999999999 109.845 -179.405 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' C' C ' 333' ' ' ARG . . . . . 0.483 ' HG2' ' CE1' ' A' ' 327' ' ' TYR . 1.6 mtt-85 -73.49 126.25 29.79 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.44 -0.787 . . . . 2.7400000000000002 109.47 179.812 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' C' C ' 334' ' ' GLY . . . . . . . . . . . . . . . 104.68 125.76 5.65 Favored Glycine 0 N--CA 1.49 2.243 0 N-CA-C 109.473 -1.451 . . . . 0.34999999999999998 109.473 -179.889 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' C' C ' 335' ' ' ARG . . . . . 0.469 ' O ' ' HB3' ' C' ' 338' ' ' PHE . 2.6 ttm180 -78.65 -36.21 44.21 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.305 -1.115 . . . . 2.5299999999999998 109.612 -179.69 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' C' C ' 336' ' ' GLU . . . . . . . . . . . . . 3.0 mm-40 -58.57 -63.31 1.33 Allowed 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.182 -0.949 . . . . 2.6200000000000001 109.598 -179.802 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' C' C ' 337' ' ' ARG . . . . . . . . . . . . . 14.9 mmt180 -59.12 -27.79 65.93 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.265 -0.897 . . . . 2.8100000000000001 109.615 -179.995 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' C' C ' 338' ' ' PHE . . . . . 0.668 ' HA ' HG21 ' C' ' 332' ' ' ILE . 59.8 t80 -55.34 -58.28 8.39 Favored 'General case' 0 N--CA 1.489 1.489 0 O-C-N 121.25 -0.906 . . . . 0.40000000000000002 109.731 179.969 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' C' C ' 339' ' ' GLU . . . . . . . . . . . . . 17.9 mt-10 -50.52 -32.95 19.76 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.097 -1.002 . . . . 2.0499999999999998 110.087 -179.544 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' C' C ' 340' ' ' MET . . . . . . . . . . . . . 35.0 ttp -64.19 -55.27 22.89 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.13 -0.981 . . . . 0.32000000000000001 110.116 -179.496 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' C' C ' 341' ' ' PHE . . . . . . . . . . . . . 49.6 m-85 -60.93 -53.64 54.79 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.126 -0.984 . . . . 0.17999999999999999 109.999 -179.486 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' C' C ' 342' ' ' ARG . . . . . . . . . . . . . 16.6 ttt180 -46.98 -38.47 10.76 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.088 -1.008 . . . . 2.9100000000000001 109.805 -179.581 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' C' C ' 343' ' ' GLU . . . . . . . . . . . . . 31.4 tt0 -60.18 -47.35 86.3 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.165 -0.96 . . . . 2.1400000000000001 109.848 -179.858 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' C' C ' 344' ' ' LEU . . . . . 0.478 HD22 HD22 ' D' ' 344' ' ' LEU . 36.0 mt -62.55 -35.48 79.6 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.146 -0.971 . . . . 0.22 109.925 -179.507 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' C' C ' 345' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -56.37 -48.83 76.03 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.062 -1.024 . . . . 1.0800000000000001 109.371 -179.991 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' C' C ' 346' ' ' GLU . . . . . . . . . . . . . 2.1 tp10 -62.47 -32.76 73.7 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.253 -0.904 . . . . 2.21 109.734 179.945 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' C' C ' 347' ' ' ALA . . . . . 0.977 ' HB1' ' HB1' ' D' ' 347' ' ' ALA . . . -62.11 -55.96 23.62 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.205 -0.935 . . . . 0.17999999999999999 110.083 -179.718 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' C' C ' 348' ' ' LEU . . . . . 0.59 ' N ' HD22 ' C' ' 348' ' ' LEU . 3.9 mm? -60.97 -49.56 76.94 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.218 -0.926 . . . . 0.32000000000000001 109.832 -179.403 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' C' C ' 349' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -56.43 -33.47 65.87 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.127 -0.983 . . . . 2.1899999999999999 109.373 -179.704 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' C' C ' 350' ' ' LEU . . . . . 1.009 HD22 HD13 ' D' ' 350' ' ' LEU . 6.4 tt -62.53 -43.35 99.03 Favored 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.337 -0.852 . . . . 0.46000000000000002 109.092 179.759 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' C' C ' 351' ' ' LYS . . . . . . . . . . . . . 36.3 tttt -58.15 -41.84 84.64 Favored 'General case' 0 C--N 1.301 -1.514 0 O-C-N 121.377 -0.827 . . . . 1.3500000000000001 109.045 179.742 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' C' C ' 352' ' ' ASP . . . . . . . . . . . . . 50.5 m-20 -56.39 -49.2 75.16 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.241 -0.912 . . . . 1.1899999999999999 109.455 179.668 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' C' C ' 353' ' ' ALA . . . . . . . . . . . . . . . -68.6 -19.1 64.43 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.434 -0.791 . . . . 0.56999999999999995 109.303 179.943 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' C' C ' 354' ' ' GLN . . . . . 0.493 ' HG3' ' CE ' ' C' ' 357' ' ' LYS . 12.3 tt0 -82.58 -1.96 52.32 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.304 -0.873 . . . . 1.47 109.71 179.972 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' C' C ' 355' ' ' ALA . . . . . . . . . . . . . . . -71.16 -80.67 0.06 Allowed 'General case' 0 N--CA 1.489 1.491 0 O-C-N 121.104 -0.997 . . . . 0.93000000000000005 109.702 -179.962 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' C' C ' 356' ' ' GLY . . . . . . . . . . . . . . . -80.9 33.96 2.37 Favored Glycine 0 N--CA 1.493 2.458 0 C-N-CA 120.23 -0.986 . . . . 1.3300000000000001 110.883 -179.516 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' C' C ' 357' ' ' LYS . . . . . 0.493 ' CE ' ' HG3' ' C' ' 354' ' ' GLN . 15.4 pttp -86.47 167.72 14.4 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 120.779 -1.424 . . . . 4.0099999999999998 109.385 179.513 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' C' C ' 358' ' ' GLU . . . . . . . . . . . . . 7.8 pt-20 -51.14 146.1 11.71 Favored Pre-proline 0 N--CA 1.488 1.439 0 O-C-N 121.175 -0.953 . . . . 5.75 109.556 179.955 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' C' C ' 359' ' ' PRO . . . . . . . . . . . . . 1.6 Cg_endo -63.25 124.98 14.79 Favored 'Trans proline' 0 C--N 1.311 -1.414 0 C-N-CA 122.174 1.916 . . . . 4.9400000000000004 110.179 179.965 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' C' C ' 360' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.349 0 CA-C-O 117.97 -1.461 . . . . 6.5 109.635 179.894 . . . . . . . . 0 0 . 1 . 031 nuclear build full ' D' D ' 319' ' ' LYS . . . . . 0.406 ' O ' ' O ' ' D' ' 320' ' ' LYS . 5.8 mtpt . . . . . 0 N--CA 1.491 1.599 0 CA-C-O 121.303 0.573 . . . . 7.5300000000000002 109.921 . . . . . . . . . 1 1 . 1 . 031 nuclear build full ' D' D ' 320' ' ' LYS . . . . . 0.406 ' O ' ' O ' ' D' ' 319' ' ' LYS . 0.2 OUTLIER 63.08 139.51 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.279 -0.888 . . . . 6.4100000000000001 109.453 -179.828 . . . . . . . . 3 3 . 1 . 031 nuclear build full ' D' D ' 321' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -160.32 71.32 2.99 Favored Pre-proline 0 C--N 1.302 -1.479 0 O-C-N 121.192 -0.942 . . . . 6.1100000000000003 108.883 179.646 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' D' D ' 322' ' ' PRO . . . . . . . . . . . . . 3.5 Cg_exo -60.88 128.16 24.64 Favored 'Trans proline' 0 C--N 1.309 -1.515 0 C-N-CA 121.997 1.798 . . . . 2.8199999999999998 110.036 -179.697 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' D' D ' 323' ' ' LEU . . . . . . . . . . . . . 14.1 mt -78.72 124.24 27.99 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.229 -0.919 . . . . 2.8300000000000001 109.556 -179.519 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' D' D ' 324' ' ' ASP . . . . . 0.519 ' CB ' ' OH ' ' D' ' 327' ' ' TYR . 14.3 m-20 -79.43 155.22 28.43 Favored 'General case' 0 N--CA 1.488 1.473 0 O-C-N 121.195 -0.941 . . . . 1.54 109.028 179.667 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' D' D ' 325' ' ' GLY . . . . . . . . . . . . . . . -70.26 -162.07 3.8 Favored Glycine 0 N--CA 1.489 2.172 0 N-CA-C 109.095 -1.602 . . . . 0.58999999999999997 109.095 179.705 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' D' D ' 326' ' ' GLU . . . . . . . . . . . . . 2.6 mt-10 -58.64 -166.57 0.01 OUTLIER 'General case' 0 N--CA 1.488 1.468 0 O-C-N 121.225 -1.162 . . . . 2.1299999999999999 109.074 179.719 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' D' D ' 327' ' ' TYR . . . . . 0.541 ' CE1' ' HG2' ' B' ' 333' ' ' ARG . 34.8 m-85 -148.65 111.58 4.85 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.199 -0.938 . . . . 0.46999999999999997 109.814 179.866 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' D' D ' 328' ' ' PHE . . . . . . . . . . . . . 85.6 m-85 -113.88 -168.4 1.34 Allowed 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.394 -0.816 . . . . 0.29999999999999999 109.372 179.796 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' D' D ' 329' ' ' THR . . . . . . . . . . . . . 35.5 p -153.9 157.79 39.76 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.169 -0.957 . . . . 0.22 109.132 -179.771 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' D' D ' 330' ' ' LEU . . . . . . . . . . . . . 18.3 tp -150.81 129.44 12.27 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.216 -0.928 . . . . 0.28000000000000003 109.864 -179.767 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' D' D ' 331' ' ' GLN . . . . . . . . . . . . . 1.7 tt0 -87.43 116.63 25.67 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.218 -0.926 . . . . 0.93000000000000005 109.27 179.702 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' D' D ' 332' ' ' ILE . . . . . 0.584 HG21 ' HA ' ' D' ' 338' ' ' PHE . 95.0 mt -102.85 106.2 19.59 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.528 0 O-C-N 121.25 -0.906 . . . . 0.25 110.132 -179.572 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' D' D ' 333' ' ' ARG . . . . . 0.627 ' HG2' ' CE1' ' B' ' 327' ' ' TYR . 1.8 mtp180 -72.95 155.25 40.05 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.375 -0.828 . . . . 2.9300000000000002 109.553 179.614 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' D' D ' 334' ' ' GLY . . . . . . . . . . . . . . . 78.09 128.91 0.48 Allowed Glycine 0 N--CA 1.491 2.337 0 N-CA-C 109.847 -1.301 . . . . 0.40999999999999998 109.847 179.643 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' D' D ' 335' ' ' ARG . . . . . 0.521 ' NH1' ' HG2' ' D' ' 335' ' ' ARG . 22.0 ttt-85 -79.68 -37.72 35.17 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.246 -1.149 . . . . 3.0299999999999998 109.235 179.734 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' D' D ' 336' ' ' GLU . . . . . . . . . . . . . 23.6 mt-10 -58.49 -59.54 5.21 Favored 'General case' 0 C--N 1.304 -1.383 0 O-C-N 121.261 -0.899 . . . . 2.2599999999999998 109.483 179.922 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' D' D ' 337' ' ' ARG . . . . . . . . . . . . . 2.0 mmt180 -60.02 -30.18 68.99 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.313 -0.867 . . . . 2.9199999999999999 109.438 -179.947 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' D' D ' 338' ' ' PHE . . . . . 0.584 ' HA ' HG21 ' D' ' 332' ' ' ILE . 65.6 t80 -55.37 -58.37 8.01 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.278 -0.889 . . . . 0.37 109.376 179.855 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' D' D ' 339' ' ' GLU . . . . . . . . . . . . . 8.0 mt-10 -51.9 -31.2 27.32 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.27 -0.894 . . . . 1.99 109.7 -179.939 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' D' D ' 340' ' ' MET . . . . . . . . . . . . . 17.6 ttp -64.21 -54.27 36.12 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.019 -1.051 . . . . 0.31 109.915 -179.627 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' D' D ' 341' ' ' PHE . . . . . . . . . . . . . 36.3 m-85 -62.72 -53.19 58.16 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.222 -0.924 . . . . 0.17999999999999999 109.984 -179.539 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' D' D ' 342' ' ' ARG . . . . . . . . . . . . . 13.6 ttp180 -47.86 -40.29 21.07 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.357 -0.84 . . . . 2.4100000000000001 109.943 -179.593 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' D' D ' 343' ' ' GLU . . . . . . . . . . . . . 40.2 tt0 -59.67 -45.4 92.17 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.042 -1.037 . . . . 2.3500000000000001 109.723 -179.699 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' D' D ' 344' ' ' LEU . . . . . 0.478 HD22 HD22 ' C' ' 344' ' ' LEU . 41.9 mt -63.0 -40.76 98.74 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.27 -0.894 . . . . 0.19 109.998 -179.678 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' D' D ' 345' ' ' ASN . . . . . . . . . . . . . 33.5 t-20 -56.7 -44.93 82.03 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.34 -0.85 . . . . 1.0900000000000001 109.454 -179.699 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' D' D ' 346' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -61.72 -35.86 79.26 Favored 'General case' 0 C--N 1.303 -1.447 0 O-C-N 121.476 -0.765 . . . . 1.6899999999999999 109.746 -179.809 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' D' D ' 347' ' ' ALA . . . . . 0.977 ' HB1' ' HB1' ' C' ' 347' ' ' ALA . . . -60.58 -51.82 67.79 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.289 -0.882 . . . . 0.17999999999999999 110.203 -179.614 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' D' D ' 348' ' ' LEU . . . . . 0.592 HD22 ' N ' ' D' ' 348' ' ' LEU . 3.9 mm? -61.16 -49.87 75.49 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.077 -1.014 . . . . 0.31 109.818 -179.315 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' D' D ' 349' ' ' GLU . . . . . . . . . . . . . 55.6 mt-10 -57.45 -31.29 65.77 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.168 -0.957 . . . . 1.95 110.062 -179.368 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' D' D ' 350' ' ' LEU . . . . . 1.009 HD13 HD22 ' C' ' 350' ' ' LEU . 4.7 tt -63.47 -41.47 98.6 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 120.972 -1.08 . . . . 0.42999999999999999 109.11 179.83 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' D' D ' 351' ' ' LYS . . . . . . . . . . . . . 6.7 tttt -59.6 -44.29 93.43 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.377 -0.827 . . . . 1.3999999999999999 109.517 -179.992 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' D' D ' 352' ' ' ASP . . . . . . . . . . . . . 66.6 m-20 -54.93 -43.5 73.4 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.201 -0.937 . . . . 1.1699999999999999 109.747 -179.859 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' D' D ' 353' ' ' ALA . . . . . . . . . . . . . . . -67.87 -28.2 67.33 Favored 'General case' 0 N--CA 1.489 1.488 0 O-C-N 121.215 -0.928 . . . . 0.58999999999999997 109.703 -179.739 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' D' D ' 354' ' ' GLN . . . . . . . . . . . . . 3.6 mt-30 -81.32 4.69 19.73 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.41 -0.806 . . . . 1.4399999999999999 109.515 179.883 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' D' D ' 355' ' ' ALA . . . . . . . . . . . . . . . -68.58 -84.1 0.03 OUTLIER 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.204 -0.935 . . . . 0.97999999999999998 109.89 -179.813 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' D' D ' 356' ' ' GLY . . . . . . . . . . . . . . . -71.69 87.84 0.45 Allowed Glycine 0 N--CA 1.491 2.362 0 N-CA-C 109.637 -1.385 . . . . 1.28 109.637 -179.601 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' D' D ' 357' ' ' LYS . . . . . . . . . . . . . 24.7 ttmt -88.1 141.67 28.38 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.225 -1.162 . . . . 4.0899999999999999 109.472 179.778 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' D' D ' 358' ' ' GLU . . . . . 0.42 ' CB ' ' HD2' ' D' ' 359' ' ' PRO . 1.1 mt-10 -50.74 167.57 0.26 Allowed Pre-proline 0 N--CA 1.493 1.677 0 O-C-N 121.099 -1.001 . . . . 5.71 109.199 179.87 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' D' D ' 359' ' ' PRO . . . . . 0.42 ' HD2' ' CB ' ' D' ' 358' ' ' GLU . 3.0 Cg_endo -62.24 -72.33 0.02 OUTLIER 'Trans proline' 0 C--N 1.311 -1.409 0 C-N-CA 122.62 2.213 . . . . 4.9699999999999998 110.174 -179.944 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' D' D ' 360' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.488 2.144 0 N-CA-C 109.458 -1.457 . . . . 6.9699999999999998 109.458 -179.837 . . . . . . . . 0 0 . 1 . 032 nuclear build full ' A' A ' 319' ' ' LYS . . . . . 0.46 ' O ' ' O ' ' A' ' 320' ' ' LYS . 3.8 mtpt . . . . . 0 N--CA 1.49 1.536 0 N-CA-C 109.535 -0.543 . . . . 7.5499999999999998 109.535 . . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 320' ' ' LYS . . . . . 0.46 ' O ' ' O ' ' A' ' 319' ' ' LYS . 2.2 mtmt 61.13 138.52 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.335 -0.853 . . . . 6.4299999999999997 109.567 179.985 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 321' ' ' LYS . . . . . . . . . . . . . 19.4 mttt -159.08 110.96 1.56 Allowed Pre-proline 0 N--CA 1.49 1.55 0 O-C-N 121.262 -0.899 . . . . 6.1299999999999999 109.459 -179.861 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 322' ' ' PRO . . . . . . . . . . . . . 3.7 Cg_exo -59.89 -158.92 0.02 OUTLIER 'Trans proline' 0 C--N 1.313 -1.335 0 C-N-CA 121.853 1.702 . . . . 2.8300000000000001 110.072 179.799 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 323' ' ' LEU . . . . . . . . . . . . . 48.1 mt -80.38 127.28 32.21 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.251 -0.906 . . . . 2.8300000000000001 109.331 179.958 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 324' ' ' ASP . . . . . . . . . . . . . 13.4 m-20 -78.61 164.45 24.63 Favored 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.228 -0.92 . . . . 1.53 109.395 -179.903 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 325' ' ' GLY . . . . . . . . . . . . . . . -67.53 178.8 17.76 Favored Glycine 0 N--CA 1.488 2.135 0 N-CA-C 109.278 -1.529 . . . . 0.60999999999999999 109.278 179.97 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 326' ' ' GLU . . . . . 0.431 ' HB2' ' CE1' ' A' ' 328' ' ' PHE . 44.9 mt-10 -57.21 -168.08 0.0 OUTLIER 'General case' 0 N--CA 1.489 1.49 0 O-C-N 121.157 -1.202 . . . . 2.1299999999999999 109.369 -179.838 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 327' ' ' TYR . . . . . . . . . . . . . 44.6 m-85 -149.49 109.27 4.05 Favored 'General case' 0 N--CA 1.488 1.452 0 O-C-N 121.337 -0.852 . . . . 0.47999999999999998 109.267 179.993 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 328' ' ' PHE . . . . . 0.431 ' CE1' ' HB2' ' A' ' 326' ' ' GLU . 41.7 m-85 -113.58 -169.16 1.45 Allowed 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.288 -0.882 . . . . 0.31 109.473 -179.809 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 329' ' ' THR . . . . . 0.427 HG23 ' O ' ' A' ' 328' ' ' PHE . 6.4 p -153.6 168.39 26.34 Favored 'General case' 0 N--CA 1.488 1.456 0 O-C-N 121.294 -0.879 . . . . 0.22 109.216 -179.948 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 330' ' ' LEU . . . . . . . . . . . . . 20.6 tp -150.19 129.03 12.47 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.171 -0.956 . . . . 0.28000000000000003 109.704 -179.783 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 331' ' ' GLN . . . . . . . . . . . . . 1.2 tp60 -87.7 113.35 23.29 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.441 -0.787 . . . . 0.91000000000000003 109.393 179.739 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 332' ' ' ILE . . . . . 0.936 HG21 ' HA ' ' A' ' 338' ' ' PHE . 76.2 mt -103.57 105.06 17.66 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.573 0 O-C-N 121.193 -0.942 . . . . 0.26000000000000001 109.431 -179.975 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 333' ' ' ARG . . . . . 0.457 ' NH1' ' HG2' ' A' ' 333' ' ' ARG . 0.0 OUTLIER -71.75 150.71 44.2 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.264 -0.898 . . . . 2.9199999999999999 109.284 179.822 . . . . . . . . 3 3 . 1 . 032 nuclear build full ' A' A ' 334' ' ' GLY . . . . . . . . . . . . . . . 76.43 126.73 0.25 Allowed Glycine 0 N--CA 1.49 2.267 0 N-CA-C 109.473 -1.451 . . . . 0.40000000000000002 109.473 -179.982 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 335' ' ' ARG . . . . . 0.463 ' HB2' ' OE1' ' C' ' 326' ' ' GLU . 0.4 OUTLIER -74.02 -32.84 63.54 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.264 -1.139 . . . . 3.0099999999999998 109.681 -179.879 . . . . . . . . 3 3 . 1 . 032 nuclear build full ' A' A ' 336' ' ' GLU . . . . . . . . . . . . . 3.1 mt-10 -58.05 -61.5 2.5 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.282 -0.886 . . . . 2.29 109.796 -179.763 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 337' ' ' ARG . . . . . . . . . . . . . 22.4 mmm180 -59.78 -33.69 72.02 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.194 -0.941 . . . . 2.9300000000000002 109.633 -179.704 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 338' ' ' PHE . . . . . 0.936 ' HA ' HG21 ' A' ' 332' ' ' ILE . 59.5 t80 -55.89 -55.12 36.37 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.159 -0.963 . . . . 0.38 109.964 -179.75 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 339' ' ' GLU . . . . . . . . . . . . . 45.4 mt-10 -50.86 -33.92 25.88 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.237 -0.914 . . . . 1.97 110.369 -179.354 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 340' ' ' MET . . . . . . . . . . . . . 24.2 ttp -64.08 -51.7 62.8 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 120.976 -1.077 . . . . 0.31 110.081 -179.457 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 341' ' ' PHE . . . . . . . . . . . . . 45.2 m-85 -61.98 -45.18 94.76 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.137 -0.977 . . . . 0.17999999999999999 110.017 -179.437 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 342' ' ' ARG . . . . . 0.418 ' O ' ' HB3' ' A' ' 345' ' ' ASN . 40.5 ttt180 -50.77 -40.39 54.84 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.144 -0.973 . . . . 2.4199999999999999 109.817 -179.75 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 343' ' ' GLU . . . . . . . . . . . . . 35.5 tp10 -58.43 -51.53 69.46 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.095 -1.003 . . . . 2.3500000000000001 109.766 -179.624 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 344' ' ' LEU . . . . . 0.618 HD22 HD22 ' B' ' 344' ' ' LEU . 84.6 mt -61.08 -32.0 71.65 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.239 -0.913 . . . . 0.17999999999999999 109.338 -179.895 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 345' ' ' ASN . . . . . 0.418 ' HB3' ' O ' ' A' ' 342' ' ' ARG . 8.7 t-20 -58.67 -55.0 40.7 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.254 -0.904 . . . . 1.0900000000000001 109.325 179.861 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 346' ' ' GLU . . . . . . . . . . . . . 32.4 tp10 -61.62 -32.1 72.22 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.382 -0.824 . . . . 1.6499999999999999 109.843 -179.736 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 347' ' ' ALA . . . . . 0.701 ' HB1' ' HB1' ' B' ' 347' ' ' ALA . . . -59.5 -57.04 14.69 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.187 -0.945 . . . . 0.17999999999999999 109.787 -179.738 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 348' ' ' LEU . . . . . 0.555 HD22 ' N ' ' A' ' 348' ' ' LEU . 3.5 mm? -61.82 -38.73 89.25 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.171 -0.956 . . . . 0.29999999999999999 109.645 -179.675 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 349' ' ' GLU . . . . . . . . . . . . . 1.8 mt-10 -58.86 -38.39 78.66 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.306 -0.871 . . . . 1.9399999999999999 110.168 -179.443 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 350' ' ' LEU . . . . . 0.515 HD13 HD22 ' B' ' 350' ' ' LEU . 7.8 tt -63.76 -43.67 95.73 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.179 -0.951 . . . . 0.46000000000000002 109.87 -179.576 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 351' ' ' LYS . . . . . . . . . . . . . 18.8 tttm -58.34 -42.02 85.94 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.311 -0.868 . . . . 1.3999999999999999 109.549 -179.774 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 352' ' ' ASP . . . . . . . . . . . . . 48.0 m-20 -56.2 -41.52 75.72 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.252 -0.905 . . . . 1.1599999999999999 109.522 -179.983 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 353' ' ' ALA . . . . . 0.402 ' O ' ' HB2' ' A' ' 357' ' ' LYS . . . -67.97 -25.54 65.48 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.229 -0.92 . . . . 0.63 109.434 -179.936 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 354' ' ' GLN . . . . . . . . . . . . . 2.5 mt-30 -81.48 -1.19 45.06 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.261 -0.9 . . . . 1.47 109.508 179.968 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 355' ' ' ALA . . . . . . . . . . . . . . . -69.31 -87.77 0.02 OUTLIER 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.233 -0.917 . . . . 1.01 109.47 179.979 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 356' ' ' GLY . . . . . . . . . . . . . . . -81.67 41.17 2.67 Favored Glycine 0 N--CA 1.493 2.442 0 N-CA-C 110.358 -1.097 . . . . 1.3 110.358 -179.882 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 357' ' ' LYS . . . . . 0.402 ' HB2' ' O ' ' A' ' 353' ' ' ALA . 24.8 tttp -87.69 97.31 10.81 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 120.894 -1.356 . . . . 4.0999999999999996 109.491 179.902 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 358' ' ' GLU . . . . . 0.581 ' N ' ' HD2' ' A' ' 359' ' ' PRO . 2.7 mt-10 -50.69 -53.52 45.7 Favored Pre-proline 0 N--CA 1.489 1.514 0 O-C-N 121.391 -0.818 . . . . 5.75 109.995 179.993 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 359' ' ' PRO . . . . . 0.581 ' HD2' ' N ' ' A' ' 358' ' ' GLU . 3.6 Cg_exo -61.6 131.69 36.92 Favored 'Trans proline' 0 C--N 1.311 -1.414 0 C-N-CA 121.974 1.783 . . . . 5.0 110.269 -179.656 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 360' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.312 0 CA-C-O 117.993 -1.448 . . . . 6.9699999999999998 109.561 -179.992 . . . . . . . . 0 0 . 1 . 032 nuclear build full ' B' B ' 319' ' ' LYS . . . . . 0.463 ' O ' ' O ' ' B' ' 320' ' ' LYS . 4.2 mtpt . . . . . 0 N--CA 1.491 1.593 0 CA-C-O 121.288 0.566 . . . . 7.5499999999999998 109.489 . . . . . . . . . 1 1 . 1 . 032 nuclear build full ' B' B ' 320' ' ' LYS . . . . . 0.463 ' O ' ' O ' ' B' ' 319' ' ' LYS . 2.2 mtmt 61.14 138.52 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.238 -0.914 . . . . 6.4400000000000004 109.51 179.96 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' B' B ' 321' ' ' LYS . . . . . . . . . . . . . 19.4 mttt -159.03 111.1 1.57 Allowed Pre-proline 0 N--CA 1.49 1.534 0 O-C-N 121.253 -0.905 . . . . 6.1299999999999999 109.485 -179.918 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' B' B ' 322' ' ' PRO . . . . . . . . . . . . . 3.4 Cg_exo -59.94 -158.76 0.02 OUTLIER 'Trans proline' 0 C--N 1.312 -1.375 0 C-N-CA 121.881 1.72 . . . . 2.8199999999999998 110.164 179.776 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' B' B ' 323' ' ' LEU . . . . . . . . . . . . . 48.4 mt -80.59 127.25 32.24 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.212 -0.93 . . . . 2.8399999999999999 109.409 179.918 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' B' B ' 324' ' ' ASP . . . . . . . . . . . . . 13.4 m-20 -78.91 163.25 25.42 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.205 -0.934 . . . . 1.53 109.557 -179.882 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' B' B ' 325' ' ' GLY . . . . . . . . . . . . . . . -65.67 178.77 11.02 Favored Glycine 0 N--CA 1.489 2.216 0 N-CA-C 109.334 -1.507 . . . . 0.58999999999999997 109.334 179.925 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' B' B ' 326' ' ' GLU . . . . . 0.44 ' HB2' ' CE1' ' B' ' 328' ' ' PHE . 45.0 mt-10 -57.52 -167.78 0.0 OUTLIER 'General case' 0 N--CA 1.488 1.462 0 O-C-N 121.204 -1.174 . . . . 2.1299999999999999 109.348 179.933 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' B' B ' 327' ' ' TYR . . . . . . . . . . . . . 44.6 m-85 -149.6 109.22 4.02 Favored 'General case' 0 N--CA 1.488 1.447 0 O-C-N 121.259 -0.901 . . . . 0.47999999999999998 109.291 179.914 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' B' B ' 328' ' ' PHE . . . . . 0.44 ' CE1' ' HB2' ' B' ' 326' ' ' GLU . 40.8 m-85 -113.63 -169.23 1.47 Allowed 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.255 -0.903 . . . . 0.32000000000000001 109.496 -179.772 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' B' B ' 329' ' ' THR . . . . . 0.433 HG23 ' O ' ' B' ' 328' ' ' PHE . 6.4 p -153.52 168.64 25.46 Favored 'General case' 0 N--CA 1.488 1.458 0 O-C-N 121.247 -0.908 . . . . 0.23000000000000001 109.267 -179.989 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' B' B ' 330' ' ' LEU . . . . . 0.477 HD21 HD22 ' D' ' 345' ' ' ASN . 20.0 tp -150.26 129.15 12.51 Favored 'General case' 0 N--CA 1.489 1.487 0 O-C-N 121.18 -0.95 . . . . 0.28000000000000003 109.759 -179.88 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' B' B ' 331' ' ' GLN . . . . . . . . . . . . . 1.2 tp60 -87.83 113.27 23.33 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.355 -0.841 . . . . 0.91000000000000003 109.383 179.739 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' B' B ' 332' ' ' ILE . . . . . 0.918 HG21 ' HA ' ' B' ' 338' ' ' PHE . 76.0 mt -103.59 105.01 17.57 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.554 0 O-C-N 121.29 -0.881 . . . . 0.23999999999999999 109.444 -179.948 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' B' B ' 333' ' ' ARG . . . . . 0.459 ' NH1' ' HG2' ' B' ' 333' ' ' ARG . 0.0 OUTLIER -71.51 150.71 44.56 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.178 -0.952 . . . . 2.9300000000000002 109.359 179.802 . . . . . . . . 3 3 . 1 . 032 nuclear build full ' B' B ' 334' ' ' GLY . . . . . . . . . . . . . . . 76.24 126.78 0.24 Allowed Glycine 0 N--CA 1.49 2.276 0 N-CA-C 109.553 -1.419 . . . . 0.40000000000000002 109.553 -179.933 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' B' B ' 335' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -74.04 -32.9 63.53 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.25 -1.147 . . . . 3.0099999999999998 109.654 -179.855 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' B' B ' 336' ' ' GLU . . . . . . . . . . . . . 3.1 mt-10 -57.96 -61.42 2.55 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.132 -0.98 . . . . 2.2799999999999998 109.781 -179.723 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' B' B ' 337' ' ' ARG . . . . . . . . . . . . . 22.2 mmm180 -59.94 -33.78 72.36 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.225 -0.922 . . . . 2.9300000000000002 109.674 -179.716 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' B' B ' 338' ' ' PHE . . . . . 0.918 ' HA ' HG21 ' B' ' 332' ' ' ILE . 59.0 t80 -55.89 -55.11 36.48 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.16 -0.963 . . . . 0.37 109.873 -179.715 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' B' B ' 339' ' ' GLU . . . . . . . . . . . . . 45.0 mt-10 -50.65 -34.22 25.47 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.21 -0.931 . . . . 1.98 110.399 -179.435 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' B' B ' 340' ' ' MET . . . . . . . . . . . . . 23.9 ttp -64.01 -51.57 63.63 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.049 -1.032 . . . . 0.32000000000000001 110.115 -179.375 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' B' B ' 341' ' ' PHE . . . . . . . . . . . . . 44.8 m-85 -61.9 -45.46 93.65 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.167 -0.958 . . . . 0.17999999999999999 109.96 -179.451 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' B' B ' 342' ' ' ARG . . . . . 0.424 ' O ' ' HB3' ' B' ' 345' ' ' ASN . 41.1 ttt180 -50.62 -40.36 52.67 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.187 -0.946 . . . . 2.4199999999999999 109.933 -179.796 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' B' B ' 343' ' ' GLU . . . . . . . . . . . . . 35.4 tp10 -58.46 -51.51 69.53 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.192 -0.943 . . . . 2.3500000000000001 109.825 -179.604 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' B' B ' 344' ' ' LEU . . . . . 0.618 HD22 HD22 ' A' ' 344' ' ' LEU . 84.0 mt -61.01 -31.99 71.6 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.137 -0.977 . . . . 0.17999999999999999 109.345 -179.949 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' B' B ' 345' ' ' ASN . . . . . 0.44 HD22 HD21 ' D' ' 330' ' ' LEU . 9.0 t-20 -58.65 -55.06 39.98 Favored 'General case' 0 N--CA 1.488 1.451 0 O-C-N 121.325 -0.859 . . . . 1.0900000000000001 109.372 179.83 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' B' B ' 346' ' ' GLU . . . . . . . . . . . . . 32.4 tp10 -61.52 -32.21 72.25 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.478 -0.764 . . . . 1.6599999999999999 109.815 -179.867 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' B' B ' 347' ' ' ALA . . . . . 0.701 ' HB1' ' HB1' ' A' ' 347' ' ' ALA . . . -59.59 -56.95 15.51 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.166 -0.959 . . . . 0.17000000000000001 109.912 -179.756 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' B' B ' 348' ' ' LEU . . . . . 0.557 HD22 ' N ' ' B' ' 348' ' ' LEU . 3.5 mm? -61.92 -38.83 89.89 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.168 -0.957 . . . . 0.28999999999999998 109.71 -179.734 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' B' B ' 349' ' ' GLU . . . . . . . . . . . . . 1.8 mt-10 -58.67 -38.36 78.02 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.298 -0.876 . . . . 1.95 110.184 -179.583 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' B' B ' 350' ' ' LEU . . . . . 0.515 HD22 HD13 ' A' ' 350' ' ' LEU . 7.8 tt -63.81 -43.58 95.84 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.089 -1.007 . . . . 0.45000000000000001 109.827 -179.512 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' B' B ' 351' ' ' LYS . . . . . . . . . . . . . 18.7 tttm -58.39 -42.14 86.42 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.189 -0.944 . . . . 1.3799999999999999 109.53 -179.744 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' B' B ' 352' ' ' ASP . . . . . . . . . . . . . 48.5 m-20 -55.91 -41.6 74.79 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.284 -0.885 . . . . 1.1599999999999999 109.524 -179.996 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' B' B ' 353' ' ' ALA . . . . . 0.401 ' O ' ' HB2' ' B' ' 357' ' ' LYS . . . -68.03 -25.6 65.46 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.19 -0.944 . . . . 0.60999999999999999 109.494 -179.871 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' B' B ' 354' ' ' GLN . . . . . . . . . . . . . 2.5 mt-30 -81.22 -1.2 43.92 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.213 -0.929 . . . . 1.45 109.54 179.884 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' B' B ' 355' ' ' ALA . . . . . . . . . . . . . . . -69.25 -87.97 0.02 OUTLIER 'General case' 0 N--CA 1.489 1.495 0 O-C-N 121.217 -0.927 . . . . 0.97999999999999998 109.454 -179.939 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' B' B ' 356' ' ' GLY . . . . . . . . . . . . . . . -81.76 41.27 2.7 Favored Glycine 0 N--CA 1.492 2.367 0 N-CA-C 110.358 -1.097 . . . . 1.29 110.358 -179.923 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' B' B ' 357' ' ' LYS . . . . . 0.401 ' HB2' ' O ' ' B' ' 353' ' ' ALA . 24.9 tttp -87.65 97.28 10.79 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 120.897 -1.355 . . . . 4.0899999999999999 109.387 179.876 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' B' B ' 358' ' ' GLU . . . . . 0.591 ' N ' ' HD2' ' B' ' 359' ' ' PRO . 2.7 mt-10 -50.65 -53.31 47.78 Favored Pre-proline 0 N--CA 1.489 1.515 0 O-C-N 121.356 -0.84 . . . . 5.7199999999999998 110.008 -179.999 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' B' B ' 359' ' ' PRO . . . . . 0.591 ' HD2' ' N ' ' B' ' 358' ' ' GLU . 3.4 Cg_exo -61.93 131.89 37.1 Favored 'Trans proline' 0 C--N 1.312 -1.37 0 C-N-CA 121.902 1.734 . . . . 4.9800000000000004 110.358 -179.669 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' B' B ' 360' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.236 0 CA-C-O 118.053 -1.415 . . . . 6.9800000000000004 109.601 -179.987 . . . . . . . . 0 0 . 1 . 032 nuclear build full ' C' C ' 319' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.49 1.574 0 N-CA-C 109.442 -0.577 . . . . 6.8200000000000003 109.442 . . . . . . . . . 1 1 . 1 . 032 nuclear build full ' C' C ' 320' ' ' LYS . . . . . . . . . . . . . 8.9 mttt 60.02 160.31 0.04 OUTLIER 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.233 -0.917 . . . . 6.4900000000000002 109.567 -179.962 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' C' C ' 321' ' ' LYS . . . . . . . . . . . . . 1.2 ptmt -82.11 147.29 57.11 Favored Pre-proline 0 N--CA 1.49 1.548 0 O-C-N 121.244 -0.91 . . . . 6.4000000000000004 109.625 -179.771 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' C' C ' 322' ' ' PRO . . . . . . . . . . . . . 1.8 Cg_endo -64.3 -58.82 0.21 Allowed 'Trans proline' 0 C--N 1.31 -1.452 0 C-N-CA 122.35 2.033 . . . . 3.4199999999999999 110.608 -179.89 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' C' C ' 323' ' ' LEU . . . . . . . . . . . . . 12.8 mt -79.22 119.61 22.55 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.252 -0.905 . . . . 3.9500000000000002 110.0 -179.535 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' C' C ' 324' ' ' ASP . . . . . 0.466 ' CB ' ' OH ' ' C' ' 327' ' ' TYR . 2.5 m-20 -79.97 172.85 13.23 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.366 -0.834 . . . . 1.6299999999999999 109.378 179.637 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' C' C ' 325' ' ' GLY . . . . . 0.449 ' O ' ' CE2' ' C' ' 327' ' ' TYR . . . -68.44 178.92 22.09 Favored Glycine 0 N--CA 1.49 2.285 0 N-CA-C 109.501 -1.44 . . . . 0.72999999999999998 109.501 179.946 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' C' C ' 326' ' ' GLU . . . . . 0.463 ' OE1' ' HB2' ' A' ' 335' ' ' ARG . 95.0 mt-10 -58.14 -177.57 0.03 OUTLIER 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.227 -1.161 . . . . 2.1699999999999999 109.286 179.967 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' C' C ' 327' ' ' TYR . . . . . 0.466 ' OH ' ' CB ' ' C' ' 324' ' ' ASP . 59.0 m-85 -149.02 104.53 3.44 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.102 -0.999 . . . . 0.47999999999999998 109.808 -179.744 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' C' C ' 328' ' ' PHE . . . . . 0.505 ' O ' HG23 ' C' ' 329' ' ' THR . 96.3 m-85 -106.03 -164.53 1.02 Allowed 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.297 -0.877 . . . . 0.33000000000000002 109.303 179.654 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' C' C ' 329' ' ' THR . . . . . 0.505 HG23 ' O ' ' C' ' 328' ' ' PHE . 4.2 p -155.75 167.01 31.77 Favored 'General case' 0 N--CA 1.489 1.491 0 O-C-N 121.214 -0.929 . . . . 0.23000000000000001 109.751 -179.982 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' C' C ' 330' ' ' LEU . . . . . . . . . . . . . 40.3 tp -150.94 125.57 9.62 Favored 'General case' 0 N--CA 1.488 1.471 0 O-C-N 121.321 -0.862 . . . . 0.28000000000000003 109.174 179.802 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' C' C ' 331' ' ' GLN . . . . . . . . . . . . . 3.5 tp60 -87.45 113.06 22.81 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.164 -0.96 . . . . 1.48 109.732 -179.857 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' C' C ' 332' ' ' ILE . . . . . . . . . . . . . 31.7 mt -103.77 109.5 27.32 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.643 0 O-C-N 121.25 -0.906 . . . . 0.23999999999999999 109.537 179.871 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' C' C ' 333' ' ' ARG . . . . . 0.475 ' HG3' ' NH1' ' C' ' 333' ' ' ARG . 16.0 mtm-85 -73.86 149.7 41.39 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.227 -0.921 . . . . 2.7400000000000002 109.428 179.786 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' C' C ' 334' ' ' GLY . . . . . . . . . . . . . . . 76.72 132.16 0.47 Allowed Glycine 0 N--CA 1.49 2.289 0 N-CA-C 109.6 -1.4 . . . . 0.34999999999999998 109.6 179.903 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' C' C ' 335' ' ' ARG . . . . . 0.425 ' O ' ' HB3' ' C' ' 338' ' ' PHE . 2.6 tmt_? -76.45 -30.74 57.47 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.309 -1.112 . . . . 2.5299999999999998 109.647 179.943 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' C' C ' 336' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -55.81 -57.11 13.39 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.322 -0.861 . . . . 2.6200000000000001 109.959 -179.603 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' C' C ' 337' ' ' ARG . . . . . 0.548 ' NH1' ' HG3' ' C' ' 337' ' ' ARG . 1.4 mtm-85 -60.82 -30.56 70.16 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.098 -1.002 . . . . 2.8100000000000001 109.718 -179.839 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' C' C ' 338' ' ' PHE . . . . . 0.425 ' HB3' ' O ' ' C' ' 335' ' ' ARG . 75.9 t80 -54.0 -59.84 4.11 Favored 'General case' 0 N--CA 1.489 1.49 0 O-C-N 121.306 -0.871 . . . . 0.40000000000000002 110.265 -179.257 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' C' C ' 339' ' ' GLU . . . . . . . . . . . . . 1.1 mt-10 -50.0 -37.75 34.07 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.024 -1.048 . . . . 2.0499999999999998 110.58 -179.283 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' C' C ' 340' ' ' MET . . . . . . . . . . . . . 25.9 ttp -63.62 -54.8 30.16 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.034 -1.041 . . . . 0.32000000000000001 110.426 -179.097 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' C' C ' 341' ' ' PHE . . . . . . . . . . . . . 59.5 m-85 -61.8 -58.49 7.77 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.117 -0.989 . . . . 0.17999999999999999 110.006 -179.298 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' C' C ' 342' ' ' ARG . . . . . 0.455 ' CG ' ' NH1' ' C' ' 342' ' ' ARG . 0.0 OUTLIER -48.21 -32.5 7.2 Favored 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.186 -0.946 . . . . 2.9100000000000001 109.813 -179.723 . . . . . . . . 3 3 . 1 . 032 nuclear build full ' C' C ' 343' ' ' GLU . . . . . . . . . . . . . 10.0 tp10 -58.72 -55.52 33.97 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.149 -0.97 . . . . 2.1400000000000001 109.458 -179.895 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' C' C ' 344' ' ' LEU . . . . . 1.118 HD22 HD22 ' D' ' 344' ' ' LEU . 43.3 mt -62.16 -28.7 69.84 Favored 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.241 -0.912 . . . . 0.22 109.361 179.833 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' C' C ' 345' ' ' ASN . . . . . . . . . . . . . 15.8 t-20 -56.33 -56.56 19.5 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.247 -0.908 . . . . 1.0800000000000001 109.53 -179.996 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' C' C ' 346' ' ' GLU . . . . . . . . . . . . . 61.6 tt0 -61.17 -30.66 70.53 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.227 -0.92 . . . . 2.21 109.592 -179.831 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' C' C ' 347' ' ' ALA . . . . . 0.84 ' HB1' ' HB1' ' D' ' 347' ' ' ALA . . . -59.82 -54.73 42.79 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.284 -0.885 . . . . 0.17999999999999999 109.94 -179.726 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' C' C ' 348' ' ' LEU . . . . . 0.565 ' N ' HD22 ' C' ' 348' ' ' LEU . 3.3 mm? -62.31 -43.58 98.5 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.257 -0.902 . . . . 0.32000000000000001 109.768 -179.664 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' C' C ' 349' ' ' GLU . . . . . . . . . . . . . 67.6 mm-40 -59.26 -32.71 70.26 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.192 -0.943 . . . . 2.1899999999999999 110.386 -179.242 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' C' C ' 350' ' ' LEU . . . . . 0.696 HD13 HD22 ' D' ' 350' ' ' LEU . 6.1 tt -62.67 -49.57 74.62 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 120.953 -1.092 . . . . 0.46000000000000002 109.562 -179.702 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' C' C ' 351' ' ' LYS . . . . . . . . . . . . . 73.2 tttt -57.83 -44.03 86.17 Favored 'General case' 0 C--N 1.303 -1.437 0 O-C-N 121.176 -0.953 . . . . 1.3500000000000001 109.393 -179.777 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' C' C ' 352' ' ' ASP . . . . . . . . . . . . . 42.4 m-20 -58.36 -39.79 80.5 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.333 -0.855 . . . . 1.1899999999999999 110.015 179.918 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' C' C ' 353' ' ' ALA . . . . . . . . . . . . . . . -66.62 -21.42 66.12 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.177 -0.952 . . . . 0.56999999999999995 110.27 -179.246 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' C' C ' 354' ' ' GLN . . . . . . . . . . . . . 29.8 mt-30 -82.94 -22.67 33.74 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 120.974 -1.079 . . . . 1.47 109.163 179.884 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' C' C ' 355' ' ' ALA . . . . . . . . . . . . . . . -74.09 -6.97 50.78 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.339 -0.851 . . . . 0.93000000000000005 109.365 179.428 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' C' C ' 356' ' ' GLY . . . . . . . . . . . . . . . -80.25 -78.35 0.92 Allowed Glycine 0 N--CA 1.491 2.325 0 N-CA-C 109.801 -1.32 . . . . 1.3300000000000001 109.801 -179.588 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' C' C ' 357' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -83.01 143.88 30.33 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.255 -1.144 . . . . 4.0099999999999998 109.744 -179.469 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' C' C ' 358' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -49.64 130.88 19.94 Favored Pre-proline 0 N--CA 1.488 1.463 0 O-C-N 121.319 -0.863 . . . . 5.75 109.248 179.999 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' C' C ' 359' ' ' PRO . . . . . . . . . . . . . 5.1 Cg_exo -59.3 -153.65 0.01 OUTLIER 'Trans proline' 0 C--N 1.311 -1.436 0 C-N-CA 121.943 1.762 . . . . 4.9400000000000004 110.267 -179.99 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' C' C ' 360' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.318 0 CA-C-O 118.078 -1.401 . . . . 6.5 109.601 -179.957 . . . . . . . . 0 0 . 1 . 032 nuclear build full ' D' D ' 319' ' ' LYS . . . . . 0.446 ' O ' ' O ' ' D' ' 320' ' ' LYS . 4.5 mtpt . . . . . 0 N--CA 1.49 1.569 0 N-CA-C 109.504 -0.554 . . . . 7.5300000000000002 109.504 . . . . . . . . . 1 1 . 1 . 032 nuclear build full ' D' D ' 320' ' ' LYS . . . . . 0.446 ' O ' ' O ' ' D' ' 319' ' ' LYS . 2.1 mtmt 61.76 138.43 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.364 -0.835 . . . . 6.4100000000000001 109.513 179.972 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' D' D ' 321' ' ' LYS . . . . . . . . . . . . . 19.7 mttt -159.16 111.01 1.55 Allowed Pre-proline 0 N--CA 1.49 1.541 0 O-C-N 121.269 -0.895 . . . . 6.1100000000000003 109.527 -179.914 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' D' D ' 322' ' ' PRO . . . . . . . . . . . . . 3.6 Cg_exo -59.94 -158.78 0.02 OUTLIER 'Trans proline' 0 C--N 1.312 -1.394 0 C-N-CA 121.755 1.636 . . . . 2.8199999999999998 110.077 179.917 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' D' D ' 323' ' ' LEU . . . . . . . . . . . . . 46.2 mt -80.45 127.42 32.39 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.205 -0.935 . . . . 2.8300000000000001 109.315 179.96 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' D' D ' 324' ' ' ASP . . . . . . . . . . . . . 13.2 m-20 -78.93 164.12 24.69 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.16 -0.962 . . . . 1.54 109.447 -179.897 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' D' D ' 325' ' ' GLY . . . . . . . . . . . . . . . -66.95 178.52 15.78 Favored Glycine 0 N--CA 1.489 2.169 0 N-CA-C 109.313 -1.515 . . . . 0.58999999999999997 109.313 -179.995 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' D' D ' 326' ' ' GLU . . . . . 0.439 ' HB2' ' CE1' ' D' ' 328' ' ' PHE . 45.0 mt-10 -56.95 -168.42 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.169 -1.194 . . . . 2.1299999999999999 109.356 -179.979 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' D' D ' 327' ' ' TYR . . . . . . . . . . . . . 44.7 m-85 -149.24 109.1 4.05 Favored 'General case' 0 N--CA 1.488 1.43 0 O-C-N 121.358 -0.839 . . . . 0.46999999999999997 109.276 179.925 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' D' D ' 328' ' ' PHE . . . . . 0.439 ' CE1' ' HB2' ' D' ' 326' ' ' GLU . 40.4 m-85 -113.58 -169.36 1.49 Allowed 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.236 -0.915 . . . . 0.29999999999999999 109.533 -179.775 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' D' D ' 329' ' ' THR . . . . . 0.425 ' HA ' ' O ' ' B' ' 330' ' ' LEU . 6.7 p -153.38 168.52 25.81 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.314 -0.866 . . . . 0.22 109.181 -179.979 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' D' D ' 330' ' ' LEU . . . . . 0.44 HD21 HD22 ' B' ' 345' ' ' ASN . 19.9 tp -150.02 129.13 12.71 Favored 'General case' 0 N--CA 1.489 1.491 0 O-C-N 121.14 -0.975 . . . . 0.28000000000000003 109.686 -179.868 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' D' D ' 331' ' ' GLN . . . . . . . . . . . . . 1.2 tp60 -87.96 113.21 23.39 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.299 -0.875 . . . . 0.93000000000000005 109.382 179.747 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' D' D ' 332' ' ' ILE . . . . . 0.927 HG21 ' HA ' ' D' ' 338' ' ' PHE . 74.7 mt -103.41 104.96 17.46 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.538 0 O-C-N 121.235 -0.915 . . . . 0.25 109.51 -179.985 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' D' D ' 333' ' ' ARG . . . . . 0.457 ' NH1' ' HG2' ' D' ' 333' ' ' ARG . 0.0 OUTLIER -71.47 150.78 44.55 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.246 -0.909 . . . . 2.9300000000000002 109.246 179.84 . . . . . . . . 3 3 . 1 . 032 nuclear build full ' D' D ' 334' ' ' GLY . . . . . . . . . . . . . . . 76.18 126.81 0.24 Allowed Glycine 0 N--CA 1.491 2.304 0 N-CA-C 109.475 -1.45 . . . . 0.40999999999999998 109.475 -179.996 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' D' D ' 335' ' ' ARG . . . . . 0.401 ' HA ' ' CE1' ' B' ' 328' ' ' PHE . 0.4 OUTLIER -74.05 -32.78 63.46 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.31 -1.112 . . . . 3.0299999999999998 109.63 -179.859 . . . . . . . . 3 3 . 1 . 032 nuclear build full ' D' D ' 336' ' ' GLU . . . . . . . . . . . . . 3.2 mt-10 -58.06 -61.53 2.48 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.221 -0.925 . . . . 2.2599999999999998 109.795 -179.762 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' D' D ' 337' ' ' ARG . . . . . . . . . . . . . 22.3 mmm180 -59.84 -33.61 71.99 Favored 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.319 -0.863 . . . . 2.9199999999999999 109.651 -179.678 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' D' D ' 338' ' ' PHE . . . . . 0.927 ' HA ' HG21 ' D' ' 332' ' ' ILE . 58.6 t80 -55.99 -55.03 37.69 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.217 -0.927 . . . . 0.37 109.916 -179.697 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' D' D ' 339' ' ' GLU . . . . . . . . . . . . . 44.7 mt-10 -50.8 -34.12 26.25 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.262 -0.899 . . . . 1.99 110.41 -179.411 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' D' D ' 340' ' ' MET . . . . . . . . . . . . . 23.9 ttp -64.14 -51.41 64.03 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.045 -1.035 . . . . 0.31 110.132 -179.413 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' D' D ' 341' ' ' PHE . . . . . . . . . . . . . 44.7 m-85 -61.93 -45.5 93.42 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.179 -0.951 . . . . 0.17999999999999999 109.972 -179.462 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' D' D ' 342' ' ' ARG . . . . . 0.423 ' O ' ' HB3' ' D' ' 345' ' ' ASN . 41.5 ttt180 -50.64 -40.31 52.79 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.141 -0.974 . . . . 2.4100000000000001 109.876 -179.751 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' D' D ' 343' ' ' GLU . . . . . . . . . . . . . 36.0 tp10 -58.36 -51.67 68.82 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.183 -0.948 . . . . 2.3500000000000001 109.77 -179.673 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' D' D ' 344' ' ' LEU . . . . . 1.118 HD22 HD22 ' C' ' 344' ' ' LEU . 84.7 mt -60.91 -32.0 71.5 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.221 -0.925 . . . . 0.19 109.425 -179.952 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' D' D ' 345' ' ' ASN . . . . . 0.477 HD22 HD21 ' B' ' 330' ' ' LEU . 9.1 t-20 -58.69 -55.2 38.09 Favored 'General case' 0 N--CA 1.489 1.487 0 O-C-N 121.351 -0.843 . . . . 1.0900000000000001 109.303 179.867 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' D' D ' 346' ' ' GLU . . . . . . . . . . . . . 31.5 tp10 -61.4 -32.2 72.13 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.35 -0.844 . . . . 1.6899999999999999 109.839 -179.85 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' D' D ' 347' ' ' ALA . . . . . 0.84 ' HB1' ' HB1' ' C' ' 347' ' ' ALA . . . -59.61 -56.94 15.63 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.128 -0.983 . . . . 0.17999999999999999 109.78 -179.669 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' D' D ' 348' ' ' LEU . . . . . 0.555 HD22 ' N ' ' D' ' 348' ' ' LEU . 3.5 mm? -61.96 -38.79 89.84 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.195 -0.941 . . . . 0.31 109.625 -179.662 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' D' D ' 349' ' ' GLU . . . . . . . . . . . . . 1.8 mt-10 -58.83 -38.17 78.07 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.293 -0.879 . . . . 1.95 110.183 -179.514 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' D' D ' 350' ' ' LEU . . . . . 0.696 HD22 HD13 ' C' ' 350' ' ' LEU . 7.8 tt -63.96 -43.61 95.3 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.091 -1.006 . . . . 0.42999999999999999 109.852 -179.505 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' D' D ' 351' ' ' LYS . . . . . . . . . . . . . 18.7 tttm -58.32 -42.03 85.85 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.305 -0.872 . . . . 1.3999999999999999 109.561 -179.758 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' D' D ' 352' ' ' ASP . . . . . . . . . . . . . 49.0 m-20 -56.04 -41.57 75.22 Favored 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.203 -0.936 . . . . 1.1699999999999999 109.579 179.972 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' D' D ' 353' ' ' ALA . . . . . 0.403 ' O ' ' HB2' ' D' ' 357' ' ' LYS . . . -67.84 -25.72 65.69 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.204 -0.935 . . . . 0.58999999999999997 109.513 -179.97 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' D' D ' 354' ' ' GLN . . . . . . . . . . . . . 2.6 mt-30 -81.38 -1.24 44.76 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.26 -0.9 . . . . 1.4399999999999999 109.474 -179.971 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' D' D ' 355' ' ' ALA . . . . . . . . . . . . . . . -69.06 -87.91 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.172 -0.955 . . . . 0.97999999999999998 109.446 179.95 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' D' D ' 356' ' ' GLY . . . . . . . . . . . . . . . -81.77 41.15 2.69 Favored Glycine 0 N--CA 1.492 2.368 0 N-CA-C 110.356 -1.097 . . . . 1.28 110.356 -179.888 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' D' D ' 357' ' ' LYS . . . . . 0.403 ' HB2' ' O ' ' D' ' 353' ' ' ALA . 24.6 tttp -87.47 97.59 10.92 Favored 'General case' 0 N--CA 1.489 1.488 0 O-C-N 120.775 -1.426 . . . . 4.0899999999999999 109.441 179.888 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' D' D ' 358' ' ' GLU . . . . . 0.574 ' N ' ' HD2' ' D' ' 359' ' ' PRO . 2.7 mt-10 -51.02 -53.45 48.13 Favored Pre-proline 0 N--CA 1.489 1.507 0 O-C-N 121.377 -0.827 . . . . 5.71 109.988 -179.97 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' D' D ' 359' ' ' PRO . . . . . 0.574 ' HD2' ' N ' ' D' ' 358' ' ' GLU . 3.4 Cg_exo -61.64 132.07 38.64 Favored 'Trans proline' 0 C--N 1.311 -1.425 0 C-N-CA 121.977 1.785 . . . . 4.9699999999999998 110.285 -179.739 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' D' D ' 360' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.334 0 CA-C-O 117.996 -1.447 . . . . 6.9699999999999998 109.522 -179.999 . . . . . . . . 0 0 . 1 . 033 nuclear build full ' A' A ' 319' ' ' LYS . . . . . . . . . . . . . 60.7 mmtt . . . . . 0 N--CA 1.492 1.649 0 N-CA-C 109.628 -0.508 . . . . 7.5499999999999998 109.628 . . . . . . . . . 0 0 . 1 . 033 nuclear build full ' A' A ' 320' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER 59.34 -171.96 0.12 Allowed 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.194 -0.941 . . . . 6.4299999999999997 109.291 -179.959 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' A' A ' 321' ' ' LYS . . . . . . . . . . . . . 2.5 ttmm -158.7 69.48 3.59 Favored Pre-proline 0 N--CA 1.493 1.683 0 O-C-N 121.161 -0.962 . . . . 6.1299999999999999 109.961 -179.913 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 322' ' ' PRO . . . . . . . . . . . . . 1.9 Cg_endo -60.6 -155.97 0.02 OUTLIER 'Trans proline' 0 C--N 1.311 -1.411 0 C-N-CA 122.155 1.903 . . . . 2.8300000000000001 110.164 179.526 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 323' ' ' LEU . . . . . 0.507 HD23 ' HA ' ' A' ' 323' ' ' LEU . 34.4 mt -81.12 126.49 31.53 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.221 -0.924 . . . . 2.8300000000000001 109.317 179.789 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' A' A ' 324' ' ' ASP . . . . . 0.436 ' HB3' ' CE2' ' A' ' 327' ' ' TYR . 14.8 m-20 -80.27 143.58 33.56 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.185 -0.947 . . . . 1.53 109.609 -179.779 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' A' A ' 325' ' ' GLY . . . . . . . . . . . . . . . -68.16 -172.6 6.95 Favored Glycine 0 N--CA 1.488 2.167 0 N-CA-C 108.943 -1.663 . . . . 0.60999999999999999 108.943 179.843 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 326' ' ' GLU . . . . . . . . . . . . . 33.9 mm-40 -58.94 -175.96 0.03 OUTLIER 'General case' 0 N--CA 1.489 1.489 0 O-C-N 121.395 -1.062 . . . . 2.1299999999999999 109.603 179.925 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 327' ' ' TYR . . . . . 0.436 ' CE2' ' HB3' ' A' ' 324' ' ' ASP . 39.4 m-85 -149.83 105.81 3.45 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.256 -0.903 . . . . 0.47999999999999998 109.638 179.928 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' A' A ' 328' ' ' PHE . . . . . 0.566 ' CZ ' ' HB2' ' C' ' 335' ' ' ARG . 24.7 m-85 -113.29 -166.51 1.09 Allowed 'General case' 0 N--CA 1.488 1.443 0 O-C-N 121.357 -0.84 . . . . 0.31 109.192 179.799 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' A' A ' 329' ' ' THR . . . . . . . . . . . . . 71.2 p -153.94 173.99 15.23 Favored 'General case' 0 N--CA 1.495 1.814 0 O-C-N 121.395 -0.815 . . . . 0.22 109.18 179.559 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 330' ' ' LEU . . . . . . . . . . . . . 17.2 tp -150.41 131.0 13.93 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.314 -0.866 . . . . 0.28000000000000003 109.394 179.845 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 331' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -87.48 112.26 22.02 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.362 -0.837 . . . . 0.91000000000000003 109.124 179.793 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' A' A ' 332' ' ' ILE . . . . . 0.91 HG21 ' HA ' ' A' ' 338' ' ' PHE . 79.5 mt -103.47 105.79 18.98 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.477 0 O-C-N 121.075 -1.015 . . . . 0.26000000000000001 109.736 -179.858 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' A' A ' 333' ' ' ARG . . . . . 0.638 ' HG2' ' CE2' ' C' ' 327' ' ' TYR . 25.9 mtt180 -72.38 148.26 45.42 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.44 -0.787 . . . . 2.9199999999999999 109.871 179.914 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' A' A ' 334' ' ' GLY . . . . . . . . . . . . . . . 82.69 134.81 2.19 Favored Glycine 0 N--CA 1.491 2.322 0 N-CA-C 109.856 -1.297 . . . . 0.40000000000000002 109.856 179.784 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 335' ' ' ARG . . . . . 0.455 ' HA ' ' CE1' ' C' ' 328' ' ' PHE . 0.0 OUTLIER -80.37 -39.75 27.89 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.338 -1.095 . . . . 3.0099999999999998 109.653 179.997 . . . . . . . . 3 3 . 1 . 033 nuclear build full ' A' A ' 336' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -58.82 -61.48 2.59 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.14 -0.975 . . . . 2.29 109.891 -179.657 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' A' A ' 337' ' ' ARG . . . . . 0.46 ' CG ' HH11 ' A' ' 337' ' ' ARG . 0.0 OUTLIER -58.09 -30.92 66.62 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.19 -0.943 . . . . 2.9300000000000002 109.529 -179.76 . . . . . . . . 3 3 . 1 . 033 nuclear build full ' A' A ' 338' ' ' PHE . . . . . 0.91 ' HA ' HG21 ' A' ' 332' ' ' ILE . 50.4 t80 -55.78 -56.37 21.33 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.306 -0.871 . . . . 0.38 109.527 -179.872 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' A' A ' 339' ' ' GLU . . . . . . . . . . . . . 48.9 mt-10 -50.88 -33.27 23.32 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.231 -0.918 . . . . 1.97 109.875 -179.965 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 340' ' ' MET . . . . . . . . . . . . . 18.7 ttp -62.22 -53.3 57.14 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.29 -0.881 . . . . 0.31 110.008 -179.416 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 341' ' ' PHE . . . . . 0.425 ' HB2' HD13 ' A' ' 332' ' ' ILE . 36.9 m-85 -61.2 -49.32 77.62 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.206 -0.934 . . . . 0.17999999999999999 110.202 -179.616 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' A' A ' 342' ' ' ARG . . . . . . . . . . . . . 4.2 ttt180 -47.43 -41.06 19.45 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.368 -0.832 . . . . 2.4199999999999999 109.821 -179.972 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 343' ' ' GLU . . . . . . . . . . . . . 65.2 tt0 -59.26 -47.94 83.49 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.156 -0.965 . . . . 2.3500000000000001 110.285 -179.586 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 344' ' ' LEU . . . . . . . . . . . . . 47.7 mt -63.16 -32.36 73.73 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.08 -1.013 . . . . 0.17999999999999999 110.063 -179.431 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 345' ' ' ASN . . . . . 0.442 ' HB2' HD21 ' C' ' 330' ' ' LEU . 10.8 t-20 -57.96 -55.38 35.65 Favored 'General case' 0 N--CA 1.488 1.47 0 O-C-N 121.19 -0.944 . . . . 1.0900000000000001 109.637 -179.756 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' A' A ' 346' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -61.55 -29.74 70.2 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.211 -0.93 . . . . 1.6499999999999999 109.977 -179.844 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' A' A ' 347' ' ' ALA . . . . . 0.553 ' HB1' ' HB1' ' B' ' 347' ' ' ALA . . . -59.34 -58.93 6.47 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.278 -0.889 . . . . 0.17999999999999999 110.237 -179.534 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' A' A ' 348' ' ' LEU . . . . . 0.607 HD22 ' N ' ' A' ' 348' ' ' LEU . 4.1 mm? -61.2 -42.7 99.05 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.162 -0.961 . . . . 0.29999999999999999 110.005 -179.365 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' A' A ' 349' ' ' GLU . . . . . . . . . . . . . 16.2 mm-40 -57.87 -34.05 69.34 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.207 -0.933 . . . . 1.9399999999999999 109.997 -179.493 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 350' ' ' LEU . . . . . 0.544 HD22 HD22 ' B' ' 350' ' ' LEU . 6.2 tt -64.43 -44.3 91.64 Favored 'General case' 0 N--CA 1.495 1.783 0 O-C-N 121.194 -0.941 . . . . 0.46000000000000002 109.651 -179.592 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' A' A ' 351' ' ' LYS . . . . . . . . . . . . . 43.8 tttt -60.46 -46.82 88.69 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.246 -0.909 . . . . 1.3999999999999999 109.859 -179.694 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 352' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -54.86 -44.89 74.43 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.416 -0.803 . . . . 1.1599999999999999 110.377 -179.288 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' A' A ' 353' ' ' ALA . . . . . . . . . . . . . . . -66.68 -26.98 67.29 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 120.95 -1.093 . . . . 0.63 109.608 -179.804 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 354' ' ' GLN . . . . . . . . . . . . . 46.8 tt0 -82.88 -3.52 57.01 Favored 'General case' 0 N--CA 1.488 1.475 0 O-C-N 121.001 -1.062 . . . . 1.47 109.825 -179.749 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 355' ' ' ALA . . . . . . . . . . . . . . . -69.97 -6.99 36.97 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.249 -0.907 . . . . 1.01 109.364 -179.938 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 356' ' ' GLY . . . . . . . . . . . . . . . -80.59 -8.08 87.89 Favored Glycine 0 N--CA 1.487 2.08 0 N-CA-C 109.886 -1.286 . . . . 1.3 109.886 -179.985 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 357' ' ' LYS . . . . . . . . . . . . . 6.1 mttm -91.56 115.0 27.68 Favored 'General case' 0 N--CA 1.488 1.433 0 O-C-N 121.315 -1.109 . . . . 4.0999999999999996 109.608 179.875 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 358' ' ' GLU . . . . . . . . . . . . . 50.7 tt0 -43.93 135.43 3.86 Favored Pre-proline 0 N--CA 1.492 1.634 0 O-C-N 121.235 -0.916 . . . . 5.75 109.159 179.797 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 359' ' ' PRO . . . . . . . . . . . . . 2.8 Cg_endo -62.82 122.76 11.18 Favored 'Trans proline' 0 C--N 1.31 -1.496 0 C-N-CA 121.859 1.706 . . . . 5.0 109.945 -179.775 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 360' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.488 2.152 0 N-CA-C 109.318 -1.513 . . . . 6.9699999999999998 109.318 179.83 . . . . . . . . 0 0 . 1 . 033 nuclear build full ' B' B ' 319' ' ' LYS . . . . . . . . . . . . . 51.7 mmtt . . . . . 0 N--CA 1.49 1.562 0 CA-C-O 121.386 0.612 . . . . 7.5499999999999998 109.588 . . . . . . . . . 0 0 . 1 . 033 nuclear build full ' B' B ' 320' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER 56.75 -171.25 0.09 Allowed 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.066 -1.021 . . . . 6.4400000000000004 109.271 -179.772 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' B' B ' 321' ' ' LYS . . . . . . . . . . . . . 4.2 ttmm -158.74 69.48 3.57 Favored Pre-proline 0 N--CA 1.491 1.611 0 O-C-N 121.288 -0.882 . . . . 6.1299999999999999 109.755 -179.906 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' B' B ' 322' ' ' PRO . . . . . . . . . . . . . 2.1 Cg_endo -60.99 -156.83 0.02 OUTLIER 'Trans proline' 0 C--N 1.309 -1.526 0 C-N-CA 122.138 1.892 . . . . 2.8199999999999998 109.959 179.884 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' B' B ' 323' ' ' LEU . . . . . 0.419 HD23 ' HA ' ' B' ' 323' ' ' LEU . 29.2 mt -80.23 126.05 30.63 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.125 -0.984 . . . . 2.8399999999999999 109.493 -179.977 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' B' B ' 324' ' ' ASP . . . . . 0.44 ' HB3' ' CE2' ' B' ' 327' ' ' TYR . 17.8 m-20 -79.89 143.84 33.93 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.193 -0.942 . . . . 1.53 109.921 -179.855 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' B' B ' 325' ' ' GLY . . . . . . . . . . . . . . . -68.66 -172.64 7.64 Favored Glycine 0 N--CA 1.488 2.148 0 N-CA-C 109.528 -1.429 . . . . 0.58999999999999997 109.528 179.806 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' B' B ' 326' ' ' GLU . . . . . . . . . . . . . 35.1 mm-40 -58.53 -177.04 0.03 OUTLIER 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.464 -1.021 . . . . 2.1299999999999999 109.791 -179.97 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' B' B ' 327' ' ' TYR . . . . . 0.627 ' CE1' ' HG2' ' D' ' 333' ' ' ARG . 39.2 m-85 -150.02 104.38 3.28 Favored 'General case' 0 N--CA 1.489 1.487 0 O-C-N 121.325 -0.859 . . . . 0.47999999999999998 109.678 -179.957 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' B' B ' 328' ' ' PHE . . . . . . . . . . . . . 18.4 m-85 -112.43 -163.86 0.88 Allowed 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.287 -0.883 . . . . 0.32000000000000001 109.308 179.657 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' B' B ' 329' ' ' THR . . . . . 0.466 ' HA ' ' O ' ' D' ' 330' ' ' LEU . 67.1 p -154.76 176.3 12.63 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.28 -0.887 . . . . 0.23000000000000001 109.36 179.452 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' B' B ' 330' ' ' LEU . . . . . 0.501 HD21 ' HB2' ' D' ' 345' ' ' ASN . 18.3 tp -151.9 130.32 12.13 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.183 -0.948 . . . . 0.28000000000000003 109.138 179.653 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' B' B ' 331' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -87.38 111.95 21.62 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.221 -0.924 . . . . 0.91000000000000003 109.144 179.72 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' B' B ' 332' ' ' ILE . . . . . 0.85 HG21 ' HA ' ' B' ' 338' ' ' PHE . 72.0 mt -103.52 107.32 21.93 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.531 0 O-C-N 120.886 -1.134 . . . . 0.23999999999999999 109.659 -179.815 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' B' B ' 333' ' ' ARG . . . . . 0.63 ' HG2' ' CE1' ' D' ' 327' ' ' TYR . 27.2 mtt180 -73.9 147.96 42.69 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.356 -0.84 . . . . 2.9300000000000002 109.824 -179.857 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' B' B ' 334' ' ' GLY . . . . . . . . . . . . . . . 82.47 135.97 2.35 Favored Glycine 0 N--CA 1.488 2.118 0 N-CA-C 109.643 -1.383 . . . . 0.40000000000000002 109.643 179.799 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' B' B ' 335' ' ' ARG . . . . . 0.414 HH11 ' HG3' ' B' ' 335' ' ' ARG . 0.0 OUTLIER -80.68 -40.35 25.6 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.303 -1.116 . . . . 3.0099999999999998 109.96 -179.964 . . . . . . . . 3 3 . 1 . 033 nuclear build full ' B' B ' 336' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -58.61 -59.98 4.53 Favored 'General case' 0 N--CA 1.495 1.811 0 O-C-N 121.102 -0.999 . . . . 2.2799999999999998 109.989 -179.638 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' B' B ' 337' ' ' ARG . . . . . 0.461 ' CG ' ' NH1' ' B' ' 337' ' ' ARG . 0.0 OUTLIER -59.23 -29.97 67.9 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.113 -0.992 . . . . 2.9300000000000002 109.61 -179.674 . . . . . . . . 3 3 . 1 . 033 nuclear build full ' B' B ' 338' ' ' PHE . . . . . 0.85 ' HA ' HG21 ' B' ' 332' ' ' ILE . 51.8 t80 -56.83 -57.06 14.14 Favored 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.509 -0.745 . . . . 0.37 109.402 179.837 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' B' B ' 339' ' ' GLU . . . . . . . . . . . . . 48.3 mt-10 -50.91 -31.72 18.46 Favored 'General case' 0 N--CA 1.493 1.722 0 O-C-N 121.293 -0.879 . . . . 1.98 109.875 -179.774 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' B' B ' 340' ' ' MET . . . . . . . . . . . . . 18.8 ttp -63.88 -53.55 48.74 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.286 -0.884 . . . . 0.32000000000000001 110.04 -179.57 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' B' B ' 341' ' ' PHE . . . . . . . . . . . . . 37.5 m-85 -61.33 -49.0 78.76 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.232 -0.917 . . . . 0.17999999999999999 109.866 -179.481 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' B' B ' 342' ' ' ARG . . . . . . . . . . . . . 4.6 ttt180 -47.45 -40.91 19.34 Favored 'General case' 0 N--CA 1.493 1.717 0 O-C-N 121.171 -0.955 . . . . 2.4199999999999999 109.928 -179.756 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' B' B ' 343' ' ' GLU . . . . . . . . . . . . . 62.5 tt0 -59.42 -48.04 83.18 Favored 'General case' 0 N--CA 1.495 1.811 0 O-C-N 121.365 -0.835 . . . . 2.3500000000000001 110.302 -179.316 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' B' B ' 344' ' ' LEU . . . . . . . . . . . . . 37.6 mt -62.44 -33.26 74.47 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.192 -0.942 . . . . 0.17999999999999999 109.949 -179.485 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' B' B ' 345' ' ' ASN . . . . . 0.497 ' HB2' HD21 ' D' ' 330' ' ' LEU . 13.2 t-20 -56.92 -56.46 21.31 Favored 'General case' 0 C--N 1.299 -1.596 0 O-C-N 121.282 -0.886 . . . . 1.0900000000000001 109.862 -179.773 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' B' B ' 346' ' ' GLU . . . . . . . . . . . . . 1.3 tt0 -61.0 -28.59 69.14 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.224 -0.923 . . . . 1.6599999999999999 110.073 -179.627 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' B' B ' 347' ' ' ALA . . . . . 0.553 ' HB1' ' HB1' ' A' ' 347' ' ' ALA . . . -60.36 -57.69 11.68 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.118 -0.989 . . . . 0.17000000000000001 110.111 -179.421 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' B' B ' 348' ' ' LEU . . . . . 0.592 HD22 ' N ' ' B' ' 348' ' ' LEU . 4.1 mm? -62.05 -42.88 99.65 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.149 -0.97 . . . . 0.28999999999999998 110.159 -179.476 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' B' B ' 349' ' ' GLU . . . . . . . . . . . . . 13.7 mm-40 -57.91 -35.23 70.75 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.045 -1.034 . . . . 1.95 110.066 -179.488 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' B' B ' 350' ' ' LEU . . . . . 0.544 HD22 HD22 ' A' ' 350' ' ' LEU . 6.5 tt -62.74 -45.01 94.71 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.002 -1.061 . . . . 0.45000000000000001 109.53 -179.652 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' B' B ' 351' ' ' LYS . . . . . . . . . . . . . 37.8 tttt -59.87 -47.17 86.82 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.37 -0.831 . . . . 1.3799999999999999 109.764 -179.769 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' B' B ' 352' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -54.14 -44.86 71.74 Favored 'General case' 0 N--CA 1.488 1.449 0 O-C-N 121.341 -0.849 . . . . 1.1599999999999999 110.252 -179.441 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' B' B ' 353' ' ' ALA . . . . . . . . . . . . . . . -66.61 -29.43 69.47 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.026 -1.046 . . . . 0.60999999999999999 109.46 -179.848 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' B' B ' 354' ' ' GLN . . . . . . . . . . . . . 44.7 tt0 -81.06 -1.81 45.59 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.107 -0.996 . . . . 1.45 109.962 -179.622 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' B' B ' 355' ' ' ALA . . . . . . . . . . . . . . . -70.02 -7.27 39.6 Favored 'General case' 0 C--N 1.303 -1.434 0 O-C-N 121.025 -1.047 . . . . 0.97999999999999998 109.33 -179.992 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' B' B ' 356' ' ' GLY . . . . . . . . . . . . . . . -80.82 -6.23 89.54 Favored Glycine 0 N--CA 1.49 2.274 0 N-CA-C 110.001 -1.24 . . . . 1.29 110.001 -179.86 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' B' B ' 357' ' ' LYS . . . . . 0.424 ' O ' ' C ' ' B' ' 358' ' ' GLU . 5.3 mttm -91.38 113.92 26.31 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.127 -1.22 . . . . 4.0899999999999999 109.369 179.744 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' B' B ' 358' ' ' GLU . . . . . 0.424 ' C ' ' O ' ' B' ' 357' ' ' LYS . 69.9 tt0 -45.31 135.31 5.51 Favored Pre-proline 0 N--CA 1.489 1.493 0 O-C-N 121.305 -0.872 . . . . 5.7199999999999998 108.742 179.973 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' B' B ' 359' ' ' PRO . . . . . . . . . . . . . 2.3 Cg_endo -61.18 122.23 10.83 Favored 'Trans proline' 0 C--N 1.309 -1.545 0 C-N-CA 121.908 1.739 . . . . 4.9800000000000004 110.162 -179.551 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' B' B ' 360' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 2.405 0 N-CA-C 109.09 -1.604 . . . . 6.9800000000000004 109.09 179.903 . . . . . . . . 0 0 . 1 . 033 nuclear build full ' C' C ' 319' ' ' LYS . . . . . . . . . . . . . 2.9 tppt? . . . . . 0 N--CA 1.489 1.51 0 N-CA-C 109.418 -0.586 . . . . 6.8200000000000003 109.418 . . . . . . . . . 0 0 . 1 . 033 nuclear build full ' C' C ' 320' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 58.27 -176.77 0.08 Allowed 'General case' 0 C--N 1.304 -1.412 0 O-C-N 121.129 -0.982 . . . . 6.4900000000000002 109.645 179.958 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' C' C ' 321' ' ' LYS . . . . . . . . . . . . . 13.9 mttt 56.22 77.26 0.43 Allowed Pre-proline 0 N--CA 1.49 1.535 0 O-C-N 121.293 -0.879 . . . . 6.4000000000000004 109.407 179.926 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' C' C ' 322' ' ' PRO . . . . . . . . . . . . . 1.7 Cg_endo -64.04 -81.32 0.01 OUTLIER 'Trans proline' 0 C--N 1.31 -1.496 0 C-N-CA 122.284 1.989 . . . . 3.4199999999999999 110.184 -179.843 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' C' C ' 323' ' ' LEU . . . . . . . . . . . . . 38.8 mt -81.53 121.31 26.14 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 120.988 -1.07 . . . . 3.9500000000000002 109.884 -179.746 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' C' C ' 324' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -81.02 167.05 20.21 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.37 -0.831 . . . . 1.6299999999999999 109.144 179.451 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' C' C ' 325' ' ' GLY . . . . . . . . . . . . . . . -66.96 165.28 42.29 Favored Glycine 0 N--CA 1.487 2.074 0 N-CA-C 109.086 -1.606 . . . . 0.72999999999999998 109.086 179.782 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' C' C ' 326' ' ' GLU . . . . . . . . . . . . . 2.7 mp0 -57.07 -167.89 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.344 -1.091 . . . . 2.1699999999999999 109.608 179.968 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' C' C ' 327' ' ' TYR . . . . . 0.638 ' CE2' ' HG2' ' A' ' 333' ' ' ARG . 46.3 m-85 -147.21 104.74 3.69 Favored 'General case' 0 N--CA 1.487 1.413 0 O-C-N 121.263 -0.898 . . . . 0.47999999999999998 109.204 -179.959 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' C' C ' 328' ' ' PHE . . . . . 0.455 ' CE1' ' HA ' ' A' ' 335' ' ' ARG . 67.7 m-85 -106.87 -168.8 1.46 Allowed 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.287 -0.883 . . . . 0.33000000000000002 109.147 -179.915 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' C' C ' 329' ' ' THR . . . . . . . . . . . . . 18.0 p -150.97 167.03 28.85 Favored 'General case' 0 C--N 1.302 -1.498 0 O-C-N 121.472 -0.768 . . . . 0.23000000000000001 108.978 -179.847 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' C' C ' 330' ' ' LEU . . . . . 0.442 HD21 ' HB2' ' A' ' 345' ' ' ASN . 47.0 tp -150.92 127.7 10.93 Favored 'General case' 0 C--N 1.302 -1.488 0 O-C-N 121.2 -0.937 . . . . 0.28000000000000003 109.688 -179.491 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' C' C ' 331' ' ' GLN . . . . . . . . . . . . . 5.4 tp60 -86.71 113.41 22.54 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.375 -0.828 . . . . 1.48 109.488 179.903 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' C' C ' 332' ' ' ILE . . . . . 0.809 HG21 ' HA ' ' C' ' 338' ' ' PHE . 30.3 mt -105.2 109.49 27.88 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.51 0 O-C-N 121.547 -0.721 . . . . 0.23999999999999999 109.883 -179.853 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' C' C ' 333' ' ' ARG . . . . . . . . . . . . . 79.3 mtt180 -74.23 147.65 42.27 Favored 'General case' 0 C--N 1.302 -1.472 0 O-C-N 121.306 -0.871 . . . . 2.7400000000000002 109.635 179.781 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' C' C ' 334' ' ' GLY . . . . . . . . . . . . . . . 80.23 127.0 0.67 Allowed Glycine 0 N--CA 1.486 1.987 0 N-CA-C 109.361 -1.495 . . . . 0.34999999999999998 109.361 -179.857 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' C' C ' 335' ' ' ARG . . . . . 0.566 ' HB2' ' CZ ' ' A' ' 328' ' ' PHE . 0.0 OUTLIER -78.35 -33.12 49.29 Favored 'General case' 0 N--CA 1.487 1.412 0 O-C-N 121.201 -1.176 . . . . 2.5299999999999998 109.463 179.972 . . . . . . . . 3 3 . 1 . 033 nuclear build full ' C' C ' 336' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -57.52 -62.56 1.7 Allowed 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.127 -0.983 . . . . 2.6200000000000001 108.986 179.567 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' C' C ' 337' ' ' ARG . . . . . 0.541 ' HG2' ' NH1' ' C' ' 337' ' ' ARG . 0.2 OUTLIER -59.52 -31.61 69.55 Favored 'General case' 0 N--CA 1.489 1.483 0 O-C-N 121.745 -0.597 . . . . 2.8100000000000001 109.656 -179.886 . . . . . . . . 3 3 . 1 . 033 nuclear build full ' C' C ' 338' ' ' PHE . . . . . 0.809 ' HA ' HG21 ' C' ' 332' ' ' ILE . 46.3 t80 -54.52 -59.42 4.72 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.171 -0.956 . . . . 0.40000000000000002 109.755 -179.466 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' C' C ' 339' ' ' GLU . . . . . . . . . . . . . 9.9 mm-40 -48.32 -32.65 7.71 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.434 -0.792 . . . . 2.0499999999999998 110.247 -179.333 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' C' C ' 340' ' ' MET . . . . . . . . . . . . . 34.6 ttp -63.91 -50.88 66.96 Favored 'General case' 0 N--CA 1.494 1.742 0 O-C-N 121.251 -0.905 . . . . 0.32000000000000001 109.818 -179.809 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' C' C ' 341' ' ' PHE . . . . . . . . . . . . . 49.7 m-85 -62.83 -52.91 61.3 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 120.959 -1.088 . . . . 0.17999999999999999 109.762 -179.804 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' C' C ' 342' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -47.81 -39.96 19.76 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.442 -0.786 . . . . 2.9100000000000001 110.005 -179.428 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' C' C ' 343' ' ' GLU . . . . . . . . . . . . . 4.5 tp10 -60.8 -44.88 96.27 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 120.974 -1.079 . . . . 2.1400000000000001 109.461 -179.998 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' C' C ' 344' ' ' LEU . . . . . 0.411 ' O ' ' HB3' ' C' ' 347' ' ' ALA . 27.0 mt -60.35 -41.02 92.8 Favored 'General case' 0 N--CA 1.487 1.395 0 O-C-N 121.294 -0.879 . . . . 0.22 109.593 -179.939 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' C' C ' 345' ' ' ASN . . . . . . . . . . . . . 48.9 t-20 -54.61 -53.7 51.24 Favored 'General case' 0 N--CA 1.489 1.488 0 O-C-N 121.313 -0.867 . . . . 1.0800000000000001 109.818 -179.664 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' C' C ' 346' ' ' GLU . . . . . . . . . . . . . 2.9 tp10 -58.58 -29.84 66.72 Favored 'General case' 0 C--N 1.303 -1.449 0 O-C-N 121.108 -0.995 . . . . 2.21 109.362 -179.872 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' C' C ' 347' ' ' ALA . . . . . 0.655 ' HB1' ' HB1' ' D' ' 347' ' ' ALA . . . -63.12 -51.82 65.0 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.16 -0.962 . . . . 0.17999999999999999 109.766 179.943 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' C' C ' 348' ' ' LEU . . . . . 0.619 ' N ' HD22 ' C' ' 348' ' ' LEU . 3.6 mm? -62.88 -43.6 98.35 Favored 'General case' 0 N--CA 1.494 1.743 0 O-C-N 121.04 -1.038 . . . . 0.32000000000000001 109.773 -179.619 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' C' C ' 349' ' ' GLU . . . . . . . . . . . . . 3.1 mm-40 -59.25 -36.82 76.19 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.284 -0.885 . . . . 2.1899999999999999 110.085 -179.376 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' C' C ' 350' ' ' LEU . . . . . 0.614 HD13 HD22 ' D' ' 350' ' ' LEU . 5.5 tt -62.75 -48.91 77.13 Favored 'General case' 0 C--N 1.302 -1.466 0 O-C-N 121.12 -0.987 . . . . 0.46000000000000002 109.29 -179.775 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' C' C ' 351' ' ' LYS . . . . . . . . . . . . . 27.4 tttm -58.23 -39.66 79.67 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.198 -0.939 . . . . 1.3500000000000001 109.06 179.662 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' C' C ' 352' ' ' ASP . . . . . . . . . . . . . 96.2 m-20 -54.44 -31.7 55.96 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.334 -0.853 . . . . 1.1899999999999999 109.579 179.888 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' C' C ' 353' ' ' ALA . . . . . . . . . . . . . . . -64.24 -37.02 85.99 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.42 -0.8 . . . . 0.56999999999999995 109.631 -179.626 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' C' C ' 354' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -81.97 -2.28 50.94 Favored 'General case' 0 N--CA 1.489 1.489 0 O-C-N 121.215 -0.928 . . . . 1.47 110.329 -179.423 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' C' C ' 355' ' ' ALA . . . . . . . . . . . . . . . -73.42 -4.89 36.42 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 120.962 -1.086 . . . . 0.93000000000000005 110.11 -179.907 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' C' C ' 356' ' ' GLY . . . . . . . . . . . . . . . -80.97 -12.77 82.24 Favored Glycine 0 N--CA 1.494 2.558 0 C-N-CA 119.569 -1.3 . . . . 1.3300000000000001 110.021 -179.699 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' C' C ' 357' ' ' LYS . . . . . 0.423 ' O ' ' HD3' ' C' ' 359' ' ' PRO . 0.4 OUTLIER -91.89 99.77 12.56 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.199 -1.177 . . . . 4.0099999999999998 110.181 -179.812 . . . . . . . . 3 3 . 1 . 033 nuclear build full ' C' C ' 358' ' ' GLU . . . . . 0.509 ' CG ' ' O ' ' C' ' 358' ' ' GLU . 4.2 pt-20 -50.96 108.93 1.15 Allowed Pre-proline 0 N--CA 1.492 1.627 0 O-C-N 121.275 -0.89 . . . . 5.75 109.446 179.669 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' C' C ' 359' ' ' PRO . . . . . 0.423 ' HD3' ' O ' ' C' ' 357' ' ' LYS . 4.9 Cg_exo -58.9 113.45 1.58 Allowed 'Trans proline' 0 C--N 1.313 -1.34 0 C-N-CA 122.056 1.837 . . . . 4.9400000000000004 110.143 179.984 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' C' C ' 360' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.493 2.457 0 CA-C-O 117.884 -1.509 . . . . 6.5 109.673 -179.949 . . . . . . . . 0 0 . 1 . 033 nuclear build full ' D' D ' 319' ' ' LYS . . . . . . . . . . . . . 51.2 mmtt . . . . . 0 N--CA 1.49 1.569 0 CA-C-O 121.39 0.614 . . . . 7.5300000000000002 109.53 . . . . . . . . . 0 0 . 1 . 033 nuclear build full ' D' D ' 320' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER 56.42 -170.7 0.08 Allowed 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.181 -0.95 . . . . 6.4100000000000001 109.557 -179.696 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' D' D ' 321' ' ' LYS . . . . . . . . . . . . . 3.2 ttmm -158.8 68.23 3.38 Favored Pre-proline 0 N--CA 1.487 1.42 0 O-C-N 121.433 -0.792 . . . . 6.1100000000000003 109.622 -179.918 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' D' D ' 322' ' ' PRO . . . . . . . . . . . . . 1.6 Cg_endo -60.93 -157.87 0.02 OUTLIER 'Trans proline' 0 C--N 1.311 -1.441 0 C-N-CA 122.283 1.989 . . . . 2.8199999999999998 110.232 179.783 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' D' D ' 323' ' ' LEU . . . . . 0.435 ' HA ' HD23 ' D' ' 323' ' ' LEU . 34.0 mt -79.58 125.73 29.98 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.176 -0.952 . . . . 2.8300000000000001 109.211 -179.935 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' D' D ' 324' ' ' ASP . . . . . . . . . . . . . 22.9 m-20 -79.59 143.43 34.75 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.103 -0.998 . . . . 1.54 109.669 -179.731 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' D' D ' 325' ' ' GLY . . . . . . . . . . . . . . . -68.28 -173.53 7.83 Favored Glycine 0 N--CA 1.488 2.128 0 N-CA-C 109.194 -1.563 . . . . 0.58999999999999997 109.194 179.562 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' D' D ' 326' ' ' GLU . . . . . . . . . . . . . 41.3 mm-40 -59.27 -177.37 0.04 OUTLIER 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.286 -1.126 . . . . 2.1299999999999999 109.65 -179.948 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' D' D ' 327' ' ' TYR . . . . . 0.63 ' CE1' ' HG2' ' B' ' 333' ' ' ARG . 41.0 m-85 -148.78 105.49 3.56 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.281 -0.887 . . . . 0.46999999999999997 109.7 179.989 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' D' D ' 328' ' ' PHE . . . . . 0.404 ' C ' HG23 ' D' ' 329' ' ' THR . 22.1 m-85 -112.95 -165.44 0.99 Allowed 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.371 -0.83 . . . . 0.29999999999999999 109.176 179.582 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' D' D ' 329' ' ' THR . . . . . 0.47 ' HA ' ' O ' ' B' ' 330' ' ' LEU . 78.3 p -154.02 173.87 15.42 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.194 -0.941 . . . . 0.22 109.257 179.783 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' D' D ' 330' ' ' LEU . . . . . 0.497 HD21 ' HB2' ' B' ' 345' ' ' ASN . 21.5 tp -150.58 129.81 12.78 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.265 -0.897 . . . . 0.28000000000000003 109.212 179.639 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' D' D ' 331' ' ' GLN . . . . . . . . . . . . . 1.1 tt0 -86.98 112.83 22.21 Favored 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.165 -0.959 . . . . 0.93000000000000005 109.331 179.756 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' D' D ' 332' ' ' ILE . . . . . 0.847 HG21 ' HA ' ' D' ' 338' ' ' PHE . 73.5 mt -103.94 107.56 22.58 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.505 0 O-C-N 121.108 -0.995 . . . . 0.25 109.671 -179.784 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' D' D ' 333' ' ' ARG . . . . . 0.627 ' HG2' ' CE1' ' B' ' 327' ' ' TYR . 32.2 mtt180 -74.1 148.27 41.99 Favored 'General case' 0 C--N 1.304 -1.37 0 O-C-N 121.413 -0.804 . . . . 2.9300000000000002 109.672 -179.886 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' D' D ' 334' ' ' GLY . . . . . . . . . . . . . . . 82.84 134.48 2.17 Favored Glycine 0 N--CA 1.486 1.978 0 N-CA-C 109.598 -1.401 . . . . 0.40999999999999998 109.598 179.988 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' D' D ' 335' ' ' ARG . . . . . 0.403 HH11 ' HG3' ' D' ' 335' ' ' ARG . 0.0 OUTLIER -79.88 -40.8 27.54 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.4 -1.059 . . . . 3.0299999999999998 109.69 -179.795 . . . . . . . . 3 3 . 1 . 033 nuclear build full ' D' D ' 336' ' ' GLU . . . . . . . . . . . . . 1.7 mt-10 -58.66 -59.12 5.9 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.221 -0.924 . . . . 2.2599999999999998 110.044 -179.717 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' D' D ' 337' ' ' ARG . . . . . 0.447 ' CG ' HH11 ' D' ' 337' ' ' ARG . 0.0 OUTLIER -59.53 -31.91 69.83 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.142 -0.974 . . . . 2.9199999999999999 109.756 -179.657 . . . . . . . . 3 3 . 1 . 033 nuclear build full ' D' D ' 338' ' ' PHE . . . . . 0.847 ' HA ' HG21 ' D' ' 332' ' ' ILE . 46.7 t80 -55.66 -56.7 17.27 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.259 -0.901 . . . . 0.37 109.783 -179.957 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' D' D ' 339' ' ' GLU . . . . . . . . . . . . . 44.1 mt-10 -50.72 -32.75 20.45 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.059 -1.026 . . . . 1.99 109.735 -179.87 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' D' D ' 340' ' ' MET . . . . . . . . . . . . . 17.3 ttp -62.49 -52.66 62.61 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.187 -0.945 . . . . 0.31 109.99 -179.535 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' D' D ' 341' ' ' PHE . . . . . 0.406 ' HB2' HD13 ' D' ' 332' ' ' ILE . 40.2 m-85 -62.32 -51.14 68.85 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.184 -0.948 . . . . 0.17999999999999999 109.773 -179.814 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' D' D ' 342' ' ' ARG . . . . . . . . . . . . . 4.1 ttt180 -45.17 -39.51 6.22 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.284 -0.885 . . . . 2.4100000000000001 109.92 -179.76 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' D' D ' 343' ' ' GLU . . . . . . . . . . . . . 60.1 tt0 -60.96 -48.48 81.64 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.136 -0.977 . . . . 2.3500000000000001 110.213 -179.675 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' D' D ' 344' ' ' LEU . . . . . 0.411 HD22 ' CD2' ' C' ' 344' ' ' LEU . 49.7 mt -62.13 -33.06 73.77 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.052 -1.03 . . . . 0.19 109.878 -179.459 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' D' D ' 345' ' ' ASN . . . . . 0.501 ' HB2' HD21 ' B' ' 330' ' ' LEU . 14.3 t-20 -56.96 -56.51 20.74 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.299 -0.875 . . . . 1.0900000000000001 109.558 -179.582 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' D' D ' 346' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -60.85 -29.1 69.32 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.192 -0.942 . . . . 1.6899999999999999 110.133 -179.716 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' D' D ' 347' ' ' ALA . . . . . 0.655 ' HB1' ' HB1' ' C' ' 347' ' ' ALA . . . -59.7 -58.53 8.17 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.152 -0.968 . . . . 0.17999999999999999 110.254 -179.502 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' D' D ' 348' ' ' LEU . . . . . 0.598 HD22 ' N ' ' D' ' 348' ' ' LEU . 4.1 mm? -62.02 -42.18 98.88 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.157 -0.964 . . . . 0.31 110.069 -179.256 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' D' D ' 349' ' ' GLU . . . . . . . . . . . . . 9.1 mm-40 -58.6 -34.26 70.92 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.033 -1.042 . . . . 1.95 110.132 -179.349 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' D' D ' 350' ' ' LEU . . . . . 0.614 HD22 HD13 ' C' ' 350' ' ' LEU . 6.4 tt -64.0 -45.15 90.24 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.248 -0.907 . . . . 0.42999999999999999 109.499 -179.633 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' D' D ' 351' ' ' LYS . . . . . . . . . . . . . 48.2 tttt -59.5 -46.08 89.85 Favored 'General case' 0 N--CA 1.488 1.448 0 O-C-N 121.292 -0.88 . . . . 1.3999999999999999 109.676 -179.825 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' D' D ' 352' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -55.27 -45.01 76.14 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.338 -0.851 . . . . 1.1699999999999999 110.119 -179.419 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' D' D ' 353' ' ' ALA . . . . . . . . . . . . . . . -66.71 -29.41 69.39 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 120.794 -1.192 . . . . 0.58999999999999997 109.576 -179.678 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' D' D ' 354' ' ' GLN . . . . . . . . . . . . . 40.8 tt0 -80.98 -2.25 47.1 Favored 'General case' 0 N--CA 1.489 1.481 0 O-C-N 121.208 -0.933 . . . . 1.4399999999999999 109.798 -179.769 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' D' D ' 355' ' ' ALA . . . . . . . . . . . . . . . -70.58 -6.2 34.82 Favored 'General case' 0 C--N 1.301 -1.522 0 O-C-N 121.094 -1.004 . . . . 0.97999999999999998 109.156 179.691 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' D' D ' 356' ' ' GLY . . . . . . . . . . . . . . . -80.54 -7.98 88.0 Favored Glycine 0 N--CA 1.49 2.284 0 N-CA-C 109.994 -1.242 . . . . 1.28 109.994 179.955 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' D' D ' 357' ' ' LYS . . . . . 0.419 ' O ' ' C ' ' D' ' 358' ' ' GLU . 6.0 mttm -90.38 115.94 27.95 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.041 -1.27 . . . . 4.0899999999999999 109.693 179.953 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' D' D ' 358' ' ' GLU . . . . . 0.428 ' CG ' ' HD2' ' D' ' 359' ' ' PRO . 53.8 tt0 -45.51 137.13 5.49 Favored Pre-proline 0 N--CA 1.487 1.425 0 O-C-N 121.277 -0.889 . . . . 5.71 108.875 179.855 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' D' D ' 359' ' ' PRO . . . . . 0.428 ' HD2' ' CG ' ' D' ' 358' ' ' GLU . 3.7 Cg_exo -61.39 119.85 7.21 Favored 'Trans proline' 0 C--N 1.311 -1.444 0 C-N-CA 121.794 1.663 . . . . 4.9699999999999998 110.116 -179.768 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' D' D ' 360' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.215 0 N-CA-C 109.525 -1.43 . . . . 6.9699999999999998 109.525 179.831 . . . . . . . . 0 0 . 1 . 034 nuclear build full ' A' A ' 319' ' ' LYS . . . . . 0.45 ' O ' ' CB ' ' A' ' 320' ' ' LYS . 9.3 mmtt . . . . . 0 N--CA 1.49 1.547 0 CA-C-O 121.331 0.586 . . . . 7.5499999999999998 109.571 . . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 320' ' ' LYS . . . . . 0.45 ' CB ' ' O ' ' A' ' 319' ' ' LYS . 0.1 OUTLIER 72.05 8.28 5.92 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.421 -0.799 . . . . 6.4299999999999997 109.666 -179.858 . . . . . . . . 3 3 . 1 . 034 nuclear build full ' A' A ' 321' ' ' LYS . . . . . 0.52 ' N ' ' HD3' ' A' ' 322' ' ' PRO . 0.3 OUTLIER -158.41 61.61 2.08 Favored Pre-proline 0 N--CA 1.491 1.597 0 O-C-N 121.215 -0.928 . . . . 6.1299999999999999 109.446 179.651 . . . . . . . . 3 3 . 1 . 034 nuclear build full ' A' A ' 322' ' ' PRO . . . . . 0.52 ' HD3' ' N ' ' A' ' 321' ' ' LYS . 2.1 Cg_endo -62.35 93.0 0.13 Allowed 'Trans proline' 0 C--N 1.31 -1.486 0 C-N-CA 122.333 2.022 . . . . 2.8300000000000001 110.536 -179.964 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' A' A ' 323' ' ' LEU . . . . . . . . . . . . . 87.7 mt -82.42 72.59 9.48 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.107 -0.996 . . . . 2.8300000000000001 109.611 179.859 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 324' ' ' ASP . . . . . 0.47 ' HB2' ' OH ' ' A' ' 327' ' ' TYR . 4.5 m-20 -80.57 177.94 8.67 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.119 -0.988 . . . . 1.53 109.421 179.809 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' A' A ' 325' ' ' GLY . . . . . . . . . . . . . . . -70.1 -154.02 1.04 Allowed Glycine 0 N--CA 1.49 2.279 0 N-CA-C 109.434 -1.466 . . . . 0.60999999999999999 109.434 179.774 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 326' ' ' GLU . . . . . . . . . . . . . 4.2 mt-10 -58.86 -167.08 0.01 OUTLIER 'General case' 0 N--CA 1.487 1.409 0 O-C-N 121.291 -1.123 . . . . 2.1299999999999999 109.404 179.922 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 327' ' ' TYR . . . . . 0.55 ' CE1' ' HG3' ' C' ' 333' ' ' ARG . 39.0 m-85 -148.96 109.81 4.29 Favored 'General case' 0 N--CA 1.489 1.478 0 O-C-N 121.35 -0.844 . . . . 0.47999999999999998 109.463 179.9 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' A' A ' 328' ' ' PHE . . . . . 0.41 ' CE2' ' HA ' ' C' ' 335' ' ' ARG . 88.0 m-85 -113.64 -169.41 1.5 Allowed 'General case' 0 C--N 1.302 -1.464 0 O-C-N 121.353 -0.842 . . . . 0.31 108.934 179.772 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' A' A ' 329' ' ' THR . . . . . . . . . . . . . 23.5 p -153.15 169.77 22.16 Favored 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.013 -1.055 . . . . 0.22 109.517 -179.97 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 330' ' ' LEU . . . . . 0.484 HD21 ' HB2' ' C' ' 345' ' ' ASN . 17.4 tp -150.83 127.2 10.68 Favored 'General case' 0 N--CA 1.488 1.46 0 O-C-N 121.288 -0.882 . . . . 0.28000000000000003 109.529 -179.809 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' A' A ' 331' ' ' GLN . . . . . 0.449 ' OE1' ' O ' ' C' ' 328' ' ' PHE . 3.7 tp-100 -87.77 119.91 28.57 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.19 -0.944 . . . . 0.91000000000000003 109.401 179.846 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' A' A ' 332' ' ' ILE . . . . . 0.619 HG21 ' HA ' ' A' ' 338' ' ' PHE . 97.9 mt -103.38 107.99 23.41 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.596 0 O-C-N 121.299 -0.875 . . . . 0.26000000000000001 109.519 179.898 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' A' A ' 333' ' ' ARG . . . . . 0.488 ' HG2' ' CE2' ' C' ' 327' ' ' TYR . 1.4 mtt-85 -72.18 131.54 42.91 Favored 'General case' 0 N--CA 1.488 1.463 0 O-C-N 121.206 -0.934 . . . . 2.9199999999999999 109.569 -179.988 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' A' A ' 334' ' ' GLY . . . . . . . . . . . . . . . 87.71 138.88 6.02 Favored Glycine 0 N--CA 1.49 2.298 0 N-CA-C 109.809 -1.316 . . . . 0.40000000000000002 109.809 179.817 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 335' ' ' ARG . . . . . 0.429 ' O ' ' HB3' ' A' ' 338' ' ' PHE . 37.5 ttt180 -79.78 -29.04 40.27 Favored 'General case' 0 N--CA 1.489 1.488 0 O-C-N 121.316 -1.108 . . . . 3.0099999999999998 109.676 -179.978 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' A' A ' 336' ' ' GLU . . . . . . . . . . . . . 38.7 mt-10 -56.45 -61.95 2.06 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.211 -0.93 . . . . 2.29 109.843 -179.732 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 337' ' ' ARG . . . . . 0.487 ' CZ ' HD12 ' C' ' 348' ' ' LEU . 0.0 OUTLIER -60.52 -26.67 67.02 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.151 -0.968 . . . . 2.9300000000000002 109.686 -179.776 . . . . . . . . 3 3 . 1 . 034 nuclear build full ' A' A ' 338' ' ' PHE . . . . . 0.619 ' HA ' HG21 ' A' ' 332' ' ' ILE . 91.5 t80 -56.31 -53.58 55.57 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.163 -0.961 . . . . 0.38 110.01 -179.694 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' A' A ' 339' ' ' GLU . . . . . . . . . . . . . 6.8 mt-10 -54.6 -39.52 67.95 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.019 -1.05 . . . . 1.97 110.533 -179.369 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 340' ' ' MET . . . . . . . . . . . . . 30.9 ttp -64.37 -53.4 49.15 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.044 -1.035 . . . . 0.31 110.877 -178.788 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 341' ' ' PHE . . . . . 0.551 ' CZ ' ' HA ' ' C' ' 345' ' ' ASN . 56.7 m-85 -60.57 -48.71 80.58 Favored 'General case' 0 N--CA 1.494 1.761 0 O-C-N 120.91 -1.119 . . . . 0.17999999999999999 110.291 -179.018 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' A' A ' 342' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -48.9 -44.4 40.09 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.075 -1.016 . . . . 2.4199999999999999 110.136 -179.6 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' A' A ' 343' ' ' GLU . . . . . . . . . . . . . 2.1 tp10 -57.81 -41.99 83.33 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.102 -0.999 . . . . 2.3500000000000001 109.745 -179.585 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 344' ' ' LEU . . . . . . . . . . . . . 45.8 mt -63.63 -47.16 82.48 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.173 -0.955 . . . . 0.17999999999999999 109.92 -179.828 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 345' ' ' ASN . . . . . 0.642 ' HB2' HD21 ' C' ' 330' ' ' LEU . 39.3 t-20 -54.83 -48.3 73.01 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.16 -0.962 . . . . 1.0900000000000001 109.737 -179.616 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' A' A ' 346' ' ' GLU . . . . . . . . . . . . . 56.5 tt0 -61.83 -35.88 79.53 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.194 -0.941 . . . . 1.6499999999999999 109.749 -179.882 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 347' ' ' ALA . . . . . 0.689 ' HB1' ' HB1' ' B' ' 347' ' ' ALA . . . -59.94 -55.83 29.26 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.249 -0.907 . . . . 0.17999999999999999 110.049 -179.623 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' A' A ' 348' ' ' LEU . . . . . 0.587 HD22 ' N ' ' A' ' 348' ' ' LEU . 3.8 mm? -60.02 -41.72 92.79 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.199 -0.938 . . . . 0.29999999999999999 109.655 -179.653 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' A' A ' 349' ' ' GLU . . . . . . . . . . . . . 88.3 mt-10 -58.6 -33.48 70.04 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.254 -0.903 . . . . 1.9399999999999999 109.785 -179.694 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 350' ' ' LEU . . . . . 0.623 HD23 ' O ' ' A' ' 350' ' ' LEU . 5.3 tt -63.16 -49.13 75.54 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.201 -0.937 . . . . 0.46000000000000002 109.162 179.944 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' A' A ' 351' ' ' LYS . . . . . . . . . . . . . 6.5 ttmm -58.49 -44.79 89.51 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.259 -0.901 . . . . 1.3999999999999999 109.303 -179.989 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 352' ' ' ASP . . . . . . . . . . . . . 14.5 m-20 -57.04 -42.95 81.45 Favored 'General case' 0 N--CA 1.489 1.484 0 O-C-N 121.319 -0.863 . . . . 1.1599999999999999 109.676 179.922 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 353' ' ' ALA . . . . . . . . . . . . . . . -67.35 -22.08 65.6 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.277 -0.889 . . . . 0.63 109.691 -179.787 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 354' ' ' GLN . . . . . 0.453 ' OE1' HD11 ' B' ' 350' ' ' LEU . 2.0 tt0 -82.43 -11.23 58.66 Favored 'General case' 0 N--CA 1.488 1.475 0 O-C-N 121.237 -0.914 . . . . 1.47 109.274 179.944 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' A' A ' 355' ' ' ALA . . . . . . . . . . . . . . . -72.27 -9.83 58.98 Favored 'General case' 0 N--CA 1.489 1.499 0 O-C-N 121.184 -0.948 . . . . 1.01 109.473 179.711 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 356' ' ' GLY . . . . . . . . . . . . . . . -80.51 -29.13 45.23 Favored Glycine 0 N--CA 1.492 2.38 0 N-CA-C 109.329 -1.508 . . . . 1.3 109.329 -179.999 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 357' ' ' LYS . . . . . . . . . . . . . 36.2 mmtt -87.25 140.35 29.63 Favored 'General case' 0 N--CA 1.488 1.457 0 O-C-N 121.342 -1.093 . . . . 4.0999999999999996 109.054 179.667 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 358' ' ' GLU . . . . . . . . . . . . . 1.8 mt-10 -47.6 150.25 1.82 Allowed Pre-proline 0 N--CA 1.488 1.473 0 O-C-N 121.212 -0.93 . . . . 5.75 109.364 -179.831 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 359' ' ' PRO . . . . . . . . . . . . . 2.0 Cg_endo -61.8 -159.63 0.03 OUTLIER 'Trans proline' 0 C--N 1.31 -1.463 0 C-N-CA 122.241 1.96 . . . . 5.0 110.373 -179.739 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 360' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.202 0 CA-C-O 118.0 -1.444 . . . . 6.9699999999999998 109.503 179.963 . . . . . . . . 0 0 . 1 . 034 nuclear build full ' B' B ' 319' ' ' LYS . . . . . 0.447 ' O ' ' CB ' ' B' ' 320' ' ' LYS . 9.4 mmtt . . . . . 0 N--CA 1.489 1.475 0 CA-C-O 121.241 0.543 . . . . 7.5499999999999998 109.663 . . . . . . . . . 1 1 . 1 . 034 nuclear build full ' B' B ' 320' ' ' LYS . . . . . 0.447 ' CB ' ' O ' ' B' ' 319' ' ' LYS . 0.1 OUTLIER 72.19 8.31 5.85 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.314 -0.866 . . . . 6.4400000000000004 109.747 -179.906 . . . . . . . . 3 3 . 1 . 034 nuclear build full ' B' B ' 321' ' ' LYS . . . . . 0.513 ' N ' ' HD3' ' B' ' 322' ' ' PRO . 0.3 OUTLIER -158.41 61.6 2.08 Favored Pre-proline 0 N--CA 1.49 1.528 0 O-C-N 121.234 -0.916 . . . . 6.1299999999999999 109.386 179.609 . . . . . . . . 3 3 . 1 . 034 nuclear build full ' B' B ' 322' ' ' PRO . . . . . 0.513 ' HD3' ' N ' ' B' ' 321' ' ' LYS . 2.1 Cg_endo -62.33 93.01 0.13 Allowed 'Trans proline' 0 C--N 1.311 -1.446 0 C-N-CA 122.213 1.942 . . . . 2.8199999999999998 110.373 -179.974 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' B' B ' 323' ' ' LEU . . . . . 0.432 ' HA ' HD23 ' B' ' 323' ' ' LEU . 88.2 mt -82.47 73.16 9.52 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.258 -0.901 . . . . 2.8399999999999999 109.421 179.853 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' B' B ' 324' ' ' ASP . . . . . 0.457 ' HB2' ' OH ' ' B' ' 327' ' ' TYR . 4.7 m-20 -80.89 178.49 8.37 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.191 -0.943 . . . . 1.53 109.29 179.809 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' B' B ' 325' ' ' GLY . . . . . . . . . . . . . . . -70.91 -153.92 1.28 Allowed Glycine 0 N--CA 1.49 2.246 0 N-CA-C 109.445 -1.462 . . . . 0.58999999999999997 109.445 179.853 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' B' B ' 326' ' ' GLU . . . . . . . . . . . . . 4.4 mt-10 -58.6 -167.01 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.482 0 O-C-N 121.253 -1.145 . . . . 2.1299999999999999 109.497 179.936 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' B' B ' 327' ' ' TYR . . . . . 0.457 ' OH ' ' HB2' ' B' ' 324' ' ' ASP . 39.3 m-85 -148.92 109.73 4.28 Favored 'General case' 0 N--CA 1.489 1.49 0 O-C-N 121.353 -0.842 . . . . 0.47999999999999998 109.51 179.854 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' B' B ' 328' ' ' PHE . . . . . 0.403 ' O ' HG23 ' B' ' 329' ' ' THR . 87.8 m-85 -113.61 -169.25 1.47 Allowed 'General case' 0 C--N 1.301 -1.522 0 O-C-N 121.305 -0.872 . . . . 0.32000000000000001 108.965 179.748 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' B' B ' 329' ' ' THR . . . . . 0.403 HG23 ' O ' ' B' ' 328' ' ' PHE . 23.8 p -153.37 169.1 23.94 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.072 -1.017 . . . . 0.23000000000000001 109.728 -179.776 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' B' B ' 330' ' ' LEU . . . . . 0.551 HD21 ' HB2' ' D' ' 345' ' ' ASN . 17.2 tp -150.61 126.89 10.64 Favored 'General case' 0 N--CA 1.488 1.452 0 O-C-N 121.262 -0.899 . . . . 0.28000000000000003 109.592 -179.768 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' B' B ' 331' ' ' GLN . . . . . 0.439 ' OE1' ' O ' ' D' ' 328' ' ' PHE . 3.7 tp-100 -87.2 120.07 28.1 Favored 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.253 -0.904 . . . . 0.91000000000000003 109.378 179.876 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' B' B ' 332' ' ' ILE . . . . . 0.615 HG21 ' HA ' ' B' ' 338' ' ' PHE . 97.9 mt -103.56 107.92 23.31 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.564 0 O-C-N 121.136 -0.978 . . . . 0.23999999999999999 109.433 179.867 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' B' B ' 333' ' ' ARG . . . . . 0.454 HH11 ' CG ' ' B' ' 333' ' ' ARG . 1.4 mtt-85 -72.2 131.67 43.07 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.267 -0.896 . . . . 2.9300000000000002 109.439 -179.979 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' B' B ' 334' ' ' GLY . . . . . . . . . . . . . . . 88.18 138.58 6.17 Favored Glycine 0 N--CA 1.49 2.27 0 N-CA-C 109.749 -1.341 . . . . 0.40000000000000002 109.749 179.704 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' B' B ' 335' ' ' ARG . . . . . 0.445 ' O ' ' HB3' ' B' ' 338' ' ' PHE . 39.1 ttt180 -79.88 -28.85 39.87 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.313 -1.11 . . . . 3.0099999999999998 109.655 179.991 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' B' B ' 336' ' ' GLU . . . . . . . . . . . . . 39.3 mt-10 -56.74 -61.77 2.2 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.309 -0.869 . . . . 2.2799999999999998 109.811 -179.67 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' B' B ' 337' ' ' ARG . . . . . 0.497 ' NH1' ' HG2' ' B' ' 337' ' ' ARG . 0.0 OUTLIER -60.54 -27.06 67.36 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.314 -0.866 . . . . 2.9300000000000002 109.602 -179.8 . . . . . . . . 3 3 . 1 . 034 nuclear build full ' B' B ' 338' ' ' PHE . . . . . 0.615 ' HA ' HG21 ' B' ' 332' ' ' ILE . 91.4 t80 -56.11 -53.64 54.61 Favored 'General case' 0 C--N 1.303 -1.418 0 O-C-N 121.199 -0.938 . . . . 0.37 110.045 -179.623 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' B' B ' 339' ' ' GLU . . . . . . . . . . . . . 7.0 mt-10 -54.75 -39.46 68.34 Favored 'General case' 0 N--CA 1.494 1.769 0 O-C-N 121.073 -1.017 . . . . 1.98 110.679 -179.459 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' B' B ' 340' ' ' MET . . . . . . . . . . . . . 30.5 ttp -64.12 -53.47 49.03 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 120.946 -1.096 . . . . 0.32000000000000001 110.89 -178.845 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' B' B ' 341' ' ' PHE . . . . . 0.446 ' CZ ' ' HA ' ' D' ' 345' ' ' ASN . 56.2 m-85 -60.72 -48.15 83.1 Favored 'General case' 0 N--CA 1.494 1.725 0 O-C-N 120.96 -1.087 . . . . 0.17999999999999999 110.412 -178.983 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' B' B ' 342' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -49.58 -43.85 46.48 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.137 -0.977 . . . . 2.4199999999999999 110.124 -179.579 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' B' B ' 343' ' ' GLU . . . . . . . . . . . . . 2.1 tp10 -57.99 -42.46 85.19 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.178 -0.951 . . . . 2.3500000000000001 109.607 -179.665 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' B' B ' 344' ' ' LEU . . . . . . . . . . . . . 46.5 mt -63.5 -47.06 83.27 Favored 'General case' 0 N--CA 1.488 1.473 0 O-C-N 121.306 -0.871 . . . . 0.17999999999999999 109.931 -179.722 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' B' B ' 345' ' ' ASN . . . . . 0.582 ' HB2' HD21 ' D' ' 330' ' ' LEU . 0.5 OUTLIER -55.06 -47.95 74.14 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.123 -0.986 . . . . 1.0900000000000001 109.679 -179.615 . . . . . . . . 3 3 . 1 . 034 nuclear build full ' B' B ' 346' ' ' GLU . . . . . . . . . . . . . 56.3 tt0 -61.99 -35.86 79.77 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.118 -0.989 . . . . 1.6599999999999999 109.661 -179.863 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' B' B ' 347' ' ' ALA . . . . . 0.689 ' HB1' ' HB1' ' A' ' 347' ' ' ALA . . . -59.93 -55.37 34.88 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.293 -0.879 . . . . 0.17000000000000001 110.184 -179.478 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' B' B ' 348' ' ' LEU . . . . . 0.576 HD22 ' N ' ' B' ' 348' ' ' LEU . 3.8 mm? -60.72 -41.0 94.38 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.214 -0.929 . . . . 0.28999999999999998 109.678 -179.595 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' B' B ' 349' ' ' GLU . . . . . . . . . . . . . 86.8 mt-10 -59.05 -33.07 70.34 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.269 -0.894 . . . . 1.95 109.75 -179.729 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' B' B ' 350' ' ' LEU . . . . . 0.616 HD23 ' O ' ' B' ' 350' ' ' LEU . 5.3 tt -63.67 -48.97 75.02 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.192 -0.942 . . . . 0.45000000000000001 109.286 179.882 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' B' B ' 351' ' ' LYS . . . . . . . . . . . . . 6.2 ttmm -58.5 -44.76 89.56 Favored 'General case' 0 N--CA 1.489 1.483 0 O-C-N 121.309 -0.869 . . . . 1.3799999999999999 109.254 179.894 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' B' B ' 352' ' ' ASP . . . . . . . . . . . . . 16.6 m-20 -57.18 -43.04 82.26 Favored 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.305 -0.872 . . . . 1.1599999999999999 109.549 179.956 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' B' B ' 353' ' ' ALA . . . . . . . . . . . . . . . -67.32 -21.92 65.64 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.228 -0.92 . . . . 0.60999999999999999 109.585 -179.776 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' B' B ' 354' ' ' GLN . . . . . . . . . . . . . 2.0 tt0 -82.49 -10.96 58.8 Favored 'General case' 0 N--CA 1.488 1.471 0 O-C-N 121.246 -0.909 . . . . 1.45 109.52 179.913 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' B' B ' 355' ' ' ALA . . . . . . . . . . . . . . . -72.66 -9.36 58.52 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.179 -0.951 . . . . 0.97999999999999998 109.415 179.814 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' B' B ' 356' ' ' GLY . . . . . . . . . . . . . . . -81.05 -29.11 42.75 Favored Glycine 0 N--CA 1.492 2.37 0 N-CA-C 109.206 -1.557 . . . . 1.29 109.206 179.956 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' B' B ' 357' ' ' LYS . . . . . . . . . . . . . 34.9 mmtt -87.26 139.82 30.17 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.349 -1.089 . . . . 4.0899999999999999 109.039 179.658 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' B' B ' 358' ' ' GLU . . . . . . . . . . . . . 2.0 mt-10 -47.03 150.64 1.31 Allowed Pre-proline 0 N--CA 1.491 1.617 0 O-C-N 121.227 -0.92 . . . . 5.7199999999999998 109.301 -179.772 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' B' B ' 359' ' ' PRO . . . . . . . . . . . . . 2.1 Cg_endo -62.03 -159.5 0.03 OUTLIER 'Trans proline' 0 C--N 1.309 -1.515 0 C-N-CA 122.278 1.985 . . . . 4.9800000000000004 110.214 -179.935 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' B' B ' 360' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.238 0 CA-C-O 118.001 -1.444 . . . . 6.9800000000000004 109.568 179.96 . . . . . . . . 0 0 . 1 . 034 nuclear build full ' C' C ' 319' ' ' LYS . . . . . . . . . . . . . 2.8 mmpp? . . . . . 0 N--CA 1.49 1.537 0 CA-C-O 121.32 0.581 . . . . 6.8200000000000003 109.526 . . . . . . . . . 0 0 . 1 . 034 nuclear build full ' C' C ' 320' ' ' LYS . . . . . . . . . . . . . 2.2 ttpt 58.13 92.94 0.03 OUTLIER 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.252 -0.905 . . . . 6.4900000000000002 109.52 -179.801 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' C' C ' 321' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -158.51 125.16 2.53 Favored Pre-proline 0 N--CA 1.49 1.534 0 O-C-N 121.307 -0.87 . . . . 6.4000000000000004 109.189 179.952 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' C' C ' 322' ' ' PRO . . . . . . . . . . . . . 2.9 Cg_endo -61.52 106.5 0.42 Allowed 'Trans proline' 0 C--N 1.313 -1.324 0 C-N-CA 121.89 1.727 . . . . 3.4199999999999999 109.997 -179.967 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' C' C ' 323' ' ' LEU . . . . . 0.471 HD23 ' HA ' ' C' ' 323' ' ' LEU . 38.6 mt -85.44 -72.19 0.5 Allowed 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.344 -0.848 . . . . 3.9500000000000002 110.159 -179.682 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' C' C ' 324' ' ' ASP . . . . . 0.468 ' OD2' ' HD2' ' A' ' 333' ' ' ARG . 87.7 m-20 -76.11 179.5 5.62 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.245 -0.909 . . . . 1.6299999999999999 109.769 -179.277 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' C' C ' 325' ' ' GLY . . . . . . . . . . . . . . . -70.28 -150.46 0.57 Allowed Glycine 0 N--CA 1.49 2.235 0 N-CA-C 110.032 -1.227 . . . . 0.72999999999999998 110.032 -179.649 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' C' C ' 326' ' ' GLU . . . . . . . . . . . . . 10.3 mt-10 -59.16 -165.07 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.453 -1.028 . . . . 2.1699999999999999 110.134 -179.672 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' C' C ' 327' ' ' TYR . . . . . 0.488 ' CE2' ' HG2' ' A' ' 333' ' ' ARG . 40.3 m-85 -148.03 116.5 6.61 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.482 -0.761 . . . . 0.47999999999999998 109.248 -179.945 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' C' C ' 328' ' ' PHE . . . . . 0.449 ' O ' ' OE1' ' A' ' 331' ' ' GLN . 72.1 m-85 -113.29 -170.15 1.63 Allowed 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.176 -0.952 . . . . 0.33000000000000002 109.49 -179.889 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' C' C ' 329' ' ' THR . . . . . 0.428 ' HA ' ' O ' ' A' ' 330' ' ' LEU . 17.8 p -152.66 168.22 26.36 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.266 -0.896 . . . . 0.23000000000000001 109.483 -179.913 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' C' C ' 330' ' ' LEU . . . . . 0.642 HD21 ' HB2' ' A' ' 345' ' ' ASN . 16.5 tp -150.99 125.42 9.49 Favored 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.25 -0.906 . . . . 0.28000000000000003 109.567 -179.677 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' C' C ' 331' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -88.91 113.16 24.15 Favored 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.224 -0.923 . . . . 1.48 109.522 179.965 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' C' C ' 332' ' ' ILE . . . . . 0.559 HD13 ' CD2' ' C' ' 341' ' ' PHE . 42.0 mt -104.12 113.9 42.29 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.631 0 O-C-N 121.171 -0.955 . . . . 0.23999999999999999 109.589 179.73 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' C' C ' 333' ' ' ARG . . . . . 0.55 ' HG3' ' CE1' ' A' ' 327' ' ' TYR . 0.1 OUTLIER -73.59 144.18 46.1 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.195 -0.941 . . . . 2.7400000000000002 109.586 179.868 . . . . . . . . 3 3 . 1 . 034 nuclear build full ' C' C ' 334' ' ' GLY . . . . . . . . . . . . . . . 88.11 135.74 5.07 Favored Glycine 0 N--CA 1.493 2.465 0 N-CA-C 110.033 -1.227 . . . . 0.34999999999999998 110.033 179.629 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' C' C ' 335' ' ' ARG . . . . . 0.454 ' O ' ' HB3' ' C' ' 338' ' ' PHE . 13.2 ttm180 -80.44 -41.49 24.38 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.384 -1.068 . . . . 2.5299999999999998 109.704 179.938 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' C' C ' 336' ' ' GLU . . . . . . . . . . . . . 4.2 mt-10 -56.46 -53.7 54.38 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.245 -0.91 . . . . 2.6200000000000001 109.5 -179.778 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' C' C ' 337' ' ' ARG . . . . . 0.426 HH11 ' HG3' ' C' ' 337' ' ' ARG . 0.1 OUTLIER -60.24 -33.61 72.52 Favored 'General case' 0 N--CA 1.489 1.499 0 O-C-N 121.149 -0.969 . . . . 2.8100000000000001 109.128 179.782 . . . . . . . . 3 3 . 1 . 034 nuclear build full ' C' C ' 338' ' ' PHE . . . . . 0.454 ' HB3' ' O ' ' C' ' 335' ' ' ARG . 86.6 t80 -56.33 -55.39 34.04 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.418 -0.801 . . . . 0.40000000000000002 109.768 179.839 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' C' C ' 339' ' ' GLU . . . . . . . . . . . . . 47.6 mt-10 -50.13 -35.99 28.07 Favored 'General case' 0 N--CA 1.494 1.748 0 O-C-N 121.255 -0.903 . . . . 2.0499999999999998 110.131 -179.75 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' C' C ' 340' ' ' MET . . . . . . . . . . . . . 37.0 ttp -63.98 -52.41 59.75 Favored 'General case' 0 N--CA 1.493 1.717 0 O-C-N 121.199 -0.938 . . . . 0.32000000000000001 110.608 -179.153 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' C' C ' 341' ' ' PHE . . . . . 0.559 ' CD2' HD13 ' C' ' 332' ' ' ILE . 50.3 m-85 -61.73 -44.38 97.02 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.216 -0.928 . . . . 0.17999999999999999 110.509 -178.976 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' C' C ' 342' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -50.39 -43.25 54.46 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 120.99 -1.069 . . . . 2.9100000000000001 110.285 -179.491 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' C' C ' 343' ' ' GLU . . . . . . . . . . . . . 80.1 tt0 -59.07 -45.55 90.54 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.121 -0.987 . . . . 2.1400000000000001 110.057 -179.388 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' C' C ' 344' ' ' LEU . . . . . . . . . . . . . 65.2 mt -62.87 -43.97 97.38 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.155 -0.966 . . . . 0.22 110.125 -179.502 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' C' C ' 345' ' ' ASN . . . . . 0.551 ' HA ' ' CZ ' ' A' ' 341' ' ' PHE . 64.6 t-20 -57.03 -51.23 70.1 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.171 -0.956 . . . . 1.0800000000000001 109.868 -179.518 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' C' C ' 346' ' ' GLU . . . . . . . . . . . . . 10.8 tt0 -60.53 -30.52 69.8 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.089 -1.007 . . . . 2.21 109.431 -179.875 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' C' C ' 347' ' ' ALA . . . . . 0.824 ' HB1' ' HB1' ' D' ' 347' ' ' ALA . . . -60.23 -58.07 10.1 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.282 -0.886 . . . . 0.17999999999999999 109.981 -179.946 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' C' C ' 348' ' ' LEU . . . . . 0.634 ' N ' HD22 ' C' ' 348' ' ' LEU . 4.0 mm? -61.66 -40.86 96.44 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.21 -0.931 . . . . 0.32000000000000001 109.659 -179.7 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' C' C ' 349' ' ' GLU . . . . . . . . . . . . . 53.3 mm-40 -56.99 -36.11 70.0 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.223 -0.923 . . . . 2.1899999999999999 109.552 -179.878 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' C' C ' 350' ' ' LEU . . . . . 0.783 HD13 HD22 ' D' ' 350' ' ' LEU . 4.5 tt -63.05 -47.1 84.43 Favored 'General case' 0 N--CA 1.488 1.46 0 O-C-N 121.236 -0.915 . . . . 0.46000000000000002 109.227 179.996 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' C' C ' 351' ' ' LYS . . . . . . . . . . . . . 16.8 tttm -59.66 -42.11 92.09 Favored 'General case' 0 N--CA 1.49 1.525 0 O-C-N 121.211 -0.93 . . . . 1.3500000000000001 109.547 179.879 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' C' C ' 352' ' ' ASP . . . . . . . . . . . . . 86.2 m-20 -56.13 -38.34 70.68 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.272 -0.893 . . . . 1.1899999999999999 109.655 -179.941 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' C' C ' 353' ' ' ALA . . . . . . . . . . . . . . . -65.96 -29.68 70.13 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.24 -0.912 . . . . 0.56999999999999995 109.613 -179.645 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' C' C ' 354' ' ' GLN . . . . . 0.408 ' OE1' HD11 ' D' ' 350' ' ' LEU . 36.8 mt-30 -82.76 -9.92 59.12 Favored 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.033 -1.042 . . . . 1.47 109.348 179.75 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' C' C ' 355' ' ' ALA . . . . . . . . . . . . . . . -72.29 -2.21 18.21 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.329 -0.857 . . . . 0.93000000000000005 109.671 179.979 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' C' C ' 356' ' ' GLY . . . . . . . . . . . . . . . -71.96 -2.92 54.26 Favored Glycine 0 N--CA 1.49 2.26 0 N-CA-C 109.677 -1.369 . . . . 1.3300000000000001 109.677 -179.903 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' C' C ' 357' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -87.62 122.66 31.6 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.308 -1.113 . . . . 4.0099999999999998 109.381 179.825 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' C' C ' 358' ' ' GLU . . . . . . . . . . . . . 8.8 pt-20 -49.6 150.05 3.82 Favored Pre-proline 0 N--CA 1.489 1.518 0 O-C-N 121.188 -0.945 . . . . 5.75 109.325 179.878 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' C' C ' 359' ' ' PRO . . . . . . . . . . . . . 2.3 Cg_endo -62.1 -174.97 0.16 Allowed 'Trans proline' 0 C--N 1.308 -1.562 0 C-N-CA 122.15 1.9 . . . . 4.9400000000000004 110.126 179.931 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' C' C ' 360' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.3 0 CA-C-O 117.885 -1.508 . . . . 6.5 109.501 179.91 . . . . . . . . 0 0 . 1 . 034 nuclear build full ' D' D ' 319' ' ' LYS . . . . . 0.464 ' O ' ' HG2' ' D' ' 321' ' ' LYS . 9.1 mmtt . . . . . 0 N--CA 1.49 1.549 0 CA-C-O 121.411 0.624 . . . . 7.5300000000000002 109.512 . . . . . . . . . 1 1 . 1 . 034 nuclear build full ' D' D ' 320' ' ' LYS . . . . . 0.44 ' CB ' ' O ' ' D' ' 319' ' ' LYS . 0.1 OUTLIER 71.78 8.39 6.08 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.199 -0.938 . . . . 6.4100000000000001 109.74 179.97 . . . . . . . . 3 3 . 1 . 034 nuclear build full ' D' D ' 321' ' ' LYS . . . . . 0.52 ' N ' ' HD3' ' D' ' 322' ' ' PRO . 0.4 OUTLIER -158.42 61.36 2.01 Favored Pre-proline 0 N--CA 1.491 1.61 0 O-C-N 121.134 -0.979 . . . . 6.1100000000000003 109.432 179.667 . . . . . . . . 3 3 . 1 . 034 nuclear build full ' D' D ' 322' ' ' PRO . . . . . 0.52 ' HD3' ' N ' ' D' ' 321' ' ' LYS . 2.0 Cg_endo -62.34 92.33 0.13 Allowed 'Trans proline' 0 C--N 1.311 -1.401 0 C-N-CA 122.32 2.014 . . . . 2.8199999999999998 110.592 -179.829 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' D' D ' 323' ' ' LEU . . . . . . . . . . . . . 91.2 mt -82.01 72.64 9.07 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.261 -0.899 . . . . 2.8300000000000001 109.671 179.933 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' D' D ' 324' ' ' ASP . . . . . 0.464 ' HB2' ' OH ' ' D' ' 327' ' ' TYR . 4.7 m-20 -80.62 178.13 8.55 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.156 -0.965 . . . . 1.54 109.332 179.81 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' D' D ' 325' ' ' GLY . . . . . . . . . . . . . . . -70.21 -153.91 1.05 Allowed Glycine 0 N--CA 1.49 2.258 0 N-CA-C 109.397 -1.481 . . . . 0.58999999999999997 109.397 179.889 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' D' D ' 326' ' ' GLU . . . . . . . . . . . . . 4.7 mt-10 -58.85 -167.01 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.5 0 O-C-N 121.239 -1.153 . . . . 2.1299999999999999 109.468 179.931 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' D' D ' 327' ' ' TYR . . . . . 0.464 ' OH ' ' HB2' ' D' ' 324' ' ' ASP . 39.0 m-85 -148.75 109.66 4.29 Favored 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.406 -0.809 . . . . 0.46999999999999997 109.612 179.919 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' D' D ' 328' ' ' PHE . . . . . 0.439 ' O ' ' OE1' ' B' ' 331' ' ' GLN . 88.1 m-85 -113.56 -169.77 1.57 Allowed 'General case' 0 N--CA 1.488 1.467 0 O-C-N 121.268 -0.895 . . . . 0.29999999999999999 109.055 179.76 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' D' D ' 329' ' ' THR . . . . . 0.441 ' HA ' ' O ' ' B' ' 330' ' ' LEU . 23.8 p -153.0 169.2 23.48 Favored 'General case' 0 N--CA 1.489 1.486 0 O-C-N 121.122 -0.986 . . . . 0.22 109.555 -179.845 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' D' D ' 330' ' ' LEU . . . . . 0.582 HD21 ' HB2' ' B' ' 345' ' ' ASN . 17.4 tp -150.72 127.09 10.68 Favored 'General case' 0 N--CA 1.488 1.457 0 O-C-N 121.297 -0.877 . . . . 0.28000000000000003 109.427 -179.737 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' D' D ' 331' ' ' GLN . . . . . . . . . . . . . 3.6 tp-100 -87.42 120.12 28.39 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.266 -0.897 . . . . 0.93000000000000005 109.377 179.862 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' D' D ' 332' ' ' ILE . . . . . 0.625 HG21 ' HA ' ' D' ' 338' ' ' PHE . 97.9 mt -103.36 108.59 24.79 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.566 0 O-C-N 121.184 -0.947 . . . . 0.25 109.354 179.814 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' D' D ' 333' ' ' ARG . . . . . 0.441 HH11 ' CG ' ' D' ' 333' ' ' ARG . 1.5 mtt-85 -72.76 131.81 42.81 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.229 -0.919 . . . . 2.9300000000000002 109.488 -179.953 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' D' D ' 334' ' ' GLY . . . . . . . . . . . . . . . 88.05 138.9 6.23 Favored Glycine 0 N--CA 1.491 2.314 0 N-CA-C 109.648 -1.381 . . . . 0.40999999999999998 109.648 179.741 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' D' D ' 335' ' ' ARG . . . . . 0.446 ' O ' ' HB3' ' D' ' 338' ' ' PHE . 40.7 ttt180 -80.12 -29.08 38.89 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.284 -1.127 . . . . 3.0299999999999998 109.594 -179.906 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' D' D ' 336' ' ' GLU . . . . . . . . . . . . . 41.1 mt-10 -56.41 -62.29 1.82 Allowed 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.306 -0.871 . . . . 2.2599999999999998 109.78 -179.715 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' D' D ' 337' ' ' ARG . . . . . 0.465 ' NH1' ' HG2' ' D' ' 337' ' ' ARG . 0.0 OUTLIER -59.92 -27.23 66.59 Favored 'General case' 0 N--CA 1.489 1.501 0 O-C-N 121.238 -0.914 . . . . 2.9199999999999999 109.68 -179.813 . . . . . . . . 3 3 . 1 . 034 nuclear build full ' D' D ' 338' ' ' PHE . . . . . 0.625 ' HA ' HG21 ' D' ' 332' ' ' ILE . 91.5 t80 -55.81 -54.26 46.68 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.175 -0.953 . . . . 0.37 109.923 -179.749 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' D' D ' 339' ' ' GLU . . . . . . . . . . . . . 6.9 mt-10 -54.04 -39.6 66.35 Favored 'General case' 0 N--CA 1.494 1.759 0 O-C-N 121.095 -1.003 . . . . 1.99 110.68 -179.345 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' D' D ' 340' ' ' MET . . . . . . . . . . . . . 30.0 ttp -64.43 -53.16 52.8 Favored 'General case' 0 N--CA 1.495 1.785 0 O-C-N 121.061 -1.025 . . . . 0.31 110.862 -178.703 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' D' D ' 341' ' ' PHE . . . . . 0.563 ' CZ ' ' HA ' ' B' ' 345' ' ' ASN . 56.8 m-85 -60.83 -48.43 81.82 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 120.958 -1.089 . . . . 0.17999999999999999 110.364 -179.084 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' D' D ' 342' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -49.28 -44.06 43.64 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.155 -0.965 . . . . 2.4100000000000001 110.054 -179.58 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' D' D ' 343' ' ' GLU . . . . . . . . . . . . . 2.1 tp10 -57.88 -42.5 84.72 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.101 -0.999 . . . . 2.3500000000000001 109.652 -179.657 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' D' D ' 344' ' ' LEU . . . . . . . . . . . . . 46.4 mt -63.31 -46.97 84.23 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.199 -0.938 . . . . 0.19 109.984 -179.878 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' D' D ' 345' ' ' ASN . . . . . 0.551 ' HB2' HD21 ' B' ' 330' ' ' LEU . 0.5 OUTLIER -55.14 -48.31 73.87 Favored 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.174 -0.954 . . . . 1.0900000000000001 109.672 -179.48 . . . . . . . . 3 3 . 1 . 034 nuclear build full ' D' D ' 346' ' ' GLU . . . . . . . . . . . . . 56.2 tt0 -61.69 -36.0 79.63 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.088 -1.007 . . . . 1.6899999999999999 109.681 179.997 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' D' D ' 347' ' ' ALA . . . . . 0.824 ' HB1' ' HB1' ' C' ' 347' ' ' ALA . . . -59.84 -55.79 29.85 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.185 -0.947 . . . . 0.17999999999999999 110.044 -179.499 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' D' D ' 348' ' ' LEU . . . . . 0.569 HD22 ' N ' ' D' ' 348' ' ' LEU . 3.8 mm? -60.1 -41.24 92.11 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.304 -0.873 . . . . 0.31 109.69 -179.645 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' D' D ' 349' ' ' GLU . . . . . . . . . . . . . 84.6 mt-10 -59.07 -32.99 70.28 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.178 -0.952 . . . . 1.95 109.877 -179.652 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' D' D ' 350' ' ' LEU . . . . . 0.783 HD22 HD13 ' C' ' 350' ' ' LEU . 5.2 tt -63.69 -48.86 75.42 Favored 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.148 -0.97 . . . . 0.42999999999999999 109.184 179.875 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' D' D ' 351' ' ' LYS . . . . . . . . . . . . . 6.0 ttmm -58.67 -44.67 90.25 Favored 'General case' 0 N--CA 1.488 1.431 0 O-C-N 121.347 -0.846 . . . . 1.3999999999999999 109.378 179.881 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' D' D ' 352' ' ' ASP . . . . . . . . . . . . . 20.0 m-20 -57.26 -42.81 82.26 Favored 'General case' 0 N--CA 1.488 1.438 0 O-C-N 121.293 -0.88 . . . . 1.1699999999999999 109.566 179.859 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' D' D ' 353' ' ' ALA . . . . . . . . . . . . . . . -67.58 -21.49 65.43 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.28 -0.888 . . . . 0.58999999999999997 109.768 -179.739 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' D' D ' 354' ' ' GLN . . . . . . . . . . . . . 2.1 tt0 -82.68 -11.09 58.61 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.229 -0.919 . . . . 1.4399999999999999 109.31 179.961 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' D' D ' 355' ' ' ALA . . . . . . . . . . . . . . . -72.16 -9.97 59.16 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.256 -0.902 . . . . 0.97999999999999998 109.51 179.819 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' D' D ' 356' ' ' GLY . . . . . . . . . . . . . . . -80.75 -29.27 43.59 Favored Glycine 0 N--CA 1.49 2.281 0 N-CA-C 109.321 -1.512 . . . . 1.28 109.321 179.848 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' D' D ' 357' ' ' LYS . . . . . . . . . . . . . 34.4 mmtt -87.14 140.48 29.5 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.21 -1.171 . . . . 4.0899999999999999 108.982 179.62 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' D' D ' 358' ' ' GLU . . . . . . . . . . . . . 2.0 mt-10 -47.7 150.41 1.84 Allowed Pre-proline 0 N--CA 1.489 1.502 0 O-C-N 121.155 -0.966 . . . . 5.71 109.507 -179.849 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' D' D ' 359' ' ' PRO . . . . . . . . . . . . . 2.1 Cg_endo -62.02 -159.32 0.03 OUTLIER 'Trans proline' 0 C--N 1.31 -1.497 0 C-N-CA 122.185 1.923 . . . . 4.9699999999999998 110.298 -179.805 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' D' D ' 360' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.248 0 N-CA-C 109.469 -1.452 . . . . 6.9699999999999998 109.469 -179.988 . . . . . . . . 0 0 . 1 . 035 nuclear build full ' A' A ' 319' ' ' LYS . . . . . 0.465 ' O ' ' O ' ' A' ' 320' ' ' LYS . 18.9 ttpt . . . . . 0 N--CA 1.491 1.599 0 N-CA-C 109.448 -0.575 . . . . 7.5499999999999998 109.448 . . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 320' ' ' LYS . . . . . 0.465 ' O ' ' O ' ' A' ' 319' ' ' LYS . 13.7 mttp 58.46 114.02 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.331 -0.856 . . . . 6.4299999999999997 109.353 179.984 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' A' A ' 321' ' ' LYS . . . . . 0.587 ' CB ' ' HD3' ' A' ' 322' ' ' PRO . 0.0 OUTLIER -160.54 -64.66 0.02 OUTLIER Pre-proline 0 N--CA 1.492 1.628 0 O-C-N 121.314 -0.866 . . . . 6.1299999999999999 109.708 179.832 . . . . . . . . 3 3 . 1 . 035 nuclear build full ' A' A ' 322' ' ' PRO . . . . . 0.587 ' HD3' ' CB ' ' A' ' 321' ' ' LYS . 6.1 Cg_exo -54.59 174.26 0.2 Allowed 'Trans proline' 0 C--N 1.313 -1.316 0 C-N-CA 121.512 1.474 . . . . 2.8300000000000001 110.028 179.672 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' A' A ' 323' ' ' LEU . . . . . . . . . . . . . 51.2 mt -79.19 142.47 36.27 Favored 'General case' 0 N--CA 1.489 1.499 0 O-C-N 121.202 -0.936 . . . . 2.8300000000000001 109.609 -179.804 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 324' ' ' ASP . . . . . . . . . . . . . 69.7 m-20 -79.06 161.38 26.6 Favored 'General case' 0 N--CA 1.488 1.471 0 O-C-N 121.271 -0.893 . . . . 1.53 109.195 -179.968 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 325' ' ' GLY . . . . . . . . . . . . . . . -67.78 174.79 28.11 Favored Glycine 0 N--CA 1.489 2.213 0 N-CA-C 109.367 -1.493 . . . . 0.60999999999999999 109.367 -179.884 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 326' ' ' GLU . . . . . . . . . . . . . 2.1 mt-10 -57.36 -176.34 0.02 OUTLIER 'General case' 0 N--CA 1.489 1.5 0 O-C-N 121.225 -1.162 . . . . 2.1299999999999999 109.424 -179.92 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 327' ' ' TYR . . . . . . . . . . . . . 48.1 m-85 -148.87 109.06 4.11 Favored 'General case' 0 C--N 1.303 -1.415 0 O-C-N 121.259 -0.901 . . . . 0.47999999999999998 109.413 179.989 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 328' ' ' PHE . . . . . 0.519 ' CZ ' ' HG3' ' C' ' 335' ' ' ARG . 88.4 m-85 -113.83 -169.01 1.43 Allowed 'General case' 0 N--CA 1.489 1.492 0 O-C-N 121.353 -0.842 . . . . 0.31 109.04 179.873 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' A' A ' 329' ' ' THR . . . . . . . . . . . . . 32.4 p -152.57 168.16 26.5 Favored 'General case' 0 C--N 1.302 -1.49 0 O-C-N 121.142 -0.973 . . . . 0.22 109.311 -179.925 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 330' ' ' LEU . . . . . . . . . . . . . 41.9 tp -149.72 127.69 11.89 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.196 -0.94 . . . . 0.28000000000000003 109.694 -179.688 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 331' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -88.3 114.65 25.13 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.23 -0.919 . . . . 0.91000000000000003 109.206 179.661 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' A' A ' 332' ' ' ILE . . . . . 0.651 HD12 ' HD1' ' A' ' 338' ' ' PHE . 23.0 mt -103.32 112.74 37.9 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.57 0 O-C-N 121.194 -0.941 . . . . 0.26000000000000001 109.524 179.957 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' A' A ' 333' ' ' ARG . . . . . 0.44 ' HG2' ' CE1' ' C' ' 327' ' ' TYR . 2.4 mtt180 -72.5 145.24 47.65 Favored 'General case' 0 N--CA 1.488 1.459 0 O-C-N 121.332 -0.855 . . . . 2.9199999999999999 109.31 179.918 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' A' A ' 334' ' ' GLY . . . . . . . . . . . . . . . 83.11 127.72 1.23 Allowed Glycine 0 N--CA 1.492 2.387 0 N-CA-C 109.567 -1.413 . . . . 0.40000000000000002 109.567 179.936 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 335' ' ' ARG . . . . . 0.443 ' CG ' HH11 ' A' ' 335' ' ' ARG . 0.4 OUTLIER -75.01 -35.12 61.99 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.233 -1.157 . . . . 3.0099999999999998 109.345 -179.965 . . . . . . . . 3 3 . 1 . 035 nuclear build full ' A' A ' 336' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -58.06 -59.29 5.5 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.319 -0.863 . . . . 2.29 109.451 179.98 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' A' A ' 337' ' ' ARG . . . . . 0.668 ' NH2' HD12 ' C' ' 348' ' ' LEU . 6.0 mmt180 -60.72 -31.61 70.9 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.33 -0.856 . . . . 2.9300000000000002 109.466 179.981 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' A' A ' 338' ' ' PHE . . . . . 0.651 ' HD1' HD12 ' A' ' 332' ' ' ILE . 52.5 t80 -55.43 -55.78 27.72 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.195 -0.94 . . . . 0.38 109.411 179.968 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' A' A ' 339' ' ' GLU . . . . . . . . . . . . . 4.9 mt-10 -52.07 -32.96 37.0 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.318 -0.864 . . . . 1.97 109.952 -179.812 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 340' ' ' MET . . . . . . . . . . . . . 21.8 ttp -63.52 -52.69 60.1 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.242 -0.911 . . . . 0.31 110.041 -179.519 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 341' ' ' PHE . . . . . 0.453 ' HB2' HD13 ' A' ' 332' ' ' ILE . 56.7 m-85 -62.22 -43.11 99.56 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.112 -0.993 . . . . 0.17999999999999999 110.012 -179.384 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' A' A ' 342' ' ' ARG . . . . . 0.449 ' CG ' HH11 ' A' ' 342' ' ' ARG . 0.0 OUTLIER -50.8 -46.45 59.7 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.299 -0.876 . . . . 2.4199999999999999 110.023 -179.655 . . . . . . . . 3 3 . 1 . 035 nuclear build full ' A' A ' 343' ' ' GLU . . . . . . . . . . . . . 4.9 tt0 -59.29 -43.55 92.57 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.167 -0.958 . . . . 2.3500000000000001 109.928 -179.562 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 344' ' ' LEU . . . . . . . . . . . . . 53.2 mt -62.19 -36.61 82.44 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.202 -0.936 . . . . 0.17999999999999999 109.715 -179.793 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 345' ' ' ASN . . . . . 0.518 ' HB2' HD21 ' C' ' 330' ' ' LEU . 56.7 t-20 -58.47 -55.59 33.1 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.284 -0.885 . . . . 1.0900000000000001 109.612 -179.787 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' A' A ' 346' ' ' GLU . . . . . . . . . . . . . 3.5 tt0 -60.41 -29.42 68.97 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.281 -0.887 . . . . 1.6499999999999999 109.575 -179.803 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 347' ' ' ALA . . . . . . . . . . . . . . . -60.77 -59.08 5.95 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.243 -0.911 . . . . 0.17999999999999999 109.954 179.96 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 348' ' ' LEU . . . . . 0.57 HD22 ' N ' ' A' ' 348' ' ' LEU . 4.0 mm? -61.47 -45.44 94.26 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.265 -0.897 . . . . 0.29999999999999999 110.026 -179.565 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' A' A ' 349' ' ' GLU . . . . . . . . . . . . . 3.8 mm-40 -55.78 -34.21 65.08 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.166 -0.959 . . . . 1.9399999999999999 109.439 -179.623 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 350' ' ' LEU . . . . . 0.542 HD22 HD13 ' B' ' 350' ' ' LEU . 6.0 tt -63.36 -45.69 90.0 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.223 -0.923 . . . . 0.46000000000000002 109.086 179.667 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' A' A ' 351' ' ' LYS . . . . . . . . . . . . . 30.4 tttt -59.72 -45.88 90.81 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.382 -0.824 . . . . 1.3999999999999999 109.692 -179.943 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 352' ' ' ASP . . . . . . . . . . . . . 7.8 m-20 -54.81 -49.85 69.97 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.248 -0.908 . . . . 1.1599999999999999 109.889 -179.717 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 353' ' ' ALA . . . . . . . . . . . . . . . -67.12 -23.85 65.86 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.192 -0.943 . . . . 0.63 109.681 -179.715 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 354' ' ' GLN . . . . . 0.482 ' OE1' HD11 ' B' ' 350' ' ' LEU . 4.6 tt0 -84.45 -7.78 59.17 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.278 -0.889 . . . . 1.47 109.797 -179.932 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' A' A ' 355' ' ' ALA . . . . . . . . . . . . . . . -71.59 -35.94 70.69 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.158 -0.964 . . . . 1.01 109.79 -179.825 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 356' ' ' GLY . . . . . . . . . . . . . . . -78.47 -2.48 84.62 Favored Glycine 0 N--CA 1.492 2.431 0 N-CA-C 109.662 -1.375 . . . . 1.3 109.662 -179.846 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 357' ' ' LYS . . . . . . . . . . . . . 16.8 mttt -89.16 112.76 23.84 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.188 -1.183 . . . . 4.0999999999999996 109.642 179.953 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 358' ' ' GLU . . . . . . . . . . . . . 21.8 pt-20 -49.24 154.81 1.34 Allowed Pre-proline 0 N--CA 1.491 1.617 0 O-C-N 121.218 -0.926 . . . . 5.75 109.327 179.779 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 359' ' ' PRO . . . . . . . . . . . . . 2.3 Cg_endo -62.41 140.89 84.78 Favored 'Trans proline' 0 C--N 1.309 -1.523 0 C-N-CA 122.081 1.854 . . . . 5.0 110.131 179.882 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 360' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.285 0 CA-C-O 117.892 -1.505 . . . . 6.9699999999999998 109.569 179.943 . . . . . . . . 0 0 . 1 . 035 nuclear build full ' B' B ' 319' ' ' LYS . . . . . 0.469 ' O ' ' O ' ' B' ' 320' ' ' LYS . 18.8 ttpt . . . . . 0 N--CA 1.49 1.558 0 CA-C-O 121.259 0.552 . . . . 7.5499999999999998 109.554 . . . . . . . . . 1 1 . 1 . 035 nuclear build full ' B' B ' 320' ' ' LYS . . . . . 0.469 ' O ' ' O ' ' B' ' 319' ' ' LYS . 13.8 mttp 58.36 113.84 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.288 -0.883 . . . . 6.4400000000000004 109.388 179.975 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' B' B ' 321' ' ' LYS . . . . . 0.584 ' CB ' ' HD3' ' B' ' 322' ' ' PRO . 0.0 OUTLIER -160.53 -64.55 0.02 OUTLIER Pre-proline 0 N--CA 1.49 1.572 0 O-C-N 121.313 -0.867 . . . . 6.1299999999999999 109.843 179.972 . . . . . . . . 3 3 . 1 . 035 nuclear build full ' B' B ' 322' ' ' PRO . . . . . 0.584 ' HD3' ' CB ' ' B' ' 321' ' ' LYS . 6.2 Cg_exo -54.73 174.04 0.22 Allowed 'Trans proline' 0 C--N 1.316 -1.168 0 C-N-CA 121.477 1.451 . . . . 2.8199999999999998 109.961 179.597 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' B' B ' 323' ' ' LEU . . . . . . . . . . . . . 47.2 mt -79.12 142.37 36.47 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.222 -0.924 . . . . 2.8399999999999999 109.646 -179.701 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' B' B ' 324' ' ' ASP . . . . . . . . . . . . . 70.2 m-20 -79.06 159.71 27.44 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.294 -0.879 . . . . 1.53 109.477 179.934 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' B' B ' 325' ' ' GLY . . . . . . . . . . . . . . . -65.83 174.43 19.89 Favored Glycine 0 N--CA 1.489 2.167 0 N-CA-C 109.603 -1.399 . . . . 0.58999999999999997 109.603 179.988 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' B' B ' 326' ' ' GLU . . . . . . . . . . . . . 2.1 mt-10 -57.44 -176.35 0.02 OUTLIER 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.243 -1.151 . . . . 2.1299999999999999 109.366 179.901 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' B' B ' 327' ' ' TYR . . . . . . . . . . . . . 47.9 m-85 -148.62 108.97 4.13 Favored 'General case' 0 N--CA 1.489 1.481 0 O-C-N 121.199 -0.938 . . . . 0.47999999999999998 109.427 -179.974 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' B' B ' 328' ' ' PHE . . . . . 0.49 ' CZ ' ' HG3' ' D' ' 335' ' ' ARG . 88.5 m-85 -113.62 -169.07 1.43 Allowed 'General case' 0 N--CA 1.487 1.419 0 O-C-N 121.254 -0.904 . . . . 0.32000000000000001 109.044 179.897 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' B' B ' 329' ' ' THR . . . . . . . . . . . . . 30.3 p -152.45 168.11 26.56 Favored 'General case' 0 N--CA 1.489 1.494 0 O-C-N 121.217 -0.927 . . . . 0.23000000000000001 109.325 -179.965 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' B' B ' 330' ' ' LEU . . . . . 0.695 HD11 HD22 ' D' ' 345' ' ' ASN . 39.9 tp -149.78 127.7 11.84 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.24 -0.913 . . . . 0.28000000000000003 109.656 -179.742 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' B' B ' 331' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -88.43 114.58 25.2 Favored 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.35 -0.844 . . . . 0.91000000000000003 109.299 179.708 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' B' B ' 332' ' ' ILE . . . . . 0.662 HD12 ' HD1' ' B' ' 338' ' ' PHE . 22.2 mt -103.18 112.57 37.13 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.542 0 O-C-N 121.107 -0.995 . . . . 0.23999999999999999 109.563 -179.923 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' B' B ' 333' ' ' ARG . . . . . 0.473 ' HG2' ' CE1' ' D' ' 327' ' ' TYR . 2.3 mtt180 -72.19 145.15 48.22 Favored 'General case' 0 N--CA 1.489 1.49 0 O-C-N 121.306 -0.871 . . . . 2.9300000000000002 109.312 179.86 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' B' B ' 334' ' ' GLY . . . . . . . . . . . . . . . 83.08 127.87 1.24 Allowed Glycine 0 N--CA 1.49 2.269 0 N-CA-C 109.646 -1.382 . . . . 0.40000000000000002 109.646 -179.999 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' B' B ' 335' ' ' ARG . . . . . 0.437 HH11 ' CG ' ' B' ' 335' ' ' ARG . 0.3 OUTLIER -75.16 -35.38 61.63 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.338 -1.095 . . . . 3.0099999999999998 109.34 179.935 . . . . . . . . 3 3 . 1 . 035 nuclear build full ' B' B ' 336' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -57.93 -59.15 5.69 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.296 -0.877 . . . . 2.2799999999999998 109.403 179.941 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' B' B ' 337' ' ' ARG . . . . . 0.58 ' NH2' HD12 ' D' ' 348' ' ' LEU . 6.2 mmt180 -60.86 -31.86 71.3 Favored 'General case' 0 N--CA 1.489 1.495 0 O-C-N 121.337 -0.852 . . . . 2.9300000000000002 109.434 -179.944 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' B' B ' 338' ' ' PHE . . . . . 0.662 ' HD1' HD12 ' B' ' 332' ' ' ILE . 52.7 t80 -55.14 -55.88 26.17 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.297 -0.877 . . . . 0.37 109.495 179.909 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' B' B ' 339' ' ' GLU . . . . . . . . . . . . . 4.9 mt-10 -51.77 -33.18 34.04 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.316 -0.865 . . . . 1.98 110.019 -179.865 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' B' B ' 340' ' ' MET . . . . . . . . . . . . . 20.9 ttp -63.45 -52.63 60.63 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.198 -0.939 . . . . 0.32000000000000001 110.113 -179.428 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' B' B ' 341' ' ' PHE . . . . . 0.46 ' CZ ' ' HA ' ' D' ' 345' ' ' ASN . 56.2 m-85 -62.42 -42.99 99.86 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.171 -0.956 . . . . 0.17999999999999999 109.988 -179.466 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' B' B ' 342' ' ' ARG . . . . . 0.448 ' CG ' ' NH1' ' B' ' 342' ' ' ARG . 0.0 OUTLIER -50.97 -46.51 61.24 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.315 -0.866 . . . . 2.4199999999999999 110.049 -179.647 . . . . . . . . 3 3 . 1 . 035 nuclear build full ' B' B ' 343' ' ' GLU . . . . . . . . . . . . . 5.1 tt0 -59.23 -43.39 92.35 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.121 -0.987 . . . . 2.3500000000000001 109.953 -179.696 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' B' B ' 344' ' ' LEU . . . . . . . . . . . . . 55.7 mt -62.31 -36.56 82.51 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.184 -0.948 . . . . 0.17999999999999999 109.75 -179.774 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' B' B ' 345' ' ' ASN . . . . . 0.601 HD22 HD11 ' D' ' 330' ' ' LEU . 56.9 t-20 -58.61 -55.02 40.4 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.239 -0.913 . . . . 1.0900000000000001 109.689 -179.838 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' B' B ' 346' ' ' GLU . . . . . . . . . . . . . 3.4 tt0 -60.77 -29.49 69.45 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.354 -0.841 . . . . 1.6599999999999999 109.574 -179.815 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' B' B ' 347' ' ' ALA . . . . . . . . . . . . . . . -60.88 -58.91 6.43 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.292 -0.88 . . . . 0.17000000000000001 109.924 -179.896 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' B' B ' 348' ' ' LEU . . . . . 0.761 HD12 ' NH2' ' D' ' 337' ' ' ARG . 4.0 mm? -61.45 -45.93 92.22 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.196 -0.94 . . . . 0.28999999999999998 109.887 -179.622 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' B' B ' 349' ' ' GLU . . . . . . . . . . . . . 3.9 mm-40 -55.38 -34.23 64.14 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.17 -0.957 . . . . 1.95 109.534 -179.705 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' B' B ' 350' ' ' LEU . . . . . 0.542 HD13 HD22 ' A' ' 350' ' ' LEU . 6.1 tt -63.32 -45.77 89.78 Favored 'General case' 0 N--CA 1.488 1.457 0 O-C-N 121.205 -0.934 . . . . 0.45000000000000001 109.173 179.69 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' B' B ' 351' ' ' LYS . . . . . . . . . . . . . 30.5 tttt -59.79 -45.87 90.98 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.442 -0.786 . . . . 1.3799999999999999 109.713 -179.967 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' B' B ' 352' ' ' ASP . . . . . . . . . . . . . 7.8 m-20 -54.88 -49.58 70.84 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.22 -0.925 . . . . 1.1599999999999999 109.84 -179.735 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' B' B ' 353' ' ' ALA . . . . . . . . . . . . . . . -67.32 -24.03 65.7 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.19 -0.943 . . . . 0.60999999999999999 109.601 -179.749 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' B' B ' 354' ' ' GLN . . . . . 0.457 ' OE1' HD11 ' A' ' 350' ' ' LEU . 4.5 tt0 -84.17 -8.32 59.11 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.233 -0.917 . . . . 1.45 109.779 -179.883 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' B' B ' 355' ' ' ALA . . . . . . . . . . . . . . . -71.3 -35.73 71.4 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.14 -0.975 . . . . 0.97999999999999998 109.937 -179.779 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' B' B ' 356' ' ' GLY . . . . . . . . . . . . . . . -78.51 -2.66 85.22 Favored Glycine 0 N--CA 1.49 2.284 0 N-CA-C 109.7 -1.36 . . . . 1.29 109.7 -179.888 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' B' B ' 357' ' ' LYS . . . . . . . . . . . . . 16.9 mttt -89.02 112.72 23.71 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.219 -1.165 . . . . 4.0899999999999999 109.611 -179.922 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' B' B ' 358' ' ' GLU . . . . . . . . . . . . . 22.0 pt-20 -49.26 154.37 1.47 Allowed Pre-proline 0 N--CA 1.491 1.584 0 O-C-N 121.29 -0.881 . . . . 5.7199999999999998 109.306 179.759 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' B' B ' 359' ' ' PRO . . . . . . . . . . . . . 2.1 Cg_endo -62.29 140.47 83.16 Favored 'Trans proline' 0 C--N 1.309 -1.506 0 C-N-CA 122.07 1.847 . . . . 4.9800000000000004 110.26 179.989 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' B' B ' 360' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.303 0 N-CA-C 109.418 -1.473 . . . . 6.9800000000000004 109.418 179.911 . . . . . . . . 0 0 . 1 . 035 nuclear build full ' C' C ' 319' ' ' LYS . . . . . 0.459 ' O ' ' HB2' ' C' ' 320' ' ' LYS . 0.0 OUTLIER . . . . . 0 N--CA 1.49 1.54 0 N-CA-C 109.499 -0.556 . . . . 6.8200000000000003 109.499 . . . . . . . . . 2 2 . 1 . 035 nuclear build full ' C' C ' 320' ' ' LYS . . . . . 0.459 ' HB2' ' O ' ' C' ' 319' ' ' LYS . 16.0 mtmm 61.49 151.15 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.235 -0.916 . . . . 6.4900000000000002 109.657 179.884 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' C' C ' 321' ' ' LYS . . . . . 0.518 ' N ' ' HD3' ' C' ' 322' ' ' PRO . 0.0 OUTLIER -158.22 61.19 2.02 Favored Pre-proline 0 N--CA 1.49 1.54 0 O-C-N 121.251 -0.906 . . . . 6.4000000000000004 109.273 179.977 . . . . . . . . 3 3 . 1 . 035 nuclear build full ' C' C ' 322' ' ' PRO . . . . . 0.518 ' HD3' ' N ' ' C' ' 321' ' ' LYS . 4.8 Cg_exo -60.1 149.53 84.19 Favored 'Trans proline' 0 C--N 1.309 -1.514 0 C-N-CA 122.225 1.95 . . . . 3.4199999999999999 110.576 -179.797 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' C' C ' 323' ' ' LEU . . . . . . . . . . . . . 16.4 mt -79.52 177.42 8.88 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.335 -0.853 . . . . 3.9500000000000002 109.324 179.868 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' C' C ' 324' ' ' ASP . . . . . . . . . . . . . 17.5 m-20 -80.12 146.58 31.79 Favored 'General case' 0 N--CA 1.489 1.492 0 O-C-N 121.308 -0.87 . . . . 1.6299999999999999 109.475 179.938 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' C' C ' 325' ' ' GLY . . . . . . . . . . . . . . . -68.42 176.9 26.7 Favored Glycine 0 N--CA 1.49 2.27 0 N-CA-C 109.265 -1.534 . . . . 0.72999999999999998 109.265 179.701 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' C' C ' 326' ' ' GLU . . . . . 0.49 ' HB3' ' CE1' ' C' ' 328' ' ' PHE . 60.7 mm-40 -56.84 179.38 0.04 OUTLIER 'General case' 0 N--CA 1.488 1.451 0 O-C-N 121.137 -1.214 . . . . 2.1699999999999999 109.204 -179.883 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' C' C ' 327' ' ' TYR . . . . . 0.44 ' CE1' ' HG2' ' A' ' 333' ' ' ARG . 37.0 m-85 -149.22 109.59 4.18 Favored 'General case' 0 C--N 1.302 -1.462 0 O-C-N 121.354 -0.841 . . . . 0.47999999999999998 109.41 179.94 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' C' C ' 328' ' ' PHE . . . . . 0.49 ' CE1' ' HB3' ' C' ' 326' ' ' GLU . 65.2 m-85 -113.58 -167.72 1.24 Allowed 'General case' 0 N--CA 1.489 1.477 0 O-C-N 121.431 -0.793 . . . . 0.33000000000000002 109.393 179.969 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' C' C ' 329' ' ' THR . . . . . . . . . . . . . 14.6 p -151.86 168.66 24.43 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.242 -0.911 . . . . 0.23000000000000001 109.342 -179.865 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' C' C ' 330' ' ' LEU . . . . . 0.518 HD21 ' HB2' ' A' ' 345' ' ' ASN . 30.6 tp -149.48 127.02 11.58 Favored 'General case' 0 C--N 1.303 -1.453 0 O-C-N 121.201 -0.937 . . . . 0.28000000000000003 109.505 -179.741 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' C' C ' 331' ' ' GLN . . . . . 0.536 ' CG ' ' NH2' ' C' ' 333' ' ' ARG . 6.9 tp-100 -87.23 114.22 23.65 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.312 -0.868 . . . . 1.48 109.46 179.941 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' C' C ' 332' ' ' ILE . . . . . 0.612 HG21 ' HA ' ' C' ' 338' ' ' PHE . 84.7 mt -103.7 110.99 31.7 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.548 0 O-C-N 121.297 -0.877 . . . . 0.23999999999999999 109.687 179.925 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' C' C ' 333' ' ' ARG . . . . . 0.536 ' NH2' ' CG ' ' C' ' 331' ' ' GLN . 0.0 OUTLIER -72.92 147.3 45.42 Favored 'General case' 0 N--CA 1.488 1.439 0 O-C-N 121.156 -0.965 . . . . 2.7400000000000002 109.277 179.711 . . . . . . . . 3 3 . 1 . 035 nuclear build full ' C' C ' 334' ' ' GLY . . . . . . . . . . . . . . . 76.65 131.73 0.45 Allowed Glycine 0 N--CA 1.492 2.388 0 N-CA-C 109.632 -1.387 . . . . 0.34999999999999998 109.632 179.815 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' C' C ' 335' ' ' ARG . . . . . 0.519 ' HG3' ' CZ ' ' A' ' 328' ' ' PHE . 1.1 tmt_? -76.84 -30.51 56.35 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.327 -1.102 . . . . 2.5299999999999998 109.61 -179.994 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' C' C ' 336' ' ' GLU . . . . . . . . . . . . . 21.2 mt-10 -57.62 -60.08 4.21 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.345 -0.847 . . . . 2.6200000000000001 109.729 -179.725 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' C' C ' 337' ' ' ARG . . . . . 0.495 ' HD2' ' N ' ' C' ' 337' ' ' ARG . 11.4 mmm180 -59.85 -31.52 69.83 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.305 -0.872 . . . . 2.8100000000000001 109.609 -179.592 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' C' C ' 338' ' ' PHE . . . . . 0.612 ' HA ' HG21 ' C' ' 332' ' ' ILE . 61.3 t80 -56.12 -56.74 17.21 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.365 -0.834 . . . . 0.40000000000000002 109.858 -179.724 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' C' C ' 339' ' ' GLU . . . . . . . . . . . . . 3.8 mt-10 -49.45 -38.38 29.45 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.254 -0.904 . . . . 2.0499999999999998 110.302 -179.462 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' C' C ' 340' ' ' MET . . . . . . . . . . . . . 35.1 ttp -64.61 -47.15 79.68 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.11 -0.994 . . . . 0.32000000000000001 110.279 -179.396 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' C' C ' 341' ' ' PHE . . . . . 0.458 ' CZ ' ' HA ' ' A' ' 345' ' ' ASN . 38.0 m-85 -62.47 -52.87 61.82 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.173 -0.954 . . . . 0.17999999999999999 110.139 -179.352 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' C' C ' 342' ' ' ARG . . . . . . . . . . . . . 7.4 tmm_? -46.51 -40.08 11.95 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.267 -0.896 . . . . 2.9100000000000001 109.718 -179.751 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' C' C ' 343' ' ' GLU . . . . . . . . . . . . . 6.4 tp10 -59.06 -50.2 74.98 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.236 -0.915 . . . . 2.1400000000000001 109.721 -179.956 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' C' C ' 344' ' ' LEU . . . . . . . . . . . . . 41.0 mt -61.91 -28.36 69.47 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.263 -0.898 . . . . 0.22 109.419 179.992 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' C' C ' 345' ' ' ASN . . . . . 0.5 ' ND2' ' OE2' ' C' ' 349' ' ' GLU . 13.9 t-20 -57.8 -59.64 4.91 Favored 'General case' 0 N--CA 1.489 1.484 0 O-C-N 121.243 -0.911 . . . . 1.0800000000000001 109.45 179.929 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' C' C ' 346' ' ' GLU . . . . . . . . . . . . . 1.3 tt0 -61.74 -24.23 66.67 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.431 -0.793 . . . . 2.21 109.655 -179.954 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' C' C ' 347' ' ' ALA . . . . . 0.496 ' HB1' ' HB1' ' D' ' 347' ' ' ALA . . . -61.71 -62.8 1.55 Allowed 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.204 -0.935 . . . . 0.17999999999999999 110.025 -179.76 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' C' C ' 348' ' ' LEU . . . . . 0.668 HD12 ' NH2' ' A' ' 337' ' ' ARG . 3.6 mm? -61.9 -45.0 95.64 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.19 -0.944 . . . . 0.32000000000000001 110.018 -179.405 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' C' C ' 349' ' ' GLU . . . . . 0.5 ' OE2' ' ND2' ' C' ' 345' ' ' ASN . 3.6 mt-10 -56.37 -34.16 66.4 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.153 -0.967 . . . . 2.1899999999999999 109.525 -179.629 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' C' C ' 350' ' ' LEU . . . . . 0.637 HD22 HD13 ' D' ' 350' ' ' LEU . 7.4 tt -65.0 -41.29 95.51 Favored 'General case' 0 N--CA 1.489 1.483 0 O-C-N 121.217 -0.927 . . . . 0.46000000000000002 109.188 179.674 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' C' C ' 351' ' ' LYS . . . . . . . . . . . . . 13.7 tttt -60.3 -48.9 79.78 Favored 'General case' 0 N--CA 1.489 1.501 0 O-C-N 121.353 -0.842 . . . . 1.3500000000000001 109.621 -179.919 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' C' C ' 352' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -57.23 -44.24 83.58 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.244 -0.91 . . . . 1.1899999999999999 109.774 -179.902 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' C' C ' 353' ' ' ALA . . . . . . . . . . . . . . . -68.01 -19.28 64.9 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.296 -0.877 . . . . 0.56999999999999995 109.764 -179.825 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' C' C ' 354' ' ' GLN . . . . . 0.42 ' OE1' HD11 ' D' ' 350' ' ' LEU . 2.9 mt-30 -82.76 -7.88 59.62 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.268 -0.895 . . . . 1.47 109.741 -179.893 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' C' C ' 355' ' ' ALA . . . . . . . . . . . . . . . -70.76 -36.08 72.93 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.229 -0.919 . . . . 0.93000000000000005 109.564 179.992 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' C' C ' 356' ' ' GLY . . . . . . . . . . . . . . . -78.1 3.43 61.73 Favored Glycine 0 N--CA 1.491 2.328 0 N-CA-C 109.855 -1.298 . . . . 1.3300000000000001 109.855 -179.785 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' C' C ' 357' ' ' LYS . . . . . . . . . . . . . 3.1 tptm -85.92 46.88 1.37 Allowed 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.172 -1.193 . . . . 4.0099999999999998 109.616 -179.933 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' C' C ' 358' ' ' GLU . . . . . 0.492 ' HG2' ' HD2' ' C' ' 359' ' ' PRO . 1.0 OUTLIER -49.56 162.6 0.43 Allowed Pre-proline 0 N--CA 1.49 1.565 0 O-C-N 121.176 -0.952 . . . . 5.75 109.159 179.75 . . . . . . . . 3 3 . 1 . 035 nuclear build full ' C' C ' 359' ' ' PRO . . . . . 0.492 ' HD2' ' HG2' ' C' ' 358' ' ' GLU . 4.1 Cg_exo -60.42 -158.12 0.02 OUTLIER 'Trans proline' 0 C--N 1.309 -1.549 0 C-N-CA 121.932 1.755 . . . . 4.9400000000000004 109.937 179.928 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' C' C ' 360' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.293 0 CA-C-O 118.058 -1.412 . . . . 6.5 109.589 179.959 . . . . . . . . 0 0 . 1 . 035 nuclear build full ' D' D ' 319' ' ' LYS . . . . . 0.462 ' O ' ' O ' ' D' ' 320' ' ' LYS . 18.9 ttpt . . . . . 0 N--CA 1.491 1.583 0 N-CA-C 109.387 -0.597 . . . . 7.5300000000000002 109.387 . . . . . . . . . 1 1 . 1 . 035 nuclear build full ' D' D ' 320' ' ' LYS . . . . . 0.462 ' O ' ' O ' ' D' ' 319' ' ' LYS . 13.7 mttp 58.54 113.98 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.359 -0.838 . . . . 6.4100000000000001 109.354 -179.827 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' D' D ' 321' ' ' LYS . . . . . 0.592 ' CB ' ' CD ' ' D' ' 322' ' ' PRO . 0.0 OUTLIER -160.41 -64.8 0.02 OUTLIER Pre-proline 0 N--CA 1.492 1.642 0 O-C-N 121.364 -0.835 . . . . 6.1100000000000003 109.806 179.871 . . . . . . . . 3 3 . 1 . 035 nuclear build full ' D' D ' 322' ' ' PRO . . . . . 0.592 ' CD ' ' CB ' ' D' ' 321' ' ' LYS . 6.2 Cg_exo -54.55 174.2 0.2 Allowed 'Trans proline' 0 C--N 1.315 -1.217 0 C-N-CA 121.644 1.563 . . . . 2.8199999999999998 109.958 179.71 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' D' D ' 323' ' ' LEU . . . . . . . . . . . . . 47.5 mt -79.38 142.03 36.37 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.161 -0.962 . . . . 2.8300000000000001 109.612 -179.735 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' D' D ' 324' ' ' ASP . . . . . . . . . . . . . 70.5 m-20 -78.64 160.75 27.38 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.274 -0.891 . . . . 1.54 109.274 -179.975 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' D' D ' 325' ' ' GLY . . . . . . . . . . . . . . . -67.21 174.78 26.0 Favored Glycine 0 N--CA 1.489 2.233 0 N-CA-C 109.448 -1.461 . . . . 0.58999999999999997 109.448 -179.822 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' D' D ' 326' ' ' GLU . . . . . . . . . . . . . 2.1 mt-10 -57.3 -176.15 0.02 OUTLIER 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.339 -1.095 . . . . 2.1299999999999999 109.355 -179.936 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' D' D ' 327' ' ' TYR . . . . . 0.473 ' CE1' ' HG2' ' B' ' 333' ' ' ARG . 47.0 m-85 -148.91 108.65 4.02 Favored 'General case' 0 N--CA 1.488 1.444 0 O-C-N 121.318 -0.864 . . . . 0.46999999999999997 109.453 -179.934 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' D' D ' 328' ' ' PHE . . . . . 0.415 ' CZ ' ' HG3' ' B' ' 335' ' ' ARG . 88.7 m-85 -113.47 -169.02 1.42 Allowed 'General case' 0 N--CA 1.489 1.481 0 O-C-N 121.356 -0.84 . . . . 0.29999999999999999 109.103 179.936 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' D' D ' 329' ' ' THR . . . . . . . . . . . . . 31.1 p -152.44 168.18 26.32 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.208 -0.932 . . . . 0.22 109.336 -179.968 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' D' D ' 330' ' ' LEU . . . . . 0.601 HD11 HD22 ' B' ' 345' ' ' ASN . 38.5 tp -149.96 127.2 11.34 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.197 -0.94 . . . . 0.28000000000000003 109.642 -179.667 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' D' D ' 331' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -87.83 114.56 24.55 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.312 -0.868 . . . . 0.93000000000000005 109.299 179.604 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' D' D ' 332' ' ' ILE . . . . . 0.666 HD12 ' HD1' ' D' ' 338' ' ' PHE . 21.9 mt -103.29 112.88 38.41 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.55 0 O-C-N 121.121 -0.987 . . . . 0.25 109.493 179.925 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' D' D ' 333' ' ' ARG . . . . . . . . . . . . . 2.3 mtt180 -72.43 145.23 47.77 Favored 'General case' 0 N--CA 1.488 1.445 0 O-C-N 121.141 -0.974 . . . . 2.9300000000000002 109.365 179.938 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' D' D ' 334' ' ' GLY . . . . . . . . . . . . . . . 83.08 127.57 1.2 Allowed Glycine 0 N--CA 1.49 2.271 0 N-CA-C 109.608 -1.397 . . . . 0.40999999999999998 109.608 179.861 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' D' D ' 335' ' ' ARG . . . . . 0.49 ' HG3' ' CZ ' ' B' ' 328' ' ' PHE . 0.4 OUTLIER -74.75 -35.23 62.62 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.225 -1.162 . . . . 3.0299999999999998 109.466 179.953 . . . . . . . . 3 3 . 1 . 035 nuclear build full ' D' D ' 336' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -58.02 -59.29 5.5 Favored 'General case' 0 N--CA 1.489 1.484 0 O-C-N 121.253 -0.904 . . . . 2.2599999999999998 109.522 179.956 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' D' D ' 337' ' ' ARG . . . . . 0.761 ' NH2' HD12 ' B' ' 348' ' ' LEU . 6.2 mmt180 -60.73 -31.77 71.06 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.317 -0.865 . . . . 2.9199999999999999 109.426 -179.97 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' D' D ' 338' ' ' PHE . . . . . 0.666 ' HD1' HD12 ' D' ' 332' ' ' ILE . 52.9 t80 -55.19 -55.9 26.05 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.234 -0.916 . . . . 0.37 109.517 179.927 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' D' D ' 339' ' ' GLU . . . . . . . . . . . . . 5.0 mt-10 -51.94 -33.06 35.78 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.261 -0.899 . . . . 1.99 109.893 -179.755 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' D' D ' 340' ' ' MET . . . . . . . . . . . . . 21.1 ttp -63.53 -52.51 60.86 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.262 -0.898 . . . . 0.31 110.12 -179.422 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' D' D ' 341' ' ' PHE . . . . . 0.569 ' CZ ' ' HA ' ' B' ' 345' ' ' ASN . 57.0 m-85 -62.38 -43.17 99.45 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.137 -0.977 . . . . 0.17999999999999999 110.016 -179.515 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' D' D ' 342' ' ' ARG . . . . . 0.447 ' CG ' ' NH1' ' D' ' 342' ' ' ARG . 0.0 OUTLIER -50.77 -46.47 59.49 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.229 -0.92 . . . . 2.4100000000000001 110.017 -179.657 . . . . . . . . 3 3 . 1 . 035 nuclear build full ' D' D ' 343' ' ' GLU . . . . . . . . . . . . . 4.7 tt0 -59.12 -43.71 91.96 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.181 -0.949 . . . . 2.3500000000000001 109.887 -179.636 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' D' D ' 344' ' ' LEU . . . . . . . . . . . . . 54.4 mt -62.18 -36.54 82.19 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.175 -0.953 . . . . 0.19 109.783 -179.79 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' D' D ' 345' ' ' ASN . . . . . 0.695 HD22 HD11 ' B' ' 330' ' ' LEU . 56.5 t-20 -58.61 -55.43 35.17 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.243 -0.911 . . . . 1.0900000000000001 109.664 -179.824 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' D' D ' 346' ' ' GLU . . . . . . . . . . . . . 3.3 tt0 -60.52 -29.44 69.11 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.193 -0.942 . . . . 1.6899999999999999 109.534 -179.777 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' D' D ' 347' ' ' ALA . . . . . 0.496 ' HB1' ' HB1' ' C' ' 347' ' ' ALA . . . -60.91 -58.84 6.74 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.154 -0.966 . . . . 0.17999999999999999 109.885 -179.943 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' D' D ' 348' ' ' LEU . . . . . 0.58 HD12 ' NH2' ' B' ' 337' ' ' ARG . 4.0 mm? -61.53 -45.82 92.55 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.212 -0.93 . . . . 0.31 109.9 -179.557 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' D' D ' 349' ' ' GLU . . . . . . . . . . . . . 3.9 mm-40 -55.51 -34.17 64.41 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.273 -0.892 . . . . 1.95 109.607 -179.622 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' D' D ' 350' ' ' LEU . . . . . 0.637 HD13 HD22 ' C' ' 350' ' ' LEU . 6.1 tt -63.44 -45.79 89.31 Favored 'General case' 0 N--CA 1.489 1.484 0 O-C-N 121.273 -0.892 . . . . 0.42999999999999999 109.069 179.701 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' D' D ' 351' ' ' LYS . . . . . . . . . . . . . 30.2 tttt -59.77 -45.74 91.34 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.402 -0.811 . . . . 1.3999999999999999 109.664 -179.942 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' D' D ' 352' ' ' ASP . . . . . . . . . . . . . 7.6 m-20 -54.91 -49.85 70.25 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.293 -0.879 . . . . 1.1699999999999999 109.845 -179.766 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' D' D ' 353' ' ' ALA . . . . . . . . . . . . . . . -67.22 -23.88 65.77 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.198 -0.939 . . . . 0.58999999999999997 109.651 -179.731 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' D' D ' 354' ' ' GLN . . . . . . . . . . . . . 4.6 tt0 -84.46 -8.02 59.09 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.249 -0.907 . . . . 1.4399999999999999 109.728 -179.889 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' D' D ' 355' ' ' ALA . . . . . . . . . . . . . . . -71.51 -35.64 70.81 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.273 -0.892 . . . . 0.97999999999999998 109.749 -179.752 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' D' D ' 356' ' ' GLY . . . . . . . . . . . . . . . -78.58 -2.57 85.32 Favored Glycine 0 N--CA 1.49 2.289 0 N-CA-C 109.675 -1.37 . . . . 1.28 109.675 -179.84 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' D' D ' 357' ' ' LYS . . . . . . . . . . . . . 16.7 mttt -89.04 112.78 23.8 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.272 -1.134 . . . . 4.0899999999999999 109.633 -179.914 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' D' D ' 358' ' ' GLU . . . . . . . . . . . . . 21.8 pt-20 -49.51 154.53 1.57 Allowed Pre-proline 0 N--CA 1.491 1.581 0 O-C-N 121.114 -0.991 . . . . 5.71 109.272 179.803 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' D' D ' 359' ' ' PRO . . . . . . . . . . . . . 2.3 Cg_endo -62.28 140.59 83.82 Favored 'Trans proline' 0 C--N 1.31 -1.47 0 C-N-CA 122.165 1.91 . . . . 4.9699999999999998 110.152 179.947 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' D' D ' 360' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.299 0 CA-C-O 117.964 -1.464 . . . . 6.9699999999999998 109.448 179.888 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 326' ' ' GLU . . . . . . . . . . . . . 4.2 mm-40 . . . . . 0 N--CA 1.487 1.424 0 N-CA-C 109.235 -0.654 . . . . 2.13 109.235 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 327' ' ' TYR . . . . . . . . . . . . . 42.2 m-85 -147.31 96.28 2.68 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.248 -0.908 . . . . 0.48 109.437 -179.974 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 328' ' ' PHE . . . . . 0.564 ' CE2' ' HG3' ' C' ' 335' ' ' ARG . 56.8 m-85 -103.46 -160.34 0.77 Allowed 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.319 -0.863 . . . . 0.31 109.588 -179.759 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 329' ' ' THR . . . . . 0.455 ' HA ' ' O ' ' C' ' 330' ' ' LEU . 34.8 p -154.11 169.22 24.07 Favored 'General case' 0 N--CA 1.489 1.49 0 O-C-N 121.455 -0.778 . . . . 0.22 108.922 179.894 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 330' ' ' LEU . . . . . 0.478 ' O ' ' HA ' ' C' ' 329' ' ' THR . 24.4 tp -151.42 132.97 14.76 Favored 'General case' 0 N--CA 1.488 1.474 0 O-C-N 121.071 -1.018 . . . . 0.28 109.768 -179.717 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 331' ' ' GLN . . . . . . . . . . . . . 7.1 tp-100 -85.66 115.94 23.64 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.343 -0.848 . . . . 0.91 108.946 179.695 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 332' ' ' ILE . . . . . 0.794 HG21 ' HA ' ' A' ' 338' ' ' PHE . 75.0 mt -103.17 104.25 16.34 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.555 0 O-C-N 121.261 -0.899 . . . . 0.26 109.819 -179.714 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 333' ' ' ARG . . . . . 0.554 ' CG ' ' CE1' ' C' ' 327' ' ' TYR . 1.9 mpt_? -72.74 138.86 46.78 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.376 -0.828 . . . . 2.92 109.35 179.744 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 334' ' ' GLY . . . . . . . . . . . . . . . 91.25 130.21 4.69 Favored Glycine 0 N--CA 1.491 2.367 0 N-CA-C 109.573 -1.411 . . . . 0.4 109.573 179.868 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 335' ' ' ARG . . . . . 0.424 ' O ' ' HB3' ' A' ' 338' ' ' PHE . 57.5 ttt180 -79.36 -37.8 36.55 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.34 -1.094 . . . . 3.01 109.653 179.919 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 336' ' ' GLU . . . . . . . . . . . . . 5.0 mt-10 -58.0 -60.87 3.07 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.187 -0.946 . . . . 2.29 109.671 -179.863 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 337' ' ' ARG . . . . . . . . . . . . . 4.0 mtt180 -59.98 -28.58 67.8 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.232 -0.918 . . . . 2.93 109.603 -179.831 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 338' ' ' PHE . . . . . 0.794 ' HA ' HG21 ' A' ' 332' ' ' ILE . 59.1 t80 -54.51 -60.24 3.62 Favored 'General case' 0 N--CA 1.489 1.494 0 O-C-N 121.175 -0.953 . . . . 0.38 109.477 -179.996 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 339' ' ' GLU . . . . . . . . . . . . . 5.8 mt-10 -51.36 -31.29 21.65 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.291 -0.881 . . . . 1.97 109.771 -179.917 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 340' ' ' MET . . . . . . . . . . . . . 27.7 ttp -64.19 -52.61 58.11 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.128 -0.982 . . . . 0.31 109.881 -179.703 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 341' ' ' PHE . . . . . . . . . . . . . 39.2 m-85 -61.79 -47.84 83.31 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.205 -0.935 . . . . 0.18 109.766 -179.623 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 342' ' ' ARG . . . . . . . . . . . . . 9.7 ttt180 -49.67 -40.21 39.16 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.21 -0.931 . . . . 2.42 109.779 -179.811 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 343' ' ' GLU . . . . . . . . . . . . . 4.3 tt0 -59.29 -49.7 76.84 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.196 -0.94 . . . . 2.35 109.8 -179.762 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 344' ' ' LEU . . . . . 0.548 ' CD2' HD22 ' B' ' 344' ' ' LEU . 45.4 mt -61.84 -31.47 71.73 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.148 -0.97 . . . . 0.18 109.569 -179.805 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 345' ' ' ASN . . . . . . . . . . . . . 15.9 t-20 -57.87 -57.87 10.87 Favored 'General case' 0 N--CA 1.489 1.477 0 O-C-N 121.229 -0.919 . . . . 1.09 109.53 -179.965 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 346' ' ' GLU . . . . . . . . . . . . . 37.3 tt0 -60.98 -29.06 69.46 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.296 -0.878 . . . . 1.65 109.628 -179.848 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 347' ' ' ALA . . . . . 0.4 ' HB1' ' HB1' ' B' ' 347' ' ' ALA . . . -59.45 -58.43 8.65 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.195 -0.941 . . . . 0.18 109.843 -179.83 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 348' ' ' LEU . . . . . 0.608 HD22 ' N ' ' A' ' 348' ' ' LEU . 4.2 mm? -61.52 -38.73 88.45 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.282 -0.887 . . . . 0.3 109.71 -179.671 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 349' ' ' GLU . . . . . . . . . . . . . 9.2 mt-10 -57.83 -38.31 75.41 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.337 -0.852 . . . . 1.94 110.063 -179.57 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 350' ' ' LEU . . . . . 0.664 HD22 HD13 ' B' ' 350' ' ' LEU . 6.1 tt -62.75 -48.74 77.88 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.165 -0.96 . . . . 0.46 109.73 -179.755 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 351' ' ' LYS . . . . . . . . . . . . . 5.8 tttt -59.33 -36.92 76.55 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.221 -0.924 . . . . 1.4 109.471 -179.808 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 352' ' ' ASP . . . . . 0.403 ' OD1' ' CZ ' ' C' ' 337' ' ' ARG . 55.3 m-20 -56.36 -42.3 77.57 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.254 -0.904 . . . . 1.16 109.709 -179.974 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 353' ' ' ALA . . . . . . . . . . . . . . . -67.62 -23.02 65.32 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.271 -0.893 . . . . 0.63 109.93 -179.573 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 354' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.491 1.602 0 O-C-N 121.185 -0.947 . . . . 1.47 109.746 -179.736 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 326' ' ' GLU . . . . . . . . . . . . . 4.1 mm-40 . . . . . 0 N--CA 1.489 1.514 0 N-CA-C 109.208 -0.664 . . . . 2.13 109.208 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' B' B ' 327' ' ' TYR . . . . . 0.606 ' CE2' ' HG2' ' D' ' 333' ' ' ARG . 42.3 m-85 -147.55 96.1 2.63 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.322 -0.861 . . . . 0.48 109.426 179.986 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 328' ' ' PHE . . . . . . . . . . . . . 58.1 m-85 -103.27 -160.2 0.76 Allowed 'General case' 0 N--CA 1.489 1.482 0 O-C-N 121.323 -0.861 . . . . 0.32 109.57 -179.841 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 329' ' ' THR . . . . . . . . . . . . . 35.4 p -154.18 169.2 24.17 Favored 'General case' 0 N--CA 1.489 1.482 0 O-C-N 121.354 -0.841 . . . . 0.23 108.987 179.825 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 330' ' ' LEU . . . . . . . . . . . . . 25.0 tp -151.34 133.04 14.89 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.084 -1.01 . . . . 0.28 109.735 -179.765 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 331' ' ' GLN . . . . . . . . . . . . . 7.1 tp-100 -85.65 116.1 23.73 Favored 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.283 -0.885 . . . . 0.91 108.999 179.546 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 332' ' ' ILE . . . . . 0.783 HG21 ' HA ' ' B' ' 338' ' ' PHE . 75.3 mt -103.44 104.3 16.46 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.523 0 O-C-N 121.258 -0.901 . . . . 0.24 109.761 -179.669 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 333' ' ' ARG . . . . . 0.527 ' CG ' ' CE2' ' D' ' 327' ' ' TYR . 1.9 mpt_? -72.87 139.05 46.66 Favored 'General case' 0 N--CA 1.489 1.493 0 O-C-N 121.271 -0.893 . . . . 2.93 109.352 179.737 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 334' ' ' GLY . . . . . . . . . . . . . . . 91.24 129.89 4.58 Favored Glycine 0 N--CA 1.489 2.206 0 N-CA-C 109.679 -1.369 . . . . 0.4 109.679 179.906 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 335' ' ' ARG . . . . . 0.421 ' O ' ' HB3' ' B' ' 338' ' ' PHE . 57.5 ttt180 -79.15 -37.88 37.37 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.34 -1.094 . . . . 3.01 109.581 -179.955 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 336' ' ' GLU . . . . . . . . . . . . . 5.0 mt-10 -57.95 -60.81 3.14 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.348 -0.845 . . . . 2.28 109.719 -179.823 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 337' ' ' ARG . . . . . 0.511 ' CZ ' ' OD1' ' D' ' 352' ' ' ASP . 4.0 mtt180 -60.02 -28.53 67.81 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.188 -0.945 . . . . 2.93 109.641 -179.806 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 338' ' ' PHE . . . . . 0.783 ' HA ' HG21 ' B' ' 332' ' ' ILE . 59.4 t80 -54.42 -60.41 3.38 Favored 'General case' 0 N--CA 1.488 1.458 0 O-C-N 121.184 -0.948 . . . . 0.37 109.397 179.969 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 339' ' ' GLU . . . . . . . . . . . . . 5.7 mt-10 -51.31 -31.23 20.88 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.248 -0.907 . . . . 1.98 109.781 -179.88 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 340' ' ' MET . . . . . . . . . . . . . 27.5 ttp -64.19 -52.64 57.92 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.221 -0.924 . . . . 0.32 109.982 -179.711 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 341' ' ' PHE . . . . . . . . . . . . . 39.1 m-85 -61.72 -47.87 83.3 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.103 -0.998 . . . . 0.18 109.78 -179.694 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 342' ' ' ARG . . . . . . . . . . . . . 9.8 ttt180 -49.62 -40.16 38.28 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.294 -0.879 . . . . 2.42 109.828 -179.846 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 343' ' ' GLU . . . . . . . . . . . . . 4.2 tt0 -59.36 -49.64 77.04 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.227 -0.92 . . . . 2.35 109.742 -179.745 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 344' ' ' LEU . . . . . 0.548 HD22 ' CD2' ' A' ' 344' ' ' LEU . 45.4 mt -61.88 -31.56 71.85 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.234 -0.916 . . . . 0.18 109.597 -179.788 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 345' ' ' ASN . . . . . . . . . . . . . 16.7 t-20 -57.64 -58.0 10.26 Favored 'General case' 0 N--CA 1.489 1.483 0 O-C-N 121.235 -0.916 . . . . 1.09 109.571 179.956 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 346' ' ' GLU . . . . . . . . . . . . . 36.8 tt0 -60.84 -29.35 69.45 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.354 -0.841 . . . . 1.66 109.658 -179.901 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 347' ' ' ALA . . . . . 0.4 ' HB1' ' HB1' ' A' ' 347' ' ' ALA . . . -59.29 -58.41 8.76 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.24 -0.912 . . . . 0.17 109.891 -179.774 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 348' ' ' LEU . . . . . 0.609 HD22 ' N ' ' B' ' 348' ' ' LEU . 4.1 mm? -61.5 -38.68 88.22 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.19 -0.944 . . . . 0.29 109.737 -179.737 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 349' ' ' GLU . . . . . . . . . . . . . 9.3 mt-10 -57.86 -38.42 75.67 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.247 -0.908 . . . . 1.95 110.074 -179.539 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 350' ' ' LEU . . . . . 0.664 HD13 HD22 ' A' ' 350' ' ' LEU . 6.1 tt -62.69 -48.82 77.64 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.197 -0.94 . . . . 0.45 109.659 -179.705 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 351' ' ' LYS . . . . . . . . . . . . . 5.8 tttt -59.26 -36.92 76.38 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.115 -0.99 . . . . 1.38 109.525 -179.847 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 352' ' ' ASP . . . . . . . . . . . . . 55.4 m-20 -56.33 -42.34 77.53 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.26 -0.9 . . . . 1.16 109.668 -179.96 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 353' ' ' ALA . . . . . . . . . . . . . . . -67.6 -23.22 65.36 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.217 -0.927 . . . . 0.61 109.868 -179.504 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 354' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.491 1.598 0 O-C-N 121.194 -0.941 . . . . 1.45 109.812 -179.86 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 326' ' ' GLU . . . . . . . . . . . . . 3.2 mm-40 . . . . . 0 N--CA 1.489 1.517 0 N-CA-C 109.47 -0.567 . . . . 2.17 109.47 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' C' C ' 327' ' ' TYR . . . . . 0.554 ' CE1' ' CG ' ' A' ' 333' ' ' ARG . 49.3 m-85 -149.05 101.71 3.18 Favored 'General case' 0 N--CA 1.488 1.46 0 O-C-N 121.333 -0.854 . . . . 0.48 109.505 179.891 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' C' C ' 328' ' ' PHE . . . . . . . . . . . . . 63.9 m-85 -103.15 -165.85 1.21 Allowed 'General case' 0 N--CA 1.488 1.472 0 O-C-N 121.381 -0.824 . . . . 0.33 109.129 179.985 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 329' ' ' THR . . . . . 0.478 ' HA ' ' O ' ' A' ' 330' ' ' LEU . 43.1 p -150.71 167.04 28.57 Favored 'General case' 0 N--CA 1.488 1.468 0 O-C-N 121.204 -0.935 . . . . 0.23 109.353 -179.952 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' C' C ' 330' ' ' LEU . . . . . 0.455 ' O ' ' HA ' ' A' ' 329' ' ' THR . 17.7 tp -150.67 125.94 10.03 Favored 'General case' 0 C--N 1.303 -1.451 0 O-C-N 121.184 -0.948 . . . . 0.28 109.939 -179.585 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' C' C ' 331' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -87.0 110.29 19.96 Favored 'General case' 0 N--CA 1.488 1.433 0 N-CA-C 108.554 -0.906 . . . . 1.48 108.554 179.236 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' C' C ' 332' ' ' ILE . . . . . 0.482 HG21 ' HA ' ' C' ' 338' ' ' PHE . 51.5 mt -100.87 111.44 30.56 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.521 0 O-C-N 121.232 -0.917 . . . . 0.24 109.622 -179.382 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' C' C ' 333' ' ' ARG . . . . . 0.476 ' NH1' ' HG2' ' C' ' 333' ' ' ARG . 0.0 OUTLIER -72.71 153.07 41.34 Favored 'General case' 0 C--N 1.304 -1.374 0 O-C-N 121.395 -0.815 . . . . 2.74 109.421 179.848 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' C' C ' 334' ' ' GLY . . . . . . . . . . . . . . . 73.97 118.67 0.08 OUTLIER Glycine 0 N--CA 1.491 2.323 0 N-CA-C 109.464 -1.455 . . . . 0.35 109.464 -179.933 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 335' ' ' ARG . . . . . 0.564 ' HG3' ' CE2' ' A' ' 328' ' ' PHE . 4.6 ttt-85 -69.76 -30.39 67.96 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.251 -1.147 . . . . 2.53 109.611 -179.826 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' C' C ' 336' ' ' GLU . . . . . . . . . . . . . 4.2 tt0 -57.89 -62.92 1.46 Allowed 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.134 -0.979 . . . . 2.62 109.552 -179.828 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 337' ' ' ARG . . . . . 0.403 ' CZ ' ' OD1' ' A' ' 352' ' ' ASP . 2.3 mpt_? -60.5 -27.1 67.32 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.217 -0.927 . . . . 2.81 109.588 -179.918 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' C' C ' 338' ' ' PHE . . . . . 0.482 ' HA ' HG21 ' C' ' 332' ' ' ILE . 61.2 t80 -54.58 -59.33 4.84 Favored 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.259 -0.901 . . . . 0.4 109.536 -179.903 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' C' C ' 339' ' ' GLU . . . . . . . . . . . . . 1.5 mt-10 -52.56 -34.13 48.91 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.326 -0.859 . . . . 2.05 109.884 -179.917 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 340' ' ' MET . . . . . . . . . . . . . 38.5 ttp -62.85 -49.98 72.76 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.194 -0.942 . . . . 0.32 109.901 -179.558 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 341' ' ' PHE . . . . . 0.403 ' CD2' HD13 ' C' ' 332' ' ' ILE . 41.6 m-85 -62.59 -41.81 99.19 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.191 -0.943 . . . . 0.18 109.724 -179.826 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' C' C ' 342' ' ' ARG . . . . . 0.449 ' NH1' ' HG3' ' C' ' 342' ' ' ARG . 0.0 OUTLIER -50.94 -43.68 60.23 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.323 -0.861 . . . . 2.91 109.922 -179.83 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' C' C ' 343' ' ' GLU . . . . . . . . . . . . . 3.3 tp10 -58.53 -45.72 88.27 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.166 -0.959 . . . . 2.14 109.725 -179.599 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 344' ' ' LEU . . . . . 0.465 HD22 ' CD2' ' D' ' 344' ' ' LEU . 81.0 mt -61.76 -37.63 85.01 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.18 -0.95 . . . . 0.22 109.499 -179.809 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' C' C ' 345' ' ' ASN . . . . . 0.436 ' O ' ' HG3' ' C' ' 349' ' ' GLU . 16.9 t-20 -58.74 -54.18 50.01 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.232 -0.917 . . . . 1.08 109.567 179.929 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' C' C ' 346' ' ' GLU . . . . . . . . . . . . . 1.3 tm-20 -60.3 -32.12 70.91 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.283 -0.886 . . . . 2.21 109.792 -179.661 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 347' ' ' ALA . . . . . 0.703 ' HB1' ' HB1' ' D' ' 347' ' ' ALA . . . -59.44 -60.55 3.68 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.142 -0.974 . . . . 0.18 109.828 -179.856 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' C' C ' 348' ' ' LEU . . . . . 0.637 HD22 ' N ' ' C' ' 348' ' ' LEU . 4.0 mm? -61.05 -31.57 71.22 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.2 -0.938 . . . . 0.32 109.453 -179.836 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' C' C ' 349' ' ' GLU . . . . . 0.436 ' HG3' ' O ' ' C' ' 345' ' ' ASN . 7.6 mt-10 -59.46 -48.4 81.8 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.247 -0.908 . . . . 2.19 110.013 -179.644 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' C' C ' 350' ' ' LEU . . . . . 0.66 HD13 HD22 ' D' ' 350' ' ' LEU . 6.6 tt -62.83 -38.56 91.25 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.069 -1.019 . . . . 0.46 109.73 -179.623 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' C' C ' 351' ' ' LYS . . . . . . . . . . . . . 20.8 ttmt -58.08 -46.7 85.04 Favored 'General case' 0 N--CA 1.487 1.42 0 O-C-N 121.138 -0.976 . . . . 1.35 109.204 179.921 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 352' ' ' ASP . . . . . . . . . . . . . 3.4 m-20 -56.71 -41.21 77.01 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.261 -0.899 . . . . 1.19 109.576 179.863 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 353' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 1.646 0 O-C-N 121.29 -0.881 . . . . 0.57 109.805 -179.647 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' D' D ' 326' ' ' GLU . . . . . . . . . . . . . 4.2 mm-40 . . . . . 0 N--CA 1.489 1.509 0 N-CA-C 109.214 -0.662 . . . . 2.13 109.214 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' D' D ' 327' ' ' TYR . . . . . 0.527 ' CE2' ' CG ' ' B' ' 333' ' ' ARG . 42.1 m-85 -147.38 96.04 2.64 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.299 -0.875 . . . . 0.47 109.396 -179.967 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' D' D ' 328' ' ' PHE . . . . . . . . . . . . . 58.1 m-85 -103.27 -160.35 0.77 Allowed 'General case' 0 N--CA 1.489 1.48 0 O-C-N 121.395 -0.816 . . . . 0.3 109.639 -179.842 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' D' D ' 329' ' ' THR . . . . . . . . . . . . . 35.7 p -154.1 169.24 24.02 Favored 'General case' 0 N--CA 1.489 1.477 0 O-C-N 121.355 -0.841 . . . . 0.22 108.95 179.869 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' D' D ' 330' ' ' LEU . . . . . . . . . . . . . 24.9 tp -151.4 133.09 14.87 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.206 -0.934 . . . . 0.28 109.796 -179.692 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' D' D ' 331' ' ' GLN . . . . . . . . . . . . . 7.1 tp-100 -85.82 115.96 23.78 Favored 'General case' 0 N--CA 1.489 1.494 0 O-C-N 121.325 -0.859 . . . . 0.93 109.037 179.646 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' D' D ' 332' ' ' ILE . . . . . 0.78 HG21 ' HA ' ' D' ' 338' ' ' PHE . 75.3 mt -103.35 104.42 16.62 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.558 0 O-C-N 121.166 -0.959 . . . . 0.25 109.8 -179.603 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' D' D ' 333' ' ' ARG . . . . . 0.606 ' HG2' ' CE2' ' B' ' 327' ' ' TYR . 2.0 mpt_? -72.73 138.82 46.78 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.294 -0.879 . . . . 2.93 109.36 179.738 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' D' D ' 334' ' ' GLY . . . . . . . . . . . . . . . 91.31 129.9 4.61 Favored Glycine 0 N--CA 1.491 2.313 0 N-CA-C 109.645 -1.382 . . . . 0.41 109.645 179.838 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' D' D ' 335' ' ' ARG . . . . . 0.415 ' O ' ' HB3' ' D' ' 338' ' ' PHE . 57.6 ttt180 -79.12 -37.9 37.48 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.36 -1.082 . . . . 3.03 109.57 -179.957 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' D' D ' 336' ' ' GLU . . . . . . . . . . . . . 5.1 mt-10 -57.9 -60.94 2.95 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.292 -0.88 . . . . 2.26 109.774 -179.86 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' D' D ' 337' ' ' ARG . . . . . . . . . . . . . 4.0 mtt180 -59.96 -28.43 67.64 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.15 -0.968 . . . . 2.92 109.693 -179.908 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' D' D ' 338' ' ' PHE . . . . . 0.78 ' HA ' HG21 ' D' ' 332' ' ' ILE . 59.5 t80 -54.56 -60.19 3.69 Favored 'General case' 0 N--CA 1.488 1.464 0 O-C-N 121.244 -0.91 . . . . 0.37 109.486 179.991 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' D' D ' 339' ' ' GLU . . . . . . . . . . . . . 5.7 mt-10 -51.35 -31.27 21.46 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.191 -0.943 . . . . 1.99 109.76 -179.951 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' D' D ' 340' ' ' MET . . . . . . . . . . . . . 27.4 ttp -64.18 -52.69 57.72 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.286 -0.884 . . . . 0.31 109.964 -179.715 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' D' D ' 341' ' ' PHE . . . . . . . . . . . . . 38.9 m-85 -61.83 -47.72 83.8 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.138 -0.976 . . . . 0.18 109.794 -179.638 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' D' D ' 342' ' ' ARG . . . . . . . . . . . . . 9.8 ttt180 -49.7 -40.12 39.23 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.21 -0.931 . . . . 2.41 109.85 -179.864 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' D' D ' 343' ' ' GLU . . . . . . . . . . . . . 4.2 tt0 -59.32 -49.81 76.41 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.147 -0.971 . . . . 2.35 109.742 -179.76 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' D' D ' 344' ' ' LEU . . . . . 0.465 ' CD2' HD22 ' C' ' 344' ' ' LEU . 45.2 mt -61.85 -31.34 71.59 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.276 -0.89 . . . . 0.19 109.616 -179.787 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' D' D ' 345' ' ' ASN . . . . . . . . . . . . . 16.3 t-20 -57.88 -57.81 11.14 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.279 -0.888 . . . . 1.09 109.526 -179.978 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' D' D ' 346' ' ' GLU . . . . . . . . . . . . . 36.6 tt0 -61.03 -29.2 69.58 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.43 -0.794 . . . . 1.69 109.682 -179.878 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' D' D ' 347' ' ' ALA . . . . . 0.703 ' HB1' ' HB1' ' C' ' 347' ' ' ALA . . . -59.36 -58.35 9.0 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.239 -0.913 . . . . 0.18 109.827 -179.827 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' D' D ' 348' ' ' LEU . . . . . 0.608 HD22 ' N ' ' D' ' 348' ' ' LEU . 4.1 mm? -61.65 -38.55 88.13 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.271 -0.893 . . . . 0.31 109.772 -179.656 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' D' D ' 349' ' ' GLU . . . . . . . . . . . . . 9.3 mt-10 -58.02 -38.33 76.0 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.228 -0.92 . . . . 1.95 110.013 -179.588 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' D' D ' 350' ' ' LEU . . . . . 0.66 HD22 HD13 ' C' ' 350' ' ' LEU . 6.1 tt -62.7 -48.83 77.57 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.11 -0.994 . . . . 0.43 109.697 -179.757 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' D' D ' 351' ' ' LYS . . . . . . . . . . . . . 5.9 tttt -59.21 -36.86 76.14 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.14 -0.975 . . . . 1.4 109.6 -179.895 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' D' D ' 352' ' ' ASP . . . . . 0.511 ' OD1' ' CZ ' ' B' ' 337' ' ' ARG . 55.5 m-20 -56.47 -42.33 78.05 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.332 -0.855 . . . . 1.17 109.664 -179.972 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' D' D ' 353' ' ' ALA . . . . . . . . . . . . . . . -67.59 -23.07 65.35 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.219 -0.925 . . . . 0.59 109.913 -179.598 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' D' D ' 354' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.491 1.59 0 O-C-N 121.048 -1.033 . . . . 1.44 109.762 -179.844 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 326' ' ' GLU . . . . . 0.427 ' O ' ' CD1' ' A' ' 327' ' ' TYR . 70.0 mm-40 . . . . . 0 N--CA 1.49 1.566 0 CA-C-O 121.388 0.614 . . . . 2.13 109.579 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 327' ' ' TYR . . . . . 0.604 ' CE2' ' HG2' ' C' ' 333' ' ' ARG . 46.6 m-85 -149.54 110.15 4.26 Favored 'General case' 0 N--CA 1.487 1.42 0 O-C-N 121.484 -0.76 . . . . 0.48 109.0 179.573 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 328' ' ' PHE . . . . . 0.424 ' CE1' ' HB3' ' A' ' 326' ' ' GLU . 54.8 m-85 -112.22 -167.99 1.26 Allowed 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.185 -0.947 . . . . 0.31 109.602 -179.696 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 329' ' ' THR . . . . . . . . . . . . . 53.3 p -152.06 164.81 36.46 Favored 'General case' 0 N--CA 1.488 1.457 0 O-C-N 121.416 -0.802 . . . . 0.22 108.973 -179.878 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 330' ' ' LEU . . . . . 0.435 ' O ' ' HA ' ' C' ' 329' ' ' THR . 19.1 tp -151.2 131.22 13.41 Favored 'General case' 0 C--N 1.301 -1.507 0 O-C-N 121.127 -0.983 . . . . 0.28 109.769 -179.606 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 331' ' ' GLN . . . . . . . . . . . . . 1.4 tt0 -85.37 116.49 23.73 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.223 -0.923 . . . . 0.91 108.989 179.524 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 332' ' ' ILE . . . . . 0.797 HG21 ' HA ' ' A' ' 338' ' ' PHE . 86.3 mt -101.52 103.44 14.91 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.53 0 O-C-N 121.281 -0.887 . . . . 0.26 109.742 -179.619 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 333' ' ' ARG . . . . . 0.601 ' HG3' ' CD1' ' C' ' 327' ' ' TYR . 3.7 mpt_? -70.27 149.42 47.44 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.238 -0.914 . . . . 2.92 109.199 179.632 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 334' ' ' GLY . . . . . . . . . . . . . . . 78.29 125.37 0.37 Allowed Glycine 0 N--CA 1.49 2.294 0 N-CA-C 109.6 -1.4 . . . . 0.4 109.6 -179.799 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 335' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -74.62 -36.02 62.93 Favored 'General case' 0 N--CA 1.489 1.494 0 O-C-N 121.36 -1.082 . . . . 3.01 109.546 179.956 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 336' ' ' GLU . . . . . . . . . . . . . 27.8 mt-10 -57.77 -58.95 6.1 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.149 -0.969 . . . . 2.29 109.739 -179.562 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 337' ' ' ARG . . . . . 0.644 ' NH1' HD12 ' C' ' 348' ' ' LEU . 15.8 mmt180 -60.77 -28.92 69.1 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.222 -0.924 . . . . 2.93 110.178 -179.573 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 338' ' ' PHE . . . . . 0.797 ' HA ' HG21 ' A' ' 332' ' ' ILE . 41.8 t80 -57.31 -58.88 6.33 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.087 -1.008 . . . . 0.38 110.126 -179.655 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 339' ' ' GLU . . . . . . . . . . . . . 3.5 mt-10 -52.07 -33.91 41.35 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.132 -0.98 . . . . 1.97 110.165 -179.399 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 340' ' ' MET . . . . . . . . . . . . . 32.8 ttp -63.72 -49.94 71.1 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.21 -0.931 . . . . 0.31 109.965 -179.577 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 341' ' ' PHE . . . . . 0.519 ' CZ ' ' HA ' ' C' ' 345' ' ' ASN . 35.6 m-85 -62.14 -44.1 97.37 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.117 -0.99 . . . . 0.18 110.038 -179.646 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 342' ' ' ARG . . . . . 0.479 ' HG2' ' NH1' ' A' ' 342' ' ' ARG . 0.1 OUTLIER -48.98 -45.48 42.29 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.236 -0.915 . . . . 2.42 110.118 -179.537 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 343' ' ' GLU . . . . . . . . . . . . . 5.4 tt0 -57.83 -47.9 81.3 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.28 -0.888 . . . . 2.35 109.977 -179.606 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 344' ' ' LEU . . . . . 0.413 ' O ' ' HB3' ' A' ' 347' ' ' ALA . 50.0 mt -61.36 -32.05 71.95 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.055 -1.028 . . . . 0.18 109.734 -179.715 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 345' ' ' ASN . . . . . 0.464 ' HA ' ' CZ ' ' C' ' 341' ' ' PHE . 17.0 t-20 -56.81 -60.73 3.13 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.326 -0.858 . . . . 1.09 109.752 -179.783 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 346' ' ' GLU . . . . . . . . . . . . . 4.3 tt0 -61.19 -24.41 66.3 Favored 'General case' 0 N--CA 1.488 1.438 0 O-C-N 121.269 -0.895 . . . . 1.65 109.785 -179.801 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 347' ' ' ALA . . . . . 0.496 ' HB1' ' HB1' ' B' ' 347' ' ' ALA . . . -60.34 -61.76 2.37 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.213 -0.929 . . . . 0.18 110.097 -179.728 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 348' ' ' LEU . . . . . 0.806 HD12 ' NH1' ' C' ' 337' ' ' ARG . 3.5 mm? -61.52 -47.43 85.63 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.165 -0.96 . . . . 0.3 109.857 -179.455 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 349' ' ' GLU . . . . . . . . . . . . . 3.3 mm-40 -56.21 -30.6 62.53 Favored 'General case' 0 C--N 1.301 -1.539 0 O-C-N 121.17 -0.956 . . . . 1.94 109.87 -179.307 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 350' ' ' LEU . . . . . 0.803 ' O ' HD23 ' A' ' 350' ' ' LEU . 4.0 tt -65.1 -45.1 86.58 Favored 'General case' 0 N--CA 1.488 1.463 0 O-C-N 121.217 -0.927 . . . . 0.46 109.621 -179.743 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 351' ' ' LYS . . . . . . . . . . . . . 28.5 tttt -59.94 -50.72 72.64 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.263 -0.898 . . . . 1.4 109.587 -179.836 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 352' ' ' ASP . . . . . . . . . . . . . 66.0 m-20 -55.8 -37.56 68.77 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.153 -0.967 . . . . 1.16 109.689 -179.848 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 353' ' ' ALA . . . . . . . . . . . . . . . -65.36 -35.65 81.6 Favored 'General case' 0 N--CA 1.488 1.467 0 O-C-N 121.269 -0.894 . . . . 0.63 109.492 -179.834 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 354' ' ' GLN . . . . . . . . . . . . . 3.7 tt0 . . . . . 0 N--CA 1.489 1.516 0 O-C-N 121.287 -0.883 . . . . 1.47 109.353 179.839 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' B' B ' 326' ' ' GLU . . . . . 0.425 ' HB3' ' CE1' ' B' ' 328' ' ' PHE . 70.8 mm-40 . . . . . 0 N--CA 1.491 1.582 0 CA-C-O 121.308 0.575 . . . . 2.13 109.535 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 327' ' ' TYR . . . . . 0.59 ' CE2' ' HG3' ' D' ' 333' ' ' ARG . 45.8 m-85 -150.15 109.46 3.96 Favored 'General case' 0 N--CA 1.487 1.421 0 O-C-N 121.274 -0.891 . . . . 0.48 108.851 179.769 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 328' ' ' PHE . . . . . 0.442 ' HB2' ' CD1' ' D' ' 338' ' ' PHE . 53.0 m-85 -111.84 -167.44 1.18 Allowed 'General case' 0 N--CA 1.488 1.473 0 O-C-N 121.326 -0.859 . . . . 0.32 109.666 -179.635 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 329' ' ' THR . . . . . . . . . . . . . 59.1 p -152.28 163.64 39.04 Favored 'General case' 0 C--N 1.302 -1.477 0 O-C-N 121.389 -0.82 . . . . 0.23 109.144 -179.889 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 330' ' ' LEU . . . . . . . . . . . . . 17.3 tp -150.12 131.68 14.84 Favored 'General case' 0 N--CA 1.488 1.46 0 O-C-N 121.166 -0.958 . . . . 0.28 109.743 -179.84 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 331' ' ' GLN . . . . . . . . . . . . . 1.4 tt0 -85.77 116.78 24.24 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.373 -0.829 . . . . 0.91 108.906 179.587 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 332' ' ' ILE . . . . . 0.79 HG21 ' HA ' ' B' ' 338' ' ' PHE . 85.1 mt -101.97 104.04 15.83 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.489 0 O-C-N 121.207 -0.933 . . . . 0.24 109.513 -179.573 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 333' ' ' ARG . . . . . 0.518 ' HG3' ' CE2' ' D' ' 327' ' ' TYR . 4.1 mpt_? -71.21 150.48 45.27 Favored 'General case' 0 C--N 1.305 -1.365 0 O-C-N 121.255 -0.903 . . . . 2.93 109.011 179.746 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 334' ' ' GLY . . . . . . . . . . . . . . . 77.58 126.17 0.33 Allowed Glycine 0 N--CA 1.489 2.175 0 N-CA-C 109.388 -1.485 . . . . 0.4 109.388 -179.986 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 335' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -75.22 -36.91 61.32 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.413 -1.051 . . . . 3.01 109.608 -179.727 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 336' ' ' GLU . . . . . . . . . . . . . 38.7 mt-10 -56.96 -57.49 12.29 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.39 -0.819 . . . . 2.28 110.069 -179.593 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 337' ' ' ARG . . . . . . . . . . . . . 17.0 mmt180 -62.38 -29.24 70.34 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.229 -0.919 . . . . 2.93 109.877 -179.635 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 338' ' ' PHE . . . . . 0.79 ' HA ' HG21 ' B' ' 332' ' ' ILE . 44.5 t80 -56.57 -59.94 4.27 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.26 -0.9 . . . . 0.37 110.121 -179.692 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 339' ' ' GLU . . . . . . . . . . . . . 4.2 mt-10 -51.98 -33.44 38.0 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.238 -0.914 . . . . 1.98 110.102 -179.347 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 340' ' ' MET . . . . . . . . . . . . . 31.8 ttp -63.89 -49.68 71.74 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.066 -1.021 . . . . 0.32 109.822 -179.578 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 341' ' ' PHE . . . . . . . . . . . . . 35.4 m-85 -62.31 -44.28 96.87 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.163 -0.961 . . . . 0.18 110.04 -179.54 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 342' ' ' ARG . . . . . 0.474 ' NH1' ' HG2' ' B' ' 342' ' ' ARG . 0.1 OUTLIER -49.33 -44.62 44.58 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.283 -0.886 . . . . 2.42 110.096 -179.576 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' B' B ' 343' ' ' GLU . . . . . . . . . . . . . 4.6 tt0 -58.18 -47.27 83.92 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.196 -0.94 . . . . 2.35 109.914 -179.393 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 344' ' ' LEU . . . . . . . . . . . . . 50.3 mt -62.11 -31.68 72.16 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.309 -0.87 . . . . 0.18 109.954 -179.825 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 345' ' ' ASN . . . . . 0.49 ' HA ' ' CZ ' ' D' ' 341' ' ' PHE . 17.0 t-20 -57.43 -60.48 3.58 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.232 -0.918 . . . . 1.09 109.849 -179.683 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 346' ' ' GLU . . . . . . . . . . . . . 4.0 tt0 -61.1 -24.61 66.37 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.304 -0.872 . . . . 1.66 109.791 -179.655 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 347' ' ' ALA . . . . . 0.496 ' HB1' ' HB1' ' A' ' 347' ' ' ALA . . . -60.18 -61.86 2.29 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.147 -0.971 . . . . 0.17 110.016 -179.7 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 348' ' ' LEU . . . . . 0.589 HD22 ' N ' ' B' ' 348' ' ' LEU . 3.5 mm? -61.3 -47.73 84.61 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.234 -0.916 . . . . 0.29 109.917 -179.418 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 349' ' ' GLU . . . . . . . . . . . . . 3.6 mm-40 -56.25 -30.3 62.21 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.174 -0.954 . . . . 1.95 109.825 -179.383 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 350' ' ' LEU . . . . . 0.756 ' O ' HD23 ' B' ' 350' ' ' LEU . 4.2 tt -65.17 -45.95 82.79 Favored 'General case' 0 N--CA 1.489 1.492 0 O-C-N 121.116 -0.99 . . . . 0.45 109.328 179.912 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 351' ' ' LYS . . . . . . . . . . . . . 29.3 tttt -59.33 -51.5 69.69 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.233 -0.917 . . . . 1.38 109.646 -179.898 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 352' ' ' ASP . . . . . . . . . . . . . 67.3 m-20 -55.35 -37.62 67.72 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.236 -0.915 . . . . 1.16 109.748 -179.757 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 353' ' ' ALA . . . . . . . . . . . . . . . -65.68 -34.94 79.37 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.377 -0.827 . . . . 0.61 109.403 -179.581 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 354' ' ' GLN . . . . . . . . . . . . . 4.1 tt0 . . . . . 0 N--CA 1.487 1.421 0 O-C-N 121.201 -0.937 . . . . 1.45 109.225 179.775 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' C' C ' 326' ' ' GLU . . . . . 0.424 ' HB3' ' CE1' ' C' ' 328' ' ' PHE . 3.0 mm-40 . . . . . 0 N--CA 1.487 1.389 0 N-CA-C 108.972 -0.751 . . . . 2.17 108.972 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 327' ' ' TYR . . . . . 0.601 ' CD1' ' HG3' ' A' ' 333' ' ' ARG . 42.2 m-85 -146.82 100.54 3.33 Favored 'General case' 0 C--N 1.302 -1.5 0 O-C-N 121.238 -0.914 . . . . 0.48 108.973 -179.885 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' C' C ' 328' ' ' PHE . . . . . 0.424 ' CE1' ' HB3' ' C' ' 326' ' ' GLU . 87.6 m-85 -103.2 -166.41 1.27 Allowed 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.278 -0.889 . . . . 0.33 109.711 -179.449 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' C' C ' 329' ' ' THR . . . . . 0.435 ' HA ' ' O ' ' A' ' 330' ' ' LEU . 24.7 p -152.97 161.44 42.53 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.413 -0.804 . . . . 0.23 109.014 -179.865 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' C' C ' 330' ' ' LEU . . . . . . . . . . . . . 17.2 tp -149.95 133.42 16.57 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.158 -0.963 . . . . 0.28 109.508 -179.525 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 331' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -87.72 116.22 25.7 Favored 'General case' 0 N--CA 1.488 1.47 0 O-C-N 121.352 -0.843 . . . . 1.48 109.36 179.802 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' C' C ' 332' ' ' ILE . . . . . 0.806 HG21 ' HA ' ' C' ' 338' ' ' PHE . 15.1 mt -104.24 104.76 17.3 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.68 0 O-C-N 121.247 -0.908 . . . . 0.24 109.607 179.961 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' C' C ' 333' ' ' ARG . . . . . 0.604 ' HG2' ' CE2' ' A' ' 327' ' ' TYR . 0.7 OUTLIER -73.04 143.38 47.52 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.392 -0.817 . . . . 2.74 109.423 179.582 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' C' C ' 334' ' ' GLY . . . . . . . . . . . . . . . 80.63 131.61 1.06 Allowed Glycine 0 N--CA 1.495 2.623 0 N-CA-C 109.722 -1.351 . . . . 0.35 109.722 179.848 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 335' ' ' ARG . . . . . 0.522 ' HG2' ' NH1' ' C' ' 335' ' ' ARG . 0.0 OUTLIER -79.48 -32.75 42.58 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.241 -1.152 . . . . 2.53 109.725 179.975 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' C' C ' 336' ' ' GLU . . . . . . . . . . . . . 49.2 mt-10 -55.55 -61.97 2.0 Allowed 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.238 -0.914 . . . . 2.62 109.208 -179.737 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 337' ' ' ARG . . . . . 0.806 ' NH1' HD12 ' A' ' 348' ' ' LEU . 30.5 mmt180 -61.98 -28.56 69.65 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.192 -0.942 . . . . 2.81 109.493 179.737 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' C' C ' 338' ' ' PHE . . . . . 0.806 ' HA ' HG21 ' C' ' 332' ' ' ILE . 86.4 t80 -54.94 -61.22 2.46 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.361 -0.837 . . . . 0.4 110.135 -179.552 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' C' C ' 339' ' ' GLU . . . . . . . . . . . . . 50.1 mt-10 -51.2 -34.2 30.86 Favored 'General case' 0 N--CA 1.495 1.787 0 O-C-N 121.257 -0.902 . . . . 2.05 109.777 -179.836 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 340' ' ' MET . . . . . . . . . . . . . 33.0 ttp -62.66 -50.77 69.89 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.316 -0.865 . . . . 0.32 109.791 -179.492 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 341' ' ' PHE . . . . . 0.464 ' CZ ' ' HA ' ' A' ' 345' ' ' ASN . 50.7 m-85 -61.11 -42.52 98.67 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.025 -1.047 . . . . 0.18 109.89 -179.772 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' C' C ' 342' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -52.35 -46.11 65.99 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.025 -1.047 . . . . 2.91 109.782 179.984 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' C' C ' 343' ' ' GLU . . . . . . . . . . . . . 9.4 tt0 -57.12 -49.14 76.81 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.225 -0.922 . . . . 2.14 109.835 -179.528 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 344' ' ' LEU . . . . . . . . . . . . . 85.4 mt -62.25 -28.06 69.44 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.292 -0.88 . . . . 0.22 109.552 179.945 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 345' ' ' ASN . . . . . 0.519 ' HA ' ' CZ ' ' A' ' 341' ' ' PHE . 24.8 t-20 -58.74 -63.21 1.37 Allowed 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.425 -0.797 . . . . 1.08 110.303 -179.422 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' C' C ' 346' ' ' GLU . . . . . 0.44 ' O ' ' HB2' ' C' ' 350' ' ' LEU . 17.9 tt0 -61.66 -21.77 64.71 Favored 'General case' 0 C--N 1.301 -1.509 0 O-C-N 121.3 -0.875 . . . . 2.21 109.948 -179.444 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' C' C ' 347' ' ' ALA . . . . . 0.454 ' HB1' ' HB1' ' D' ' 347' ' ' ALA . . . -61.67 -58.43 8.08 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.004 -1.06 . . . . 0.18 110.214 -179.617 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' C' C ' 348' ' ' LEU . . . . . 0.644 HD12 ' NH1' ' A' ' 337' ' ' ARG . 3.4 mm? -63.47 -53.94 44.26 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.071 -1.018 . . . . 0.32 110.344 -179.214 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' C' C ' 349' ' ' GLU . . . . . . . . . . . . . 1.9 mp0 -57.22 -26.84 61.37 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.002 -1.061 . . . . 2.19 109.735 -179.472 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 350' ' ' LEU . . . . . 0.99 ' CD2' HD13 ' D' ' 350' ' ' LEU . 7.7 tt -65.12 -46.7 79.92 Favored 'General case' 0 N--CA 1.488 1.453 0 O-C-N 121.015 -1.053 . . . . 0.46 109.165 179.666 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' C' C ' 351' ' ' LYS . . . . . 0.414 ' N ' HD23 ' C' ' 350' ' ' LEU . 42.1 tttt -61.19 -43.63 98.58 Favored 'General case' 0 N--CA 1.488 1.438 0 O-C-N 121.385 -0.822 . . . . 1.35 109.473 179.924 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' C' C ' 352' ' ' ASP . . . . . . . . . . . . . 2.9 m-20 -56.28 -47.79 77.9 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.264 -0.898 . . . . 1.19 109.655 -179.95 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 353' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 1.499 0 O-C-N 121.189 -0.944 . . . . 0.57 109.424 -179.934 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' D' D ' 326' ' ' GLU . . . . . 0.433 ' O ' ' CD1' ' D' ' 327' ' ' TYR . 71.8 mm-40 . . . . . 0 N--CA 1.488 1.437 0 CA-C-O 121.514 0.673 . . . . 2.13 109.617 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' D' D ' 327' ' ' TYR . . . . . 0.518 ' CE2' ' HG3' ' B' ' 333' ' ' ARG . 47.4 m-85 -150.12 109.49 3.98 Favored 'General case' 0 C--N 1.302 -1.5 0 O-C-N 121.276 -0.89 . . . . 0.47 109.082 179.817 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' D' D ' 328' ' ' PHE . . . . . 0.417 ' CE1' ' HB3' ' D' ' 326' ' ' GLU . 52.0 m-85 -111.35 -166.71 1.1 Allowed 'General case' 0 N--CA 1.488 1.472 0 O-C-N 121.398 -0.814 . . . . 0.3 109.623 -179.674 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' D' D ' 329' ' ' THR . . . . . . . . . . . . . 66.4 p -152.56 163.33 39.8 Favored 'General case' 0 N--CA 1.488 1.425 0 O-C-N 121.34 -0.85 . . . . 0.22 108.843 179.991 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' D' D ' 330' ' ' LEU . . . . . . . . . . . . . 17.7 tp -149.85 131.35 14.8 Favored 'General case' 0 C--N 1.301 -1.507 0 O-C-N 121.158 -0.964 . . . . 0.28 109.655 -179.702 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' D' D ' 331' ' ' GLN . . . . . . . . . . . . . 1.5 tt0 -86.0 116.66 24.36 Favored 'General case' 0 C--N 1.303 -1.433 0 O-C-N 121.347 -0.846 . . . . 0.93 108.804 179.593 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' D' D ' 332' ' ' ILE . . . . . 0.774 HG21 ' HA ' ' D' ' 338' ' ' PHE . 80.4 mt -102.4 103.68 15.36 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.452 0 O-C-N 121.344 -0.848 . . . . 0.25 109.572 -179.545 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' D' D ' 333' ' ' ARG . . . . . 0.59 ' HG3' ' CE2' ' B' ' 327' ' ' TYR . 4.5 mpt_? -70.64 151.22 45.2 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.282 -0.886 . . . . 2.93 109.294 179.731 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' D' D ' 334' ' ' GLY . . . . . . . . . . . . . . . 77.07 126.77 0.29 Allowed Glycine 0 N--CA 1.489 2.199 0 N-CA-C 109.389 -1.485 . . . . 0.41 109.389 -179.953 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' D' D ' 335' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -75.68 -36.83 59.96 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.426 -1.043 . . . . 3.03 109.56 -179.815 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' D' D ' 336' ' ' GLU . . . . . . . . . . . . . 43.8 mt-10 -56.8 -58.77 6.67 Favored 'General case' 0 C--N 1.301 -1.505 0 O-C-N 121.281 -0.887 . . . . 2.26 109.778 -179.633 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' D' D ' 337' ' ' ARG . . . . . 0.475 ' CZ ' HD12 ' B' ' 348' ' ' LEU . 16.9 mmt180 -60.94 -28.94 69.33 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.195 -0.941 . . . . 2.92 110.196 -179.578 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' D' D ' 338' ' ' PHE . . . . . 0.774 ' HA ' HG21 ' D' ' 332' ' ' ILE . 40.5 t80 -57.22 -60.29 3.83 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.261 -0.899 . . . . 0.37 110.081 -179.45 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' D' D ' 339' ' ' GLU . . . . . . . . . . . . . 5.3 mt-10 -51.89 -33.0 34.8 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.328 -0.858 . . . . 1.99 110.218 -179.203 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' D' D ' 340' ' ' MET . . . . . . . . . . . . . 30.2 ttp -63.96 -49.94 70.6 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.065 -1.022 . . . . 0.31 109.755 -179.659 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' D' D ' 341' ' ' PHE . . . . . 0.49 ' CZ ' ' HA ' ' B' ' 345' ' ' ASN . 36.2 m-85 -61.97 -43.96 97.74 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.314 -0.866 . . . . 0.18 110.106 -179.721 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' D' D ' 342' ' ' ARG . . . . . 0.493 ' NH1' ' HG2' ' D' ' 342' ' ' ARG . 0.1 OUTLIER -49.32 -44.54 44.49 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.401 -0.812 . . . . 2.41 110.042 -179.54 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' D' D ' 343' ' ' GLU . . . . . . . . . . . . . 4.4 tt0 -58.49 -47.85 82.73 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.247 -0.908 . . . . 2.35 109.949 -179.448 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' D' D ' 344' ' ' LEU . . . . . . . . . . . . . 47.3 mt -61.58 -32.03 72.11 Favored 'General case' 0 N--CA 1.489 1.493 0 O-C-N 121.065 -1.022 . . . . 0.19 109.979 -179.66 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' D' D ' 345' ' ' ASN . . . . . . . . . . . . . 16.3 t-20 -57.09 -60.39 3.66 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.23 -0.919 . . . . 1.09 109.85 -179.538 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' D' D ' 346' ' ' GLU . . . . . . . . . . . . . 3.9 tt0 -61.09 -24.71 66.44 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.391 -0.818 . . . . 1.69 109.699 -179.549 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' D' D ' 347' ' ' ALA . . . . . 0.454 ' HB1' ' HB1' ' C' ' 347' ' ' ALA . . . -60.15 -61.7 2.41 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.162 -0.961 . . . . 0.18 110.058 -179.719 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' D' D ' 348' ' ' LEU . . . . . 0.606 HD22 ' N ' ' D' ' 348' ' ' LEU . 3.5 mm? -61.4 -47.72 84.52 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.144 -0.972 . . . . 0.31 110.219 -179.616 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' D' D ' 349' ' ' GLU . . . . . . . . . . . . . 3.5 mm-40 -56.71 -29.81 62.84 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.131 -0.981 . . . . 1.95 109.723 -179.327 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' D' D ' 350' ' ' LEU . . . . . 0.99 HD13 ' CD2' ' C' ' 350' ' ' LEU . 4.3 tt -64.95 -45.92 83.75 Favored 'General case' 0 N--CA 1.488 1.469 0 O-C-N 121.252 -0.905 . . . . 0.43 109.368 179.947 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' D' D ' 351' ' ' LYS . . . . . . . . . . . . . 29.3 tttt -60.04 -51.62 68.85 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.504 -0.748 . . . . 1.4 109.584 179.959 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' D' D ' 352' ' ' ASP . . . . . . . . . . . . . 69.3 m-20 -55.3 -38.04 68.13 Favored 'General case' 0 N--CA 1.489 1.48 0 O-C-N 121.343 -0.848 . . . . 1.17 109.382 -179.916 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' D' D ' 353' ' ' ALA . . . . . . . . . . . . . . . -65.17 -35.17 80.24 Favored 'General case' 0 N--CA 1.489 1.489 0 O-C-N 121.146 -0.971 . . . . 0.59 109.552 -179.998 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' D' D ' 354' ' ' GLN . . . . . . . . . . . . . 4.1 tt0 . . . . . 0 N--CA 1.488 1.457 0 O-C-N 121.151 -0.968 . . . . 1.44 109.557 -179.944 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 326' ' ' GLU . . . . . 0.453 ' HB3' ' CE2' ' A' ' 328' ' ' PHE . 43.5 mm-40 . . . . . 0 N--CA 1.49 1.568 0 N-CA-C 109.093 -0.706 . . . . 2.13 109.093 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 327' ' ' TYR . . . . . 0.611 ' CE1' ' HG2' ' C' ' 333' ' ' ARG . 41.2 m-85 -149.69 104.83 3.37 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.169 -0.957 . . . . 0.48 109.428 -179.894 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 328' ' ' PHE . . . . . 0.453 ' CE2' ' HB3' ' A' ' 326' ' ' GLU . 88.9 m-85 -111.46 -166.19 1.06 Allowed 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.419 -0.801 . . . . 0.31 109.576 -179.72 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 329' ' ' THR . . . . . 0.404 ' HA ' ' O ' ' C' ' 330' ' ' LEU . 33.5 p -153.61 160.92 42.56 Favored 'General case' 0 N--CA 1.488 1.435 0 O-C-N 121.451 -0.781 . . . . 0.22 108.923 -179.826 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 330' ' ' LEU . . . . . 0.59 HD11 HD22 ' C' ' 345' ' ' ASN . 25.9 tp -150.78 129.84 12.62 Favored 'General case' 0 N--CA 1.488 1.465 0 O-C-N 121.167 -0.958 . . . . 0.28 109.738 -179.611 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 331' ' ' GLN . . . . . . . . . . . . . 1.3 tt0 -88.82 113.81 24.77 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.22 -0.925 . . . . 0.91 109.189 179.732 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 332' ' ' ILE . . . . . 0.478 HD12 ' CD1' ' A' ' 338' ' ' PHE . 38.5 mt -103.41 111.76 34.35 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.505 0 O-C-N 121.08 -1.013 . . . . 0.26 109.911 -179.864 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 333' ' ' ARG . . . . . 0.594 ' CG ' ' CE1' ' C' ' 327' ' ' TYR . 0.0 OUTLIER -73.12 149.28 43.17 Favored 'General case' 0 C--N 1.302 -1.47 0 O-C-N 121.27 -0.894 . . . . 2.92 109.488 179.725 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 334' ' ' GLY . . . . . . . . . . . . . . . 84.77 132.57 2.53 Favored Glycine 0 N--CA 1.49 2.259 0 N-CA-C 109.514 -1.434 . . . . 0.4 109.514 -179.917 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 335' ' ' ARG . . . . . . . . . . . . . 36.0 ttt180 -78.92 -42.48 26.98 Favored 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.199 -1.177 . . . . 3.01 109.59 -179.83 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 336' ' ' GLU . . . . . . . . . . . . . 3.5 pt-20 -57.22 -53.08 62.14 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.232 -0.917 . . . . 2.29 110.115 -179.589 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 337' ' ' ARG . . . . . 0.604 ' CZ ' HD12 ' C' ' 348' ' ' LEU . 12.6 mmt180 -61.97 -34.81 76.82 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 120.97 -1.081 . . . . 2.93 109.809 -179.754 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 338' ' ' PHE . . . . . 0.478 ' CD1' HD12 ' A' ' 332' ' ' ILE . 80.8 t80 -55.32 -57.55 11.36 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.173 -0.955 . . . . 0.38 109.802 -179.711 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 339' ' ' GLU . . . . . . . . . . . . . 44.1 mt-10 -51.43 -36.09 42.29 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.224 -0.923 . . . . 1.97 110.425 -179.681 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 340' ' ' MET . . . . . . . . . . . . . 47.1 ttp -62.44 -48.57 79.08 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.119 -0.988 . . . . 0.31 109.808 -179.448 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 341' ' ' PHE . . . . . 0.434 ' CZ ' ' HA ' ' C' ' 345' ' ' ASN . 43.3 m-85 -62.55 -47.81 82.24 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.128 -0.982 . . . . 0.18 109.982 -179.614 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 342' ' ' ARG . . . . . . . . . . . . . 19.7 ttt180 -49.23 -42.32 40.18 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.316 -0.865 . . . . 2.42 110.21 -179.496 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 343' ' ' GLU . . . . . . . . . . . . . 4.2 tp10 -58.89 -49.05 79.24 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.143 -0.973 . . . . 2.35 109.921 -179.611 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 344' ' ' LEU . . . . . 0.569 HD22 ' CD2' ' B' ' 344' ' ' LEU . 37.1 mt -61.34 -31.56 71.43 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.217 -0.927 . . . . 0.18 109.76 -179.568 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 345' ' ' ASN . . . . . . . . . . . . . 62.4 t-20 -57.36 -54.3 48.4 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.295 -0.878 . . . . 1.09 109.698 -179.717 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 346' ' ' GLU . . . . . . . . . . . . . 6.0 tp10 -62.62 -27.74 69.41 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.331 -0.855 . . . . 1.65 110.097 -179.661 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 347' ' ' ALA . . . . . 0.891 ' HB1' ' HB1' ' B' ' 347' ' ' ALA . . . -61.85 -58.82 6.5 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.217 -0.927 . . . . 0.18 110.025 -179.609 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 348' ' ' LEU . . . . . 0.583 HD22 ' N ' ' A' ' 348' ' ' LEU . 3.8 mm? -60.72 -48.53 81.37 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.119 -0.988 . . . . 0.3 110.053 -179.304 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 349' ' ' GLU . . . . . 0.452 ' OE1' ' NH1' ' C' ' 333' ' ' ARG . 43.4 mt-10 -56.98 -33.13 66.79 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.155 -0.966 . . . . 1.94 109.533 -179.47 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 350' ' ' LEU . . . . . 0.817 ' O ' HD23 ' A' ' 350' ' ' LEU . 3.9 tt -63.96 -45.34 89.59 Favored 'General case' 0 C--N 1.302 -1.469 0 O-C-N 121.269 -0.895 . . . . 0.46 109.182 179.887 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 351' ' ' LYS . . . . . . . . . . . . . 9.5 tttp -60.5 -45.33 94.19 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.279 -0.888 . . . . 1.4 109.624 179.858 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 352' ' ' ASP . . . . . . . . . . . . . 7.0 m-20 -55.19 -37.56 67.23 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.233 -0.917 . . . . 1.16 109.633 -179.844 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 353' ' ' ALA . . . . . . . . . . . . . . . -66.08 -30.29 70.78 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.228 -0.92 . . . . 0.63 109.702 -179.795 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 354' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 N--CA 1.492 1.658 0 O-C-N 121.239 -0.913 . . . . 1.47 109.727 -179.954 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 326' ' ' GLU . . . . . 0.452 ' HB3' ' CE2' ' B' ' 328' ' ' PHE . 45.1 mm-40 . . . . . 0 N--CA 1.491 1.582 0 N-CA-C 109.205 -0.665 . . . . 2.13 109.205 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 327' ' ' TYR . . . . . 0.622 ' CE1' ' CG ' ' D' ' 333' ' ' ARG . 42.9 m-85 -149.16 106.36 3.61 Favored 'General case' 0 C--N 1.301 -1.516 0 O-C-N 121.177 -0.952 . . . . 0.48 109.199 179.974 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 328' ' ' PHE . . . . . 0.53 ' CE2' ' HA ' ' D' ' 335' ' ' ARG . 89.3 m-85 -113.57 -167.07 1.15 Allowed 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.331 -0.856 . . . . 0.32 109.458 -179.563 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 329' ' ' THR . . . . . . . . . . . . . 33.9 p -152.74 161.32 42.72 Favored 'General case' 0 N--CA 1.488 1.459 0 O-C-N 121.314 -0.866 . . . . 0.23 109.08 -179.912 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 330' ' ' LEU . . . . . 0.69 HD11 HD22 ' D' ' 345' ' ' ASN . 25.4 tp -151.19 129.09 11.69 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 120.966 -1.084 . . . . 0.28 109.779 -179.637 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 331' ' ' GLN . . . . . . . . . . . . . 1.3 tt0 -87.96 114.91 25.03 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.201 -0.937 . . . . 0.91 109.185 179.623 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 332' ' ' ILE . . . . . 0.474 HD12 ' CD1' ' B' ' 338' ' ' PHE . 39.1 mt -103.89 111.81 34.97 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.594 0 O-C-N 121.09 -1.006 . . . . 0.24 109.718 -179.871 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 333' ' ' ARG . . . . . 0.598 ' HG2' ' CE1' ' D' ' 327' ' ' TYR . 0.0 OUTLIER -73.34 149.21 42.77 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.231 -0.918 . . . . 2.93 109.587 179.755 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' B' B ' 334' ' ' GLY . . . . . . . . . . . . . . . 84.23 132.36 2.29 Favored Glycine 0 N--CA 1.492 2.391 0 N-CA-C 109.437 -1.465 . . . . 0.4 109.437 -179.834 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 335' ' ' ARG . . . . . 0.492 ' HA ' ' CE2' ' D' ' 328' ' ' PHE . 38.4 ttt180 -78.62 -41.96 30.15 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.332 -1.099 . . . . 3.01 109.737 -179.768 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 336' ' ' GLU . . . . . . . . . . . . . 3.7 pt-20 -57.16 -53.2 60.84 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.224 -0.922 . . . . 2.28 110.09 -179.677 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 337' ' ' ARG . . . . . . . . . . . . . 13.0 mmt180 -62.05 -34.9 77.12 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.044 -1.035 . . . . 2.93 109.929 -179.75 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 338' ' ' PHE . . . . . 0.474 ' CD1' HD12 ' B' ' 332' ' ' ILE . 80.3 t80 -55.61 -56.71 17.2 Favored 'General case' 0 C--N 1.303 -1.455 0 O-C-N 121.211 -0.931 . . . . 0.37 109.88 -179.618 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 339' ' ' GLU . . . . . . . . . . . . . 44.0 mt-10 -52.4 -35.2 51.13 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.222 -0.923 . . . . 1.98 110.337 -179.489 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 340' ' ' MET . . . . . . . . . . . . . 47.4 ttp -63.27 -48.27 78.85 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.135 -0.978 . . . . 0.32 109.755 -179.405 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 341' ' ' PHE . . . . . . . . . . . . . 43.9 m-85 -62.49 -47.94 81.74 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.204 -0.935 . . . . 0.18 109.848 -179.886 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 342' ' ' ARG . . . . . . . . . . . . . 17.2 ttt180 -49.24 -41.98 39.25 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.246 -0.909 . . . . 2.42 110.162 -179.55 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 343' ' ' GLU . . . . . . . . . . . . . 4.3 tp10 -59.16 -48.72 80.57 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.026 -1.046 . . . . 2.35 109.839 -179.53 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 344' ' ' LEU . . . . . 0.569 ' CD2' HD22 ' A' ' 344' ' ' LEU . 38.0 mt -61.76 -31.3 71.48 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.207 -0.933 . . . . 0.18 109.865 -179.609 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 345' ' ' ASN . . . . . 0.63 HD22 HD11 ' D' ' 330' ' ' LEU . 63.0 t-20 -57.64 -54.65 44.42 Favored 'General case' 0 C--N 1.302 -1.465 0 O-C-N 121.175 -0.953 . . . . 1.09 109.641 -179.714 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 346' ' ' GLU . . . . . . . . . . . . . 6.3 tp10 -62.0 -28.06 69.3 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.29 -0.881 . . . . 1.66 110.047 -179.659 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 347' ' ' ALA . . . . . 0.891 ' HB1' ' HB1' ' A' ' 347' ' ' ALA . . . -61.62 -58.32 8.55 Favored 'General case' 0 N--CA 1.495 1.795 0 O-C-N 121.138 -0.976 . . . . 0.17 110.238 -179.732 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 348' ' ' LEU . . . . . 0.569 HD22 ' N ' ' B' ' 348' ' ' LEU . 3.8 mm? -61.09 -49.54 76.88 Favored 'General case' 0 N--CA 1.493 1.692 0 O-C-N 121.287 -0.883 . . . . 0.29 109.869 -179.283 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 349' ' ' GLU . . . . . . . . . . . . . 44.0 mt-10 -56.1 -32.9 64.6 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.047 -1.033 . . . . 1.95 109.617 -179.624 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 350' ' ' LEU . . . . . 0.832 ' O ' HD23 ' B' ' 350' ' ' LEU . 4.0 tt -64.46 -44.38 91.26 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.245 -0.909 . . . . 0.45 109.399 179.929 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 351' ' ' LYS . . . . . . . . . . . . . 9.9 tttp -61.56 -45.32 94.65 Favored 'General case' 0 N--CA 1.488 1.45 0 O-C-N 121.337 -0.852 . . . . 1.38 109.619 179.872 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 352' ' ' ASP . . . . . . . . . . . . . 6.3 m-20 -55.23 -37.21 66.86 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.201 -0.937 . . . . 1.16 109.602 -179.995 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 353' ' ' ALA . . . . . . . . . . . . . . . -66.44 -30.97 71.44 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.164 -0.96 . . . . 0.61 109.548 -179.75 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 354' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 N--CA 1.489 1.505 0 O-C-N 121.109 -0.994 . . . . 1.45 109.552 -179.962 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 326' ' ' GLU . . . . . . . . . . . . . 3.1 mt-10 . . . . . 0 N--CA 1.492 1.652 0 CA-C-O 121.392 0.615 . . . . 2.17 109.635 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' C' C ' 327' ' ' TYR . . . . . 0.594 ' CE1' ' CG ' ' A' ' 333' ' ' ARG . 38.2 m-85 -149.14 111.45 4.69 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.412 -0.805 . . . . 0.48 109.512 179.823 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' C' C ' 328' ' ' PHE . . . . . 0.418 ' O ' HG23 ' C' ' 329' ' ' THR . 93.8 m-85 -113.47 -170.17 1.64 Allowed 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.2 -0.938 . . . . 0.33 109.578 -179.941 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' C' C ' 329' ' ' THR . . . . . 0.418 HG23 ' O ' ' C' ' 328' ' ' PHE . 6.3 p -153.28 161.78 42.01 Favored 'General case' 0 N--CA 1.491 1.609 0 N-CA-C 108.807 -0.812 . . . . 0.23 108.807 179.84 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' C' C ' 330' ' ' LEU . . . . . 0.404 ' O ' ' HA ' ' A' ' 329' ' ' THR . 15.7 tp -150.46 130.01 13.05 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.0 -1.063 . . . . 0.28 110.609 -179.027 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' C' C ' 331' ' ' GLN . . . . . . . . . . . . . 1.8 tp60 -89.32 116.0 27.21 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.394 -0.816 . . . . 1.48 108.938 178.885 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 332' ' ' ILE . . . . . . . . . . . . . 58.5 mt -103.7 115.04 44.91 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.695 0 O-C-N 121.011 -1.056 . . . . 0.24 109.984 -179.569 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 333' ' ' ARG . . . . . 0.611 ' HG2' ' CE1' ' A' ' 327' ' ' TYR . 0.7 OUTLIER -72.61 146.64 46.5 Favored 'General case' 0 N--CA 1.489 1.494 0 O-C-N 121.319 -0.863 . . . . 2.74 109.223 179.58 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' C' C ' 334' ' ' GLY . . . . . . . . . . . . . . . 84.43 127.79 1.6 Allowed Glycine 0 N--CA 1.49 2.272 0 N-CA-C 109.896 -1.282 . . . . 0.35 109.896 179.759 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 335' ' ' ARG . . . . . 0.418 ' O ' ' HB3' ' C' ' 338' ' ' PHE . 62.4 ttt180 -78.5 -32.97 48.4 Favored 'General case' 0 C--N 1.301 -1.501 0 O-C-N 121.331 -1.099 . . . . 2.53 109.271 179.634 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' C' C ' 336' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -57.74 -62.03 2.09 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.355 -0.841 . . . . 2.62 110.027 -179.702 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' C' C ' 337' ' ' ARG . . . . . . . . . . . . . 1.1 mpt_? -60.43 -26.54 66.8 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.287 -0.883 . . . . 2.81 109.905 -179.427 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 338' ' ' PHE . . . . . 0.418 ' HB3' ' O ' ' C' ' 335' ' ' ARG . 76.1 t80 -55.89 -58.95 5.71 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.236 -0.915 . . . . 0.4 109.855 -179.899 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' C' C ' 339' ' ' GLU . . . . . . . . . . . . . 10.2 mm-40 -51.64 -34.51 38.21 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.309 -0.87 . . . . 2.05 109.884 -179.537 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 340' ' ' MET . . . . . . . . . . . . . 33.4 ttp -64.43 -49.53 71.11 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.22 -0.925 . . . . 0.32 109.898 -179.665 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 341' ' ' PHE . . . . . . . . . . . . . 41.2 m-85 -60.78 -39.54 89.19 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.177 -0.952 . . . . 0.18 109.848 -179.505 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 342' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -51.77 -45.83 63.9 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.119 -0.988 . . . . 2.91 109.835 179.879 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' C' C ' 343' ' ' GLU . . . . . . . . . . . . . 2.3 tp10 -59.17 -47.77 84.09 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.309 -0.869 . . . . 2.14 110.486 -179.267 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 344' ' ' LEU . . . . . 0.464 ' CD2' HD22 ' D' ' 344' ' ' LEU . 30.2 mt -61.62 -35.0 76.65 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.034 -1.041 . . . . 0.22 110.159 -179.376 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' C' C ' 345' ' ' ASN . . . . . 0.59 HD22 HD11 ' A' ' 330' ' ' LEU . 50.4 t-20 -58.17 -59.76 4.8 Favored 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.245 -0.91 . . . . 1.08 110.217 -179.506 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' C' C ' 346' ' ' GLU . . . . . . . . . . . . . 2.6 tt0 -60.55 -22.95 64.22 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.183 -0.948 . . . . 2.21 110.168 -179.375 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 347' ' ' ALA . . . . . 0.652 ' HB1' ' HB1' ' D' ' 347' ' ' ALA . . . -61.52 -57.47 12.0 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.124 -0.985 . . . . 0.18 110.159 -179.657 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' C' C ' 348' ' ' LEU . . . . . 0.604 HD12 ' CZ ' ' A' ' 337' ' ' ARG . 4.2 mm? -61.83 -52.92 62.19 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.267 -0.896 . . . . 0.32 110.272 -179.165 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' C' C ' 349' ' ' GLU . . . . . . . . . . . . . 21.4 mm-40 -55.75 -31.29 62.42 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.157 -0.964 . . . . 2.19 109.995 -179.195 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 350' ' ' LEU . . . . . 1.029 ' CD1' HD13 ' D' ' 350' ' ' LEU . 0.3 OUTLIER -65.22 -49.24 70.46 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.126 -0.984 . . . . 0.46 109.342 -179.91 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' C' C ' 351' ' ' LYS . . . . . 0.861 ' N ' HD13 ' C' ' 350' ' ' LEU . 9.6 tttt -61.4 -44.19 97.57 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.322 -0.861 . . . . 1.35 109.744 179.696 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' C' C ' 352' ' ' ASP . . . . . . . . . . . . . 77.8 m-20 -55.98 -31.48 63.06 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.47 -0.769 . . . . 1.19 110.182 -179.53 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 353' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 1.493 0 O-C-N 121.066 -1.021 . . . . 0.57 109.441 -179.676 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' D' D ' 326' ' ' GLU . . . . . 0.46 ' HB3' ' CE2' ' D' ' 328' ' ' PHE . 48.1 mm-40 . . . . . 0 N--CA 1.487 1.399 0 N-CA-C 109.123 -0.695 . . . . 2.13 109.123 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' D' D ' 327' ' ' TYR . . . . . 0.598 ' CE1' ' HG2' ' B' ' 333' ' ' ARG . 41.8 m-85 -149.16 106.21 3.59 Favored 'General case' 0 C--N 1.302 -1.467 0 O-C-N 121.203 -0.935 . . . . 0.47 109.385 179.814 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' D' D ' 328' ' ' PHE . . . . . 0.492 ' CE2' ' HA ' ' B' ' 335' ' ' ARG . 87.8 m-85 -113.09 -166.39 1.08 Allowed 'General case' 0 N--CA 1.488 1.456 0 O-C-N 121.298 -0.876 . . . . 0.3 109.623 -179.557 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' D' D ' 329' ' ' THR . . . . . . . . . . . . . 35.2 p -153.51 160.32 42.48 Favored 'General case' 0 N--CA 1.488 1.464 0 O-C-N 121.345 -0.847 . . . . 0.22 109.012 -179.544 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' D' D ' 330' ' ' LEU . . . . . 0.63 HD11 HD22 ' B' ' 345' ' ' ASN . 23.4 tp -151.05 129.6 12.2 Favored 'General case' 0 N--CA 1.488 1.475 0 O-C-N 121.152 -0.968 . . . . 0.28 109.639 -179.677 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' D' D ' 331' ' ' GLN . . . . . . . . . . . . . 1.3 tt0 -88.44 114.54 25.16 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.367 -0.833 . . . . 0.93 109.271 179.865 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' D' D ' 332' ' ' ILE . . . . . 0.478 HD12 ' CD1' ' D' ' 338' ' ' PHE . 38.5 mt -103.52 111.7 34.24 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.447 0 O-C-N 121.094 -1.004 . . . . 0.25 109.849 -179.604 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' D' D ' 333' ' ' ARG . . . . . 0.622 ' CG ' ' CE1' ' B' ' 327' ' ' TYR . 0.0 OUTLIER -73.11 148.9 43.52 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.291 -0.88 . . . . 2.93 109.527 179.803 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' D' D ' 334' ' ' GLY . . . . . . . . . . . . . . . 84.97 131.94 2.48 Favored Glycine 0 N--CA 1.492 2.37 0 N-CA-C 109.567 -1.413 . . . . 0.41 109.567 179.988 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' D' D ' 335' ' ' ARG . . . . . 0.53 ' HA ' ' CE2' ' B' ' 328' ' ' PHE . 39.7 ttt180 -78.75 -40.66 32.78 Favored 'General case' 0 N--CA 1.49 1.525 0 O-C-N 121.158 -1.201 . . . . 3.03 109.558 -179.821 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' D' D ' 336' ' ' GLU . . . . . . . . . . . . . 3.7 pt-20 -58.18 -53.28 60.02 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.173 -0.955 . . . . 2.26 110.001 -179.566 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' D' D ' 337' ' ' ARG . . . . . . . . . . . . . 12.9 mmt180 -61.79 -35.98 79.76 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.182 -0.949 . . . . 2.92 109.795 -179.719 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' D' D ' 338' ' ' PHE . . . . . 0.478 ' CD1' HD12 ' D' ' 332' ' ' ILE . 80.5 t80 -54.73 -56.66 16.9 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.145 -0.972 . . . . 0.37 110.054 -179.65 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' D' D ' 339' ' ' GLU . . . . . . . . . . . . . 43.4 mt-10 -52.26 -35.9 51.19 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.214 -0.929 . . . . 1.99 110.337 -179.565 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' D' D ' 340' ' ' MET . . . . . . . . . . . . . 46.9 ttp -62.97 -48.03 80.62 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 120.989 -1.069 . . . . 0.31 109.83 -179.454 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' D' D ' 341' ' ' PHE . . . . . . . . . . . . . 44.5 m-85 -62.83 -47.9 81.39 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.207 -0.933 . . . . 0.18 109.859 -179.752 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' D' D ' 342' ' ' ARG . . . . . . . . . . . . . 16.7 ttt180 -48.98 -42.26 37.05 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.374 -0.829 . . . . 2.41 110.104 -179.544 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' D' D ' 343' ' ' GLU . . . . . . . . . . . . . 4.2 tp10 -59.12 -48.95 79.73 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.037 -1.039 . . . . 2.35 109.845 -179.692 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' D' D ' 344' ' ' LEU . . . . . 0.464 HD22 ' CD2' ' C' ' 344' ' ' LEU . 39.0 mt -60.95 -33.03 72.56 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.097 -1.002 . . . . 0.19 109.741 -179.68 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' D' D ' 345' ' ' ASN . . . . . 0.69 HD22 HD11 ' B' ' 330' ' ' LEU . 63.2 t-20 -56.2 -54.6 43.31 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.223 -0.923 . . . . 1.09 109.739 -179.928 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' D' D ' 346' ' ' GLU . . . . . . . . . . . . . 6.6 tp10 -62.46 -27.48 69.15 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.124 -0.985 . . . . 1.69 110.101 -179.589 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' D' D ' 347' ' ' ALA . . . . . 0.652 ' HB1' ' HB1' ' C' ' 347' ' ' ALA . . . -62.16 -58.48 7.63 Favored 'General case' 0 N--CA 1.493 1.725 0 O-C-N 121.051 -1.03 . . . . 0.18 110.221 -179.573 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' D' D ' 348' ' ' LEU . . . . . 0.582 HD22 ' N ' ' D' ' 348' ' ' LEU . 3.8 mm? -60.8 -48.81 80.09 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.26 -0.9 . . . . 0.31 110.017 -179.321 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' D' D ' 349' ' ' GLU . . . . . . . . . . . . . 43.4 mt-10 -56.83 -33.31 66.62 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.073 -1.017 . . . . 1.95 109.594 -179.591 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' D' D ' 350' ' ' LEU . . . . . 1.029 HD13 ' CD1' ' C' ' 350' ' ' LEU . 4.2 tt -64.16 -44.4 92.21 Favored 'General case' 0 N--CA 1.489 1.479 0 O-C-N 121.374 -0.829 . . . . 0.43 109.243 179.968 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' D' D ' 351' ' ' LYS . . . . . . . . . . . . . 10.1 tttp -61.51 -44.78 96.45 Favored 'General case' 0 N--CA 1.489 1.486 0 O-C-N 121.393 -0.817 . . . . 1.4 109.677 -179.943 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' D' D ' 352' ' ' ASP . . . . . . . . . . . . . 6.0 m-20 -55.96 -37.1 68.57 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.352 -0.842 . . . . 1.17 109.701 -179.795 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' D' D ' 353' ' ' ALA . . . . . . . . . . . . . . . -66.44 -30.51 70.88 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.278 -0.889 . . . . 0.59 109.722 -179.767 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' D' D ' 354' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 N--CA 1.49 1.526 0 O-C-N 121.269 -0.894 . . . . 1.44 109.603 -179.947 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 326' ' ' GLU . . . . . . . . . . . . . 3.5 mt-10 . . . . . 0 N--CA 1.489 1.518 0 CA-C-O 121.427 0.632 . . . . 2.13 109.716 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 327' ' ' TYR . . . . . 0.611 ' CE1' ' HG2' ' C' ' 333' ' ' ARG . 39.1 m-85 -149.44 109.66 4.16 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.471 -0.768 . . . . 0.48 109.613 -179.877 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 328' ' ' PHE . . . . . 0.45 ' O ' ' OE1' ' C' ' 331' ' ' GLN . 81.2 m-85 -113.01 -166.6 1.09 Allowed 'General case' 0 N--CA 1.489 1.487 0 O-C-N 121.439 -0.788 . . . . 0.31 109.293 179.658 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 329' ' ' THR . . . . . 0.441 ' HA ' ' O ' ' C' ' 330' ' ' LEU . 15.2 p -153.77 167.14 30.63 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.305 -0.872 . . . . 0.22 109.216 179.985 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 330' ' ' LEU . . . . . 0.423 HD11 HD22 ' C' ' 345' ' ' ASN . 15.1 tp -152.79 131.55 12.39 Favored 'General case' 0 C--N 1.303 -1.415 0 O-C-N 121.278 -0.889 . . . . 0.28 109.876 -179.698 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 331' ' ' GLN . . . . . 0.406 ' O ' ' NH2' ' A' ' 333' ' ' ARG . 1.5 tt0 -86.4 117.42 25.19 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.29 -0.881 . . . . 0.91 108.87 179.635 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 332' ' ' ILE . . . . . 0.586 HG21 ' HA ' ' A' ' 338' ' ' PHE . 61.1 mt -102.91 103.55 15.24 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.526 0 O-C-N 121.042 -1.036 . . . . 0.26 109.725 -179.796 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 333' ' ' ARG . . . . . 0.469 HH11 ' CG ' ' A' ' 333' ' ' ARG . 0.0 OUTLIER -69.96 145.86 51.56 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.372 -0.83 . . . . 2.92 109.123 179.659 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 334' ' ' GLY . . . . . . . . . . . . . . . 82.5 126.86 1.02 Allowed Glycine 0 N--CA 1.492 2.421 0 N-CA-C 109.654 -1.378 . . . . 0.4 109.654 -179.801 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 335' ' ' ARG . . . . . 0.462 ' O ' ' HB3' ' A' ' 338' ' ' PHE . 10.2 ttm180 -74.6 -38.5 62.59 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.387 -1.066 . . . . 3.01 109.334 179.881 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 336' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -55.54 -54.94 37.73 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.416 -0.802 . . . . 2.29 109.792 -179.555 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 337' ' ' ARG . . . . . . . . . . . . . 17.8 mtp180 -62.81 -28.65 70.15 Favored 'General case' 0 N--CA 1.496 1.835 0 O-C-N 121.381 -0.824 . . . . 2.93 109.87 179.803 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 338' ' ' PHE . . . . . 0.586 ' HA ' HG21 ' A' ' 332' ' ' ILE . 77.9 t80 -55.05 -61.5 2.27 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.035 -1.04 . . . . 0.38 109.833 -179.453 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 339' ' ' GLU . . . . . . . . . . . . . 43.1 mt-10 -50.58 -31.75 16.69 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 120.935 -1.103 . . . . 1.97 109.769 -179.748 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 340' ' ' MET . . . . . . . . . . . . . 27.2 ttp -63.8 -55.06 25.82 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 120.991 -1.068 . . . . 0.31 110.153 -179.519 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 341' ' ' PHE . . . . . . . . . . . . . 43.5 m-85 -61.37 -53.72 53.03 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.346 -0.846 . . . . 0.18 109.647 -179.502 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 342' ' ' ARG . . . . . . . . . . . . . 5.4 ttp180 -44.52 -40.57 5.75 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.466 -0.771 . . . . 2.42 109.596 -179.866 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 343' ' ' GLU . . . . . . . . . . . . . 21.6 tt0 -58.68 -46.69 86.66 Favored 'General case' 0 N--CA 1.489 1.5 0 O-C-N 121.18 -0.95 . . . . 2.35 109.866 -179.689 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 344' ' ' LEU . . . . . 0.616 HD22 ' CD2' ' B' ' 344' ' ' LEU . 49.3 mt -63.36 -45.16 92.46 Favored 'General case' 0 C--N 1.3 -1.552 0 O-C-N 121.269 -0.895 . . . . 0.18 109.988 -179.628 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 345' ' ' ASN . . . . . . . . . . . . . 34.5 t-20 -53.02 -48.93 67.18 Favored 'General case' 0 C--N 1.302 -1.478 0 O-C-N 121.247 -0.908 . . . . 1.09 109.595 -179.613 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 346' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -59.61 -36.34 76.12 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.178 -0.951 . . . . 1.65 109.514 -179.922 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 347' ' ' ALA . . . . . 0.837 ' HB1' ' HB1' ' B' ' 347' ' ' ALA . . . -61.05 -49.44 77.35 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.239 -0.913 . . . . 0.18 109.854 -179.924 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 348' ' ' LEU . . . . . 0.518 HD22 ' N ' ' A' ' 348' ' ' LEU . 4.0 mm? -61.84 -41.6 98.0 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 120.949 -1.094 . . . . 0.3 109.739 -179.729 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 349' ' ' GLU . . . . . . . . . . . . . 61.5 mt-10 -58.06 -41.02 82.47 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.231 -0.918 . . . . 1.94 110.117 -179.441 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 350' ' ' LEU . . . . . 0.621 HD22 HD13 ' B' ' 350' ' ' LEU . 7.7 tt -62.9 -41.43 99.44 Favored 'General case' 0 N--CA 1.488 1.461 0 O-C-N 121.109 -0.995 . . . . 0.46 109.86 -179.52 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 351' ' ' LYS . . . . . . . . . . . . . 10.5 tttt -58.04 -46.7 84.91 Favored 'General case' 0 N--CA 1.494 1.751 0 O-C-N 121.0 -1.063 . . . . 1.4 109.387 -179.741 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 352' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -55.8 -51.88 65.91 Favored 'General case' 0 N--CA 1.487 1.389 0 O-C-N 121.481 -0.762 . . . . 1.16 109.778 -179.951 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 353' ' ' ALA . . . . . . . . . . . . . . . -68.65 -14.76 63.23 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 120.964 -1.085 . . . . 0.63 109.574 -179.829 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 354' ' ' GLN . . . . . 0.529 ' NE2' ' CD1' ' B' ' 350' ' ' LEU . 0.7 OUTLIER . . . . . 0 N--CA 1.492 1.63 0 O-C-N 121.279 -0.888 . . . . 1.47 109.611 -179.893 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 326' ' ' GLU . . . . . . . . . . . . . 3.4 mt-10 . . . . . 0 N--CA 1.492 1.639 0 CA-C-O 121.367 0.603 . . . . 2.13 109.391 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' B' B ' 327' ' ' TYR . . . . . 0.455 ' CE1' ' HG2' ' D' ' 333' ' ' ARG . 41.1 m-85 -150.35 109.72 3.98 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.444 -0.785 . . . . 0.48 109.556 179.902 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 328' ' ' PHE . . . . . 0.402 ' O ' HG23 ' B' ' 329' ' ' THR . 91.1 m-85 -113.41 -167.05 1.14 Allowed 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.363 -0.835 . . . . 0.32 109.399 179.999 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 329' ' ' THR . . . . . 0.446 ' HA ' ' O ' ' D' ' 330' ' ' LEU . 18.0 p -153.53 165.64 35.24 Favored 'General case' 0 N--CA 1.487 1.41 0 O-C-N 121.122 -0.987 . . . . 0.23 109.351 179.836 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 330' ' ' LEU . . . . . 0.416 HD11 HD22 ' D' ' 345' ' ' ASN . 14.9 tp -151.19 132.8 14.83 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.206 -0.934 . . . . 0.28 110.102 -179.685 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 331' ' ' GLN . . . . . . . . . . . . . 1.4 tt0 -87.06 117.95 26.13 Favored 'General case' 0 C--N 1.301 -1.528 0 O-C-N 121.296 -0.877 . . . . 0.91 109.067 179.496 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 332' ' ' ILE . . . . . 0.601 HG21 ' HA ' ' B' ' 338' ' ' PHE . 56.4 mt -103.02 104.89 17.29 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.5 0 O-C-N 121.14 -0.975 . . . . 0.24 109.664 179.813 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 333' ' ' ARG . . . . . 0.472 ' CG ' HH11 ' B' ' 333' ' ' ARG . 0.0 OUTLIER -70.76 145.44 50.43 Favored 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.385 -0.822 . . . . 2.93 108.927 179.602 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' B' B ' 334' ' ' GLY . . . . . . . . . . . . . . . 81.62 131.18 1.27 Allowed Glycine 0 N--CA 1.491 2.303 0 N-CA-C 109.264 -1.534 . . . . 0.4 109.264 -179.685 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 335' ' ' ARG . . . . . 0.47 ' O ' ' HB3' ' B' ' 338' ' ' PHE . 9.9 ttm180 -77.5 -38.14 49.62 Favored 'General case' 0 N--CA 1.489 1.48 0 O-C-N 121.283 -1.128 . . . . 3.01 109.472 -179.931 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 336' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -56.38 -54.48 45.11 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.362 -0.837 . . . . 2.28 109.382 -179.924 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 337' ' ' ARG . . . . . . . . . . . . . 18.6 mtp180 -62.19 -28.49 69.71 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.189 -0.944 . . . . 2.93 109.944 -179.987 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 338' ' ' PHE . . . . . 0.601 ' HA ' HG21 ' B' ' 332' ' ' ILE . 80.2 t80 -55.85 -61.18 2.54 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 120.985 -1.072 . . . . 0.37 109.848 -179.617 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 339' ' ' GLU . . . . . . . . . . . . . 35.8 mt-10 -50.44 -32.84 18.96 Favored 'General case' 0 N--CA 1.494 1.77 0 O-C-N 121.241 -0.912 . . . . 1.98 109.846 -179.6 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 340' ' ' MET . . . . . . . . . . . . . 27.0 ttp -63.08 -54.42 38.33 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.265 -0.897 . . . . 0.32 109.921 -179.725 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 341' ' ' PHE . . . . . 0.416 ' O ' ' C ' ' B' ' 342' ' ' ARG . 45.0 m-85 -62.28 -54.06 46.1 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.464 -0.772 . . . . 0.18 109.826 -179.721 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 342' ' ' ARG . . . . . 0.416 ' C ' ' O ' ' B' ' 341' ' ' PHE . 4.4 ttp180 -45.0 -39.14 5.31 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 120.926 -1.108 . . . . 2.42 109.768 -179.954 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 343' ' ' GLU . . . . . . . . . . . . . 20.1 tt0 -58.68 -47.6 83.94 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.111 -0.993 . . . . 2.35 109.568 -179.911 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 344' ' ' LEU . . . . . 0.616 ' CD2' HD22 ' A' ' 344' ' ' LEU . 48.0 mt -63.27 -45.25 92.33 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.047 -1.033 . . . . 0.18 110.244 -179.628 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 345' ' ' ASN . . . . . 0.521 HD22 HD11 ' D' ' 330' ' ' LEU . 36.8 t-20 -52.79 -48.12 67.09 Favored 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.28 -0.887 . . . . 1.09 109.666 -179.316 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 346' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -60.48 -35.64 76.39 Favored 'General case' 0 N--CA 1.488 1.447 0 O-C-N 121.021 -1.049 . . . . 1.66 109.465 179.882 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 347' ' ' ALA . . . . . 0.837 ' HB1' ' HB1' ' A' ' 347' ' ' ALA . . . -61.72 -48.88 78.75 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.145 -0.972 . . . . 0.17 110.406 -179.732 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 348' ' ' LEU . . . . . 0.543 HD22 ' N ' ' B' ' 348' ' ' LEU . 3.8 mm? -63.0 -40.85 99.0 Favored 'General case' 0 N--CA 1.495 1.818 0 O-C-N 121.263 -0.898 . . . . 0.29 109.661 -179.647 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 349' ' ' GLU . . . . . . . . . . . . . 64.5 mt-10 -58.32 -41.54 84.79 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.264 -0.898 . . . . 1.95 110.254 -179.863 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 350' ' ' LEU . . . . . 0.621 HD13 HD22 ' A' ' 350' ' ' LEU . 8.6 tt -61.93 -41.65 98.2 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.067 -1.021 . . . . 0.45 109.969 -179.428 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 351' ' ' LYS . . . . . . . . . . . . . 10.9 tttt -57.9 -47.02 84.03 Favored 'General case' 0 C--N 1.3 -1.577 0 O-C-N 121.084 -1.01 . . . . 1.38 109.425 179.952 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 352' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -55.28 -50.62 69.06 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 120.917 -1.114 . . . . 1.16 109.835 -179.9 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 353' ' ' ALA . . . . . . . . . . . . . . . -69.26 -16.0 63.49 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 121.284 -0.885 . . . . 0.61 109.667 -179.853 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 354' ' ' GLN . . . . . 0.42 ' NE2' ' CD1' ' A' ' 350' ' ' LEU . 1.0 OUTLIER . . . . . 0 N--CA 1.492 1.674 0 O-C-N 121.263 -0.898 . . . . 1.45 109.892 -179.808 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' C' C ' 326' ' ' GLU . . . . . . . . . . . . . 8.0 mm-40 . . . . . 0 N--CA 1.486 1.327 0 N-CA-C 108.938 -0.764 . . . . 2.17 108.938 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' C' C ' 327' ' ' TYR . . . . . . . . . . . . . 47.9 m-85 -149.78 109.46 4.04 Favored 'General case' 0 C--N 1.3 -1.561 0 O-C-N 121.014 -1.054 . . . . 0.48 110.139 -179.804 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 328' ' ' PHE . . . . . 0.407 ' CZ ' ' HG3' ' A' ' 335' ' ' ARG . 77.4 m-85 -110.72 -167.79 1.23 Allowed 'General case' 0 N--CA 1.491 1.59 0 N-CA-C 108.886 -0.783 . . . . 0.33 108.886 179.742 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' C' C ' 329' ' ' THR . . . . . 0.402 HG23 ' O ' ' C' ' 328' ' ' PHE . 6.4 p -151.77 160.12 43.69 Favored 'General case' 0 C--N 1.302 -1.486 0 O-C-N 121.052 -1.03 . . . . 0.23 109.312 -179.779 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' C' C ' 330' ' ' LEU . . . . . 0.441 ' O ' ' HA ' ' A' ' 329' ' ' THR . 21.8 tp -149.32 126.87 11.61 Favored 'General case' 0 N--CA 1.494 1.771 0 O-C-N 121.083 -1.01 . . . . 0.28 109.833 -179.674 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' C' C ' 331' ' ' GLN . . . . . 0.45 ' OE1' ' O ' ' A' ' 328' ' ' PHE . 0.7 OUTLIER -87.14 120.99 28.99 Favored 'General case' 0 N--CA 1.496 1.851 0 O-C-N 121.437 -0.79 . . . . 1.48 109.578 179.904 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' C' C ' 332' ' ' ILE . . . . . 0.493 HD12 ' CD1' ' C' ' 338' ' ' PHE . 15.2 mt -103.88 111.1 32.25 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.854 0 O-C-N 121.023 -1.048 . . . . 0.24 109.843 179.762 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' C' C ' 333' ' ' ARG . . . . . 0.611 ' HG2' ' CE1' ' A' ' 327' ' ' TYR . 4.4 mtp180 -72.06 137.66 47.29 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.351 -0.843 . . . . 2.74 109.332 179.709 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' C' C ' 334' ' ' GLY . . . . . . . . . . . . . . . 90.94 137.0 7.01 Favored Glycine 0 N--CA 1.491 2.303 0 N-CA-C 109.82 -1.312 . . . . 0.35 109.82 179.709 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 335' ' ' ARG . . . . . 0.409 ' HA ' ' CE1' ' A' ' 328' ' ' PHE . 3.1 ttt180 -80.09 -38.9 30.76 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.272 -1.134 . . . . 2.53 109.31 179.929 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' C' C ' 336' ' ' GLU . . . . . 0.418 ' HA ' ' OE1' ' C' ' 339' ' ' GLU . 1.7 tm-20 -58.91 -52.8 64.18 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.569 -0.707 . . . . 2.62 109.391 179.992 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' C' C ' 337' ' ' ARG . . . . . . . . . . . . . 34.9 mtp180 -60.91 -34.66 75.02 Favored 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.33 -0.856 . . . . 2.81 109.324 179.975 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 338' ' ' PHE . . . . . 0.493 ' CD1' HD12 ' C' ' 332' ' ' ILE . 57.5 t80 -53.57 -65.21 0.6 Allowed 'General case' 0 N--CA 1.487 1.403 0 O-C-N 121.264 -0.898 . . . . 0.4 109.745 -179.735 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' C' C ' 339' ' ' GLU . . . . . 0.418 ' OE1' ' HA ' ' C' ' 336' ' ' GLU . 3.2 mp0 -47.13 -34.84 6.46 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.249 -0.907 . . . . 2.05 110.375 -179.217 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' C' C ' 340' ' ' MET . . . . . . . . . . . . . 15.2 ttp -63.92 -53.4 50.98 Favored 'General case' 0 C--N 1.301 -1.51 0 O-C-N 120.841 -1.162 . . . . 0.32 110.034 -179.208 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 341' ' ' PHE . . . . . 0.441 ' HB2' HD13 ' C' ' 332' ' ' ILE . 40.6 m-85 -61.29 -44.92 96.42 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.032 -1.043 . . . . 0.18 109.614 -179.581 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' C' C ' 342' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -50.5 -45.52 56.51 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.213 -0.929 . . . . 2.91 110.41 -179.699 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' C' C ' 343' ' ' GLU . . . . . . . . . . . . . 5.1 tt0 -57.34 -43.58 83.52 Favored 'General case' 0 N--CA 1.489 1.497 0 O-C-N 121.331 -0.856 . . . . 2.14 109.786 -179.431 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 344' ' ' LEU . . . . . 0.437 HD22 HD22 ' D' ' 344' ' ' LEU . 41.3 mt -62.64 -46.93 85.95 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.192 -0.942 . . . . 0.22 109.779 179.945 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' C' C ' 345' ' ' ASN . . . . . 0.423 HD22 HD11 ' A' ' 330' ' ' LEU . 31.2 t-20 -55.22 -49.48 71.87 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.287 -0.883 . . . . 1.08 109.896 -179.499 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' C' C ' 346' ' ' GLU . . . . . . . . . . . . . 13.6 tp10 -58.18 -35.95 72.35 Favored 'General case' 0 N--CA 1.489 1.5 0 O-C-N 121.098 -1.001 . . . . 2.21 109.713 -179.556 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 347' ' ' ALA . . . . . 0.809 ' HB1' ' HB1' ' D' ' 347' ' ' ALA . . . -61.49 -47.0 87.61 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.03 -1.044 . . . . 0.18 109.802 -179.931 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' C' C ' 348' ' ' LEU . . . . . 0.496 HD22 ' N ' ' C' ' 348' ' ' LEU . 4.2 mm? -62.83 -48.44 79.08 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.104 -0.998 . . . . 0.32 110.401 -179.552 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' C' C ' 349' ' ' GLU . . . . . . . . . . . . . 33.4 mt-10 -57.7 -36.53 72.1 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.151 -0.968 . . . . 2.19 109.878 -179.176 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 350' ' ' LEU . . . . . 0.597 ' CD2' HD22 ' D' ' 350' ' ' LEU . 3.9 tt -62.05 -40.07 94.53 Favored 'General case' 0 N--CA 1.489 1.482 0 O-C-N 121.312 -0.867 . . . . 0.46 109.424 -179.87 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' C' C ' 351' ' ' LYS . . . . . . . . . . . . . 12.3 tttt -58.72 -37.83 77.0 Favored 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.147 -0.97 . . . . 1.35 109.084 -179.929 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 352' ' ' ASP . . . . . . . . . . . . . 49.0 m-20 -55.1 -54.97 36.41 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.29 -0.881 . . . . 1.19 109.556 179.519 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 353' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 1.566 0 O-C-N 121.351 -0.843 . . . . 0.57 109.544 -179.85 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' D' D ' 326' ' ' GLU . . . . . . . . . . . . . 3.4 mt-10 . . . . . 0 N--CA 1.489 1.491 0 CA-C-O 121.331 0.586 . . . . 2.13 109.723 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' D' D ' 327' ' ' TYR . . . . . . . . . . . . . 40.5 m-85 -149.39 109.88 4.22 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.277 -0.89 . . . . 0.47 109.541 -179.695 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' D' D ' 328' ' ' PHE . . . . . 0.442 ' O ' HG23 ' D' ' 329' ' ' THR . 94.9 m-85 -113.29 -166.83 1.12 Allowed 'General case' 0 N--CA 1.488 1.469 0 O-C-N 121.213 -0.929 . . . . 0.3 109.38 179.986 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' D' D ' 329' ' ' THR . . . . . 0.442 HG23 ' O ' ' D' ' 328' ' ' PHE . 19.1 p -154.1 165.05 37.44 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.248 -0.907 . . . . 0.22 109.517 179.875 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' D' D ' 330' ' ' LEU . . . . . 0.521 HD11 HD22 ' B' ' 345' ' ' ASN . 14.7 tp -150.69 132.56 15.08 Favored 'General case' 0 N--CA 1.487 1.413 0 O-C-N 121.029 -1.044 . . . . 0.28 109.997 -179.463 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' D' D ' 331' ' ' GLN . . . . . . . . . . . . . 1.3 tt0 -86.21 117.14 24.84 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.234 -0.916 . . . . 0.93 108.576 179.402 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' D' D ' 332' ' ' ILE . . . . . 0.619 HG21 ' HA ' ' D' ' 338' ' ' PHE . 63.7 mt -102.65 104.2 16.17 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.618 0 O-C-N 121.162 -0.961 . . . . 0.25 109.584 -179.923 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' D' D ' 333' ' ' ARG . . . . . 0.457 HH11 ' CG ' ' D' ' 333' ' ' ARG . 0.0 OUTLIER -70.19 146.49 50.71 Favored 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.422 -0.799 . . . . 2.93 109.477 179.869 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' D' D ' 334' ' ' GLY . . . . . . . . . . . . . . . 80.33 130.93 0.94 Allowed Glycine 0 N--CA 1.491 2.363 0 N-CA-C 109.533 -1.427 . . . . 0.41 109.533 -179.77 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' D' D ' 335' ' ' ARG . . . . . 0.477 ' O ' ' HB3' ' D' ' 338' ' ' PHE . 9.8 ttm180 -77.66 -36.33 51.47 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.104 -1.233 . . . . 3.03 109.572 -179.753 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' D' D ' 336' ' ' GLU . . . . . . . . . . . . . 1.1 tt0 -57.12 -55.31 36.36 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.369 -0.832 . . . . 2.26 109.358 -179.759 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' D' D ' 337' ' ' ARG . . . . . . . . . . . . . 18.1 mtp180 -61.48 -28.38 69.25 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.356 -0.84 . . . . 2.92 109.695 -179.932 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' D' D ' 338' ' ' PHE . . . . . 0.619 ' HA ' HG21 ' D' ' 332' ' ' ILE . 79.5 t80 -55.74 -61.76 2.14 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.21 -0.931 . . . . 0.37 109.83 -179.482 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' D' D ' 339' ' ' GLU . . . . . . . . . . . . . 45.1 mt-10 -50.66 -31.63 16.81 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.38 -0.825 . . . . 1.99 109.945 -179.655 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' D' D ' 340' ' ' MET . . . . . . . . . . . . . 29.3 ttp -64.64 -53.86 40.96 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.093 -1.004 . . . . 0.31 110.0 -179.482 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' D' D ' 341' ' ' PHE . . . . . . . . . . . . . 46.3 m-85 -62.57 -53.41 55.1 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.216 -0.928 . . . . 0.18 109.549 -179.74 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' D' D ' 342' ' ' ARG . . . . . . . . . . . . . 4.0 ttp180 -45.08 -38.67 5.19 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.101 -0.999 . . . . 2.41 109.904 -179.924 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' D' D ' 343' ' ' GLU . . . . . . . . . . . . . 20.9 tt0 -59.39 -47.65 84.62 Favored 'General case' 0 N--CA 1.49 1.525 0 O-C-N 121.12 -0.988 . . . . 2.35 109.534 -179.978 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' D' D ' 344' ' ' LEU . . . . . 0.453 ' O ' HD23 ' D' ' 348' ' ' LEU . 44.9 mt -63.18 -45.37 92.08 Favored 'General case' 0 C--N 1.301 -1.51 0 O-C-N 121.193 -0.942 . . . . 0.19 110.037 -179.703 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' D' D ' 345' ' ' ASN . . . . . 0.416 HD22 HD11 ' B' ' 330' ' ' LEU . 33.9 t-20 -52.43 -49.03 65.36 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.22 -0.925 . . . . 1.09 109.858 -179.349 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' D' D ' 346' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -60.07 -35.63 75.59 Favored 'General case' 0 N--CA 1.488 1.436 0 O-C-N 121.077 -1.014 . . . . 1.69 109.453 -179.961 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' D' D ' 347' ' ' ALA . . . . . 0.809 ' HB1' ' HB1' ' C' ' 347' ' ' ALA . . . -61.42 -48.97 78.78 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.259 -0.901 . . . . 0.18 110.215 -179.677 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' D' D ' 348' ' ' LEU . . . . . 0.57 HD22 ' N ' ' D' ' 348' ' ' LEU . 4.0 mm? -62.91 -40.66 98.25 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.147 -0.971 . . . . 0.31 109.663 -179.7 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' D' D ' 349' ' ' GLU . . . . . . . . . . . . . 59.6 mt-10 -59.05 -41.64 88.39 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.3 -0.875 . . . . 1.95 110.059 -179.309 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' D' D ' 350' ' ' LEU . . . . . 0.597 HD22 ' CD2' ' C' ' 350' ' ' LEU . 8.3 tt -61.76 -41.45 97.7 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.04 -1.037 . . . . 0.43 109.791 -179.282 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' D' D ' 351' ' ' LYS . . . . . . . . . . . . . 13.3 tttt -57.56 -47.34 82.33 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.01 -1.056 . . . . 1.4 109.301 -179.96 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' D' D ' 352' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -55.8 -51.45 67.4 Favored 'General case' 0 C--N 1.301 -1.505 0 O-C-N 121.393 -0.817 . . . . 1.17 109.503 179.984 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' D' D ' 353' ' ' ALA . . . . . . . . . . . . . . . -68.77 -14.88 63.31 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.153 -0.967 . . . . 0.59 109.616 -179.806 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' D' D ' 354' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 N--CA 1.494 1.746 0 O-C-N 121.334 -0.854 . . . . 1.44 109.955 -179.51 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 326' ' ' GLU . . . . . . . . . . . . . 6.2 mm-40 . . . . . 0 N--CA 1.49 1.554 0 CA-C-O 121.257 0.551 . . . . 2.13 109.548 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 327' ' ' TYR . . . . . 0.607 ' CE1' ' HG2' ' C' ' 333' ' ' ARG . 49.1 m-85 -149.36 108.47 3.91 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.31 -0.869 . . . . 0.48 109.315 179.98 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 328' ' ' PHE . . . . . 0.422 ' CZ ' ' HG3' ' C' ' 335' ' ' ARG . 98.0 m-85 -113.97 -167.54 1.22 Allowed 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.261 -0.9 . . . . 0.31 109.693 -179.902 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 329' ' ' THR . . . . . . . . . . . . . 41.5 p -152.83 165.13 36.39 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.398 -0.814 . . . . 0.22 108.967 179.91 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 330' ' ' LEU . . . . . . . . . . . . . 21.4 tp -151.55 129.59 11.83 Favored 'General case' 0 N--CA 1.489 1.497 0 O-C-N 121.067 -1.021 . . . . 0.28 110.063 -179.519 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 331' ' ' GLN . . . . . . . . . . . . . 1.7 tp60 -88.28 116.32 26.4 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.28 -0.887 . . . . 0.91 109.02 179.422 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 332' ' ' ILE . . . . . 0.593 HD12 ' CD1' ' A' ' 338' ' ' PHE . 36.1 mt -103.71 108.64 25.0 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.641 0 O-C-N 121.107 -0.996 . . . . 0.26 110.082 -179.588 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 333' ' ' ARG . . . . . 0.452 ' HG2' ' CE1' ' C' ' 327' ' ' TYR . 0.1 OUTLIER -73.41 144.84 46.22 Favored 'General case' 0 N--CA 1.489 1.483 0 O-C-N 121.284 -0.885 . . . . 2.92 109.152 179.417 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 334' ' ' GLY . . . . . 0.489 ' CA ' ' HB2' ' C' ' 326' ' ' GLU . . . 82.37 128.01 1.1 Allowed Glycine 0 N--CA 1.492 2.385 0 N-CA-C 109.534 -1.426 . . . . 0.4 109.534 -179.853 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 335' ' ' ARG . . . . . . . . . . . . . 40.3 ttp180 -79.92 -30.48 40.04 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.269 -1.136 . . . . 3.01 110.019 -179.717 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 336' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -55.41 -68.29 0.21 Allowed 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.199 -0.938 . . . . 2.29 109.967 -179.537 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 337' ' ' ARG . . . . . . . . . . . . . 16.3 mmt180 -60.36 -28.05 67.88 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.182 -0.949 . . . . 2.93 109.693 -179.72 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 338' ' ' PHE . . . . . 0.593 ' CD1' HD12 ' A' ' 332' ' ' ILE . 66.2 t80 -55.56 -56.35 21.31 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.141 -0.974 . . . . 0.38 109.749 -179.934 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 339' ' ' GLU . . . . . . . . . . . . . 20.2 mm-40 -51.37 -37.48 48.3 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.276 -0.89 . . . . 1.97 109.948 -179.774 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 340' ' ' MET . . . . . . . . . . . . . 33.6 ttp -64.36 -45.39 87.95 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.138 -0.977 . . . . 0.31 110.252 -179.545 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 341' ' ' PHE . . . . . . . . . . . . . 32.8 m-85 -63.04 -51.07 68.18 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.234 -0.917 . . . . 0.18 110.313 -179.341 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 342' ' ' ARG . . . . . 0.549 ' HG2' ' NH1' ' A' ' 342' ' ' ARG . 4.5 ttt-85 -49.0 -46.2 43.53 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.187 -0.946 . . . . 2.42 110.158 -179.295 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 343' ' ' GLU . . . . . . . . . . . . . 2.1 tt0 -58.44 -43.05 88.6 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.27 -0.894 . . . . 2.35 110.046 -179.408 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 344' ' ' LEU . . . . . . . . . . . . . 40.3 mt -62.54 -38.41 89.9 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.111 -0.993 . . . . 0.18 109.828 -179.745 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 345' ' ' ASN . . . . . . . . . . . . . 46.7 t-20 -56.88 -48.43 78.18 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.152 -0.967 . . . . 1.09 109.648 -179.778 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 346' ' ' GLU . . . . . . . . . . . . . 2.9 tt0 -61.7 -33.65 74.39 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.274 -0.891 . . . . 1.65 109.835 -179.776 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 347' ' ' ALA . . . . . 0.945 ' HB1' ' HB1' ' B' ' 347' ' ' ALA . . . -60.53 -53.76 53.59 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.204 -0.935 . . . . 0.18 110.27 -179.601 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 348' ' ' LEU . . . . . 0.599 HD22 ' N ' ' A' ' 348' ' ' LEU . 4.1 mm? -61.51 -48.46 80.93 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.201 -0.937 . . . . 0.3 110.166 -179.319 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 349' ' ' GLU . . . . . . . . . . . . . 64.9 mm-40 -57.86 -32.89 68.1 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.182 -0.949 . . . . 1.94 110.126 -179.426 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 350' ' ' LEU . . . . . 0.562 ' C ' HD23 ' A' ' 350' ' ' LEU . 7.7 tt -64.39 -49.11 72.88 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.136 -0.978 . . . . 0.46 109.821 -179.647 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 351' ' ' LYS . . . . . . . . . . . . . 68.0 tttt -59.01 -43.25 91.52 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.193 -0.942 . . . . 1.4 109.781 -179.547 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 352' ' ' ASP . . . . . . . . . . . . . 66.7 m-20 -56.52 -50.91 70.45 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.11 -0.994 . . . . 1.16 109.66 -179.79 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 353' ' ' ALA . . . . . . . . . . . . . . . -68.23 -14.11 62.74 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.308 -0.87 . . . . 0.63 109.803 -179.676 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 354' ' ' GLN . . . . . . . . . . . . . 10.6 tt0 . . . . . 0 N--CA 1.49 1.548 0 O-C-N 121.181 -0.949 . . . . 1.47 109.798 -179.857 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' B' B ' 326' ' ' GLU . . . . . . . . . . . . . 6.5 mm-40 . . . . . 0 N--CA 1.49 1.528 0 CA-C-O 121.285 0.564 . . . . 2.13 109.536 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' B' B ' 327' ' ' TYR . . . . . 0.477 ' CE1' ' HG2' ' D' ' 333' ' ' ARG . 49.0 m-85 -149.33 108.69 3.96 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.264 -0.898 . . . . 0.48 109.373 179.881 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 328' ' ' PHE . . . . . . . . . . . . . 98.0 m-85 -114.09 -167.32 1.2 Allowed 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.242 -0.911 . . . . 0.32 109.73 -179.847 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 329' ' ' THR . . . . . . . . . . . . . 40.9 p -152.81 165.2 36.13 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.423 -0.798 . . . . 0.23 109.041 179.876 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 330' ' ' LEU . . . . . . . . . . . . . 21.4 tp -151.81 129.66 11.68 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.038 -1.039 . . . . 0.28 110.038 -179.647 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 331' ' ' GLN . . . . . . . . . . . . . 1.7 tp60 -88.42 116.32 26.56 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.397 -0.814 . . . . 0.91 109.001 179.528 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 332' ' ' ILE . . . . . 0.607 HD12 ' CD1' ' B' ' 338' ' ' PHE . 35.4 mt -103.74 108.94 25.7 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.614 0 O-C-N 121.18 -0.95 . . . . 0.24 109.988 -179.555 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 333' ' ' ARG . . . . . 0.551 ' HG2' ' CE1' ' D' ' 327' ' ' TYR . 0.1 OUTLIER -73.83 144.57 45.45 Favored 'General case' 0 N--CA 1.489 1.481 0 O-C-N 121.267 -0.896 . . . . 2.93 109.043 179.359 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' B' B ' 334' ' ' GLY . . . . . . . . . . . . . . . 82.65 127.54 1.11 Allowed Glycine 0 N--CA 1.492 2.418 0 N-CA-C 109.491 -1.444 . . . . 0.4 109.491 -179.821 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 335' ' ' ARG . . . . . . . . . . . . . 40.3 ttp180 -79.71 -30.32 40.94 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.333 -1.098 . . . . 3.01 109.944 -179.654 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 336' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -55.6 -68.43 0.2 Allowed 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.128 -0.982 . . . . 2.28 109.824 -179.533 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 337' ' ' ARG . . . . . . . . . . . . . 16.5 mmt180 -60.21 -27.88 67.54 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.192 -0.942 . . . . 2.93 109.67 -179.614 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 338' ' ' PHE . . . . . 0.607 ' CD1' HD12 ' B' ' 332' ' ' ILE . 65.4 t80 -55.73 -56.39 21.06 Favored 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.298 -0.876 . . . . 0.37 109.672 -179.867 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 339' ' ' GLU . . . . . . . . . . . . . 21.2 mm-40 -51.42 -37.56 49.14 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.229 -0.919 . . . . 1.98 109.886 -179.77 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 340' ' ' MET . . . . . . . . . . . . . 33.6 ttp -64.25 -45.54 87.68 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.202 -0.936 . . . . 0.32 110.171 -179.48 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 341' ' ' PHE . . . . . . . . . . . . . 32.6 m-85 -62.88 -50.85 69.26 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.202 -0.936 . . . . 0.18 110.433 -179.331 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 342' ' ' ARG . . . . . 0.542 ' NH1' ' HG2' ' B' ' 342' ' ' ARG . 4.5 ttt-85 -49.25 -46.21 45.78 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.165 -0.959 . . . . 2.42 110.164 -179.337 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 343' ' ' GLU . . . . . . . . . . . . . 2.0 tt0 -58.28 -43.03 87.83 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.061 -1.024 . . . . 2.35 110.016 -179.475 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 344' ' ' LEU . . . . . . . . . . . . . 40.2 mt -62.71 -38.19 89.47 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.107 -0.995 . . . . 0.18 109.922 -179.718 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 345' ' ' ASN . . . . . . . . . . . . . 47.0 t-20 -57.13 -48.3 79.0 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.211 -0.931 . . . . 1.09 109.658 -179.825 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 346' ' ' GLU . . . . . . . . . . . . . 2.9 tt0 -61.66 -33.7 74.42 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.206 -0.934 . . . . 1.66 109.812 -179.825 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 347' ' ' ALA . . . . . 0.945 ' HB1' ' HB1' ' A' ' 347' ' ' ALA . . . -60.56 -53.74 53.81 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.197 -0.939 . . . . 0.17 110.188 -179.526 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 348' ' ' LEU . . . . . 0.594 HD22 ' N ' ' B' ' 348' ' ' LEU . 4.1 mm? -61.42 -48.59 80.49 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.221 -0.924 . . . . 0.29 110.178 -179.287 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 349' ' ' GLU . . . . . . . . . . . . . 64.3 mm-40 -57.76 -32.91 67.94 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.188 -0.945 . . . . 1.95 110.105 -179.348 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 350' ' ' LEU . . . . . 0.566 HD23 ' C ' ' B' ' 350' ' ' LEU . 7.6 tt -64.44 -49.06 72.94 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.133 -0.979 . . . . 0.45 109.853 -179.631 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 351' ' ' LYS . . . . . . . . . . . . . 67.3 tttt -59.06 -43.41 91.73 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.299 -0.876 . . . . 1.38 109.77 -179.569 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 352' ' ' ASP . . . . . . . . . . . . . 66.7 m-20 -56.25 -50.99 69.75 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.147 -0.971 . . . . 1.16 109.729 -179.902 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 353' ' ' ALA . . . . . . . . . . . . . . . -68.29 -13.98 62.66 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.217 -0.927 . . . . 0.61 109.777 -179.621 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 354' ' ' GLN . . . . . . . . . . . . . 10.5 tt0 . . . . . 0 N--CA 1.49 1.557 0 O-C-N 121.17 -0.956 . . . . 1.45 109.775 -179.871 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' C' C ' 326' ' ' GLU . . . . . 0.489 ' HB2' ' CA ' ' A' ' 334' ' ' GLY . 6.5 mm-40 . . . . . 0 N--CA 1.489 1.516 0 N-CA-C 108.836 -0.802 . . . . 2.17 108.836 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 327' ' ' TYR . . . . . 0.452 ' CE1' ' HG2' ' A' ' 333' ' ' ARG . 37.5 m-85 -149.09 102.94 3.29 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.042 -1.036 . . . . 0.48 110.215 -179.583 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' C' C ' 328' ' ' PHE . . . . . 0.442 ' CE2' ' HB3' ' C' ' 326' ' ' GLU . 90.6 m-85 -112.98 -165.23 0.97 Allowed 'General case' 0 N--CA 1.489 1.478 0 O-C-N 121.48 -0.762 . . . . 0.33 108.966 179.337 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' C' C ' 329' ' ' THR . . . . . 0.436 HG23 ' C ' ' C' ' 328' ' ' PHE . 54.6 p -155.48 156.45 35.27 Favored 'General case' 0 N--CA 1.489 1.492 0 O-C-N 121.085 -1.01 . . . . 0.23 109.437 179.961 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' C' C ' 330' ' ' LEU . . . . . . . . . . . . . 18.1 tp -148.71 120.06 7.87 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.331 -0.856 . . . . 0.28 109.596 -179.671 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 331' ' ' GLN . . . . . 0.45 ' OE1' ' HB3' ' A' ' 327' ' ' TYR . 0.1 OUTLIER -86.98 117.69 25.87 Favored 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.32 -0.863 . . . . 1.48 109.089 179.743 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' C' C ' 332' ' ' ILE . . . . . 0.417 HD12 ' CD1' ' C' ' 338' ' ' PHE . 18.8 mt -103.8 118.68 51.31 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.557 0 O-C-N 121.116 -0.99 . . . . 0.24 109.972 -179.639 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' C' C ' 333' ' ' ARG . . . . . 0.607 ' HG2' ' CE1' ' A' ' 327' ' ' TYR . 4.1 mtp180 -73.25 143.38 47.1 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.384 -0.823 . . . . 2.74 109.309 179.526 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' C' C ' 334' ' ' GLY . . . . . . . . . . . . . . . 86.22 130.78 2.73 Favored Glycine 0 N--CA 1.491 2.365 0 N-CA-C 109.694 -1.363 . . . . 0.35 109.694 179.867 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 335' ' ' ARG . . . . . 0.448 ' O ' ' HB3' ' C' ' 338' ' ' PHE . 0.0 OUTLIER -80.25 -37.91 31.99 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.367 -1.078 . . . . 2.53 109.81 -179.994 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' C' C ' 336' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -56.33 -59.0 5.59 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.222 -0.923 . . . . 2.62 109.521 -179.83 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' C' C ' 337' ' ' ARG . . . . . 0.518 ' HD2' ' N ' ' C' ' 337' ' ' ARG . 18.6 mmm180 -60.95 -30.82 70.46 Favored 'General case' 0 N--CA 1.489 1.482 0 O-C-N 121.247 -0.908 . . . . 2.81 109.241 179.836 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' C' C ' 338' ' ' PHE . . . . . 0.448 ' HB3' ' O ' ' C' ' 335' ' ' ARG . 91.7 t80 -55.03 -54.99 36.0 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.326 -0.859 . . . . 0.4 109.554 179.991 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' C' C ' 339' ' ' GLU . . . . . . . . . . . . . 27.4 mt-10 -51.82 -32.81 33.14 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.313 -0.867 . . . . 2.05 110.055 -179.787 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 340' ' ' MET . . . . . . . . . . . . . 3.3 ttt -63.66 -51.7 63.96 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.073 -1.017 . . . . 0.32 110.067 -179.539 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 341' ' ' PHE . . . . . . . . . . . . . 65.1 m-85 -62.68 -46.48 87.96 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.161 -0.962 . . . . 0.18 110.057 -179.506 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 342' ' ' ARG . . . . . 0.483 ' O ' ' HB3' ' C' ' 345' ' ' ASN . 14.6 ttm180 -49.81 -43.53 48.61 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.2 -0.937 . . . . 2.91 109.965 -179.558 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' C' C ' 343' ' ' GLU . . . . . . . . . . . . . 1.3 tt0 -58.19 -48.53 80.02 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.04 -1.037 . . . . 2.14 109.568 -179.685 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 344' ' ' LEU . . . . . . . . . . . . . 36.7 mt -61.82 -26.58 68.2 Favored 'General case' 0 N--CA 1.488 1.469 0 O-C-N 121.229 -0.919 . . . . 0.22 109.549 -179.977 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 345' ' ' ASN . . . . . 0.483 ' HB3' ' O ' ' C' ' 342' ' ' ARG . 24.0 t-20 -57.15 -62.52 1.7 Allowed 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.219 -0.926 . . . . 1.08 109.659 -179.866 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' C' C ' 346' ' ' GLU . . . . . 0.454 ' O ' ' HB2' ' C' ' 350' ' ' LEU . 2.5 tt0 -62.04 -23.66 66.6 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.209 -0.932 . . . . 2.21 109.768 -179.692 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' C' C ' 347' ' ' ALA . . . . . 0.728 ' HB1' ' HB1' ' D' ' 347' ' ' ALA . . . -62.33 -57.04 12.81 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.194 -0.941 . . . . 0.18 109.865 -179.84 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' C' C ' 348' ' ' LEU . . . . . 0.508 ' N ' ' CD2' ' C' ' 348' ' ' LEU . 3.6 mm? -61.58 -53.46 55.93 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.244 -0.91 . . . . 0.32 110.032 -179.658 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' C' C ' 349' ' ' GLU . . . . . . . . . . . . . 1.5 mt-10 -56.38 -28.83 60.39 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.172 -0.955 . . . . 2.19 109.692 -179.578 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 350' ' ' LEU . . . . . 0.699 ' CD2' HD13 ' D' ' 350' ' ' LEU . 10.3 tt -65.24 -48.78 72.11 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.341 -0.849 . . . . 0.46 109.212 179.821 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' C' C ' 351' ' ' LYS . . . . . . . . . . . . . 31.1 tttm -58.26 -42.83 87.29 Favored 'General case' 0 N--CA 1.488 1.454 0 O-C-N 121.466 -0.771 . . . . 1.35 109.579 -179.782 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 352' ' ' ASP . . . . . . . . . . . . . 5.2 m-20 -61.0 -43.05 99.46 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.288 -0.882 . . . . 1.19 109.712 179.752 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 353' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.493 1.701 0 O-C-N 121.275 -0.891 . . . . 0.57 109.855 -179.483 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' D' D ' 326' ' ' GLU . . . . . . . . . . . . . 6.6 mm-40 . . . . . 0 N--CA 1.49 1.531 0 N-CA-C 109.45 -0.574 . . . . 2.13 109.45 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' D' D ' 327' ' ' TYR . . . . . 0.551 ' CE1' ' HG2' ' B' ' 333' ' ' ARG . 49.4 m-85 -149.25 108.81 3.99 Favored 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.295 -0.878 . . . . 0.47 109.371 179.979 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' D' D ' 328' ' ' PHE . . . . . . . . . . . . . 97.9 m-85 -114.09 -167.15 1.17 Allowed 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.352 -0.842 . . . . 0.3 109.687 -179.808 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' D' D ' 329' ' ' THR . . . . . . . . . . . . . 40.7 p -152.97 164.96 36.99 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.369 -0.832 . . . . 0.22 109.024 179.934 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' D' D ' 330' ' ' LEU . . . . . . . . . . . . . 21.3 tp -151.66 129.53 11.69 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.113 -0.992 . . . . 0.28 110.016 -179.571 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' D' D ' 331' ' ' GLN . . . . . . . . . . . . . 1.7 tp60 -88.27 116.38 26.44 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.266 -0.896 . . . . 0.93 108.97 179.506 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' D' D ' 332' ' ' ILE . . . . . 0.601 HD12 ' CD1' ' D' ' 338' ' ' PHE . 36.2 mt -103.81 109.02 25.91 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.57 0 O-C-N 121.023 -1.048 . . . . 0.25 110.071 -179.634 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' D' D ' 333' ' ' ARG . . . . . 0.477 ' HG2' ' CE1' ' B' ' 327' ' ' TYR . 0.1 OUTLIER -73.87 144.54 45.37 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.306 -0.871 . . . . 2.93 109.142 179.442 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' D' D ' 334' ' ' GLY . . . . . . . . . . . . . . . 82.58 127.91 1.14 Allowed Glycine 0 N--CA 1.492 2.399 0 N-CA-C 109.417 -1.473 . . . . 0.41 109.417 -179.841 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' D' D ' 335' ' ' ARG . . . . . . . . . . . . . 40.4 ttp180 -79.96 -30.29 39.8 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.239 -1.153 . . . . 3.03 110.017 -179.722 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' D' D ' 336' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -55.48 -68.47 0.19 Allowed 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.126 -0.984 . . . . 2.26 109.889 -179.568 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' D' D ' 337' ' ' ARG . . . . . . . . . . . . . 16.3 mmt180 -60.23 -27.9 67.57 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.24 -0.913 . . . . 2.92 109.746 -179.787 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' D' D ' 338' ' ' PHE . . . . . 0.601 ' CD1' HD12 ' D' ' 332' ' ' ILE . 65.6 t80 -55.69 -56.41 20.81 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.174 -0.954 . . . . 0.37 109.638 -179.917 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' D' D ' 339' ' ' GLU . . . . . . . . . . . . . 21.7 mm-40 -51.45 -37.51 49.07 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.245 -0.909 . . . . 1.99 109.865 -179.764 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' D' D ' 340' ' ' MET . . . . . . . . . . . . . 33.6 ttp -64.21 -45.78 86.77 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.164 -0.96 . . . . 0.31 110.162 -179.468 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' D' D ' 341' ' ' PHE . . . . . . . . . . . . . 32.5 m-85 -62.61 -51.18 68.31 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.127 -0.983 . . . . 0.18 110.377 -179.357 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' D' D ' 342' ' ' ARG . . . . . 0.534 ' NH1' ' HG2' ' D' ' 342' ' ' ARG . 4.7 ttt-85 -49.06 -46.12 44.0 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.13 -0.981 . . . . 2.41 110.212 -179.314 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' D' D ' 343' ' ' GLU . . . . . . . . . . . . . 2.0 tt0 -58.4 -43.04 88.41 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.115 -0.991 . . . . 2.35 109.921 -179.481 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' D' D ' 344' ' ' LEU . . . . . . . . . . . . . 39.1 mt -62.59 -38.37 89.87 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.163 -0.961 . . . . 0.19 109.898 -179.675 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' D' D ' 345' ' ' ASN . . . . . . . . . . . . . 46.4 t-20 -57.01 -48.4 78.56 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.231 -0.918 . . . . 1.09 109.667 -179.838 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' D' D ' 346' ' ' GLU . . . . . . . . . . . . . 2.8 tt0 -61.53 -33.99 74.78 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.22 -0.925 . . . . 1.69 109.753 -179.784 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' D' D ' 347' ' ' ALA . . . . . 0.728 ' HB1' ' HB1' ' C' ' 347' ' ' ALA . . . -60.27 -53.64 55.22 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.238 -0.914 . . . . 0.18 110.331 -179.594 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' D' D ' 348' ' ' LEU . . . . . 0.59 HD22 ' N ' ' D' ' 348' ' ' LEU . 4.2 mm? -61.63 -48.63 79.99 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.187 -0.946 . . . . 0.31 110.112 -179.165 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' D' D ' 349' ' ' GLU . . . . . . . . . . . . . 64.5 mm-40 -57.8 -32.78 67.89 Favored 'General case' 0 N--CA 1.492 1.675 0 O-C-N 121.257 -0.902 . . . . 1.95 110.076 -179.296 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' D' D ' 350' ' ' LEU . . . . . 0.699 HD13 ' CD2' ' C' ' 350' ' ' LEU . 7.6 tt -64.48 -49.12 72.64 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.13 -0.981 . . . . 0.43 109.855 -179.697 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' D' D ' 351' ' ' LYS . . . . . . . . . . . . . 66.5 tttt -58.97 -43.1 91.3 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.246 -0.909 . . . . 1.4 109.785 -179.581 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' D' D ' 352' ' ' ASP . . . . . . . . . . . . . 66.7 m-20 -56.58 -51.05 70.1 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.286 -0.884 . . . . 1.17 109.706 -179.848 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' D' D ' 353' ' ' ALA . . . . . . . . . . . . . . . -68.11 -14.01 62.65 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.287 -0.883 . . . . 0.59 109.866 -179.824 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' D' D ' 354' ' ' GLN . . . . . . . . . . . . . 10.5 tt0 . . . . . 0 N--CA 1.492 1.652 0 O-C-N 121.092 -1.005 . . . . 1.44 109.69 -179.867 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 326' ' ' GLU . . . . . . . . . . . . . 11.0 mm-40 . . . . . 0 N--CA 1.488 1.462 0 N-CA-C 109.362 -0.606 . . . . 2.13 109.362 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 327' ' ' TYR . . . . . 0.464 ' CE2' ' HG2' ' C' ' 333' ' ' ARG . 39.5 m-85 -148.7 109.51 4.26 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.244 -0.91 . . . . 0.48 109.732 -179.9 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 328' ' ' PHE . . . . . 0.486 ' CD1' ' N ' ' A' ' 328' ' ' PHE . 5.2 m-85 -113.7 -169.18 1.46 Allowed 'General case' 0 N--CA 1.488 1.473 0 O-C-N 121.401 -0.812 . . . . 0.31 108.969 179.75 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 329' ' ' THR . . . . . 0.426 HG23 ' O ' ' A' ' 328' ' ' PHE . 23.9 p -154.4 171.67 18.95 Favored 'General case' 0 N--CA 1.489 1.476 0 O-C-N 121.041 -1.037 . . . . 0.22 109.605 -179.763 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 330' ' ' LEU . . . . . 0.46 HD21 HD22 ' C' ' 345' ' ' ASN . 29.7 tp -150.49 129.88 12.93 Favored 'General case' 0 N--CA 1.488 1.456 0 O-C-N 121.307 -0.87 . . . . 0.28 109.378 -179.913 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 331' ' ' GLN . . . . . . . . . . . . . 1.6 tp60 -87.27 113.89 23.4 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.19 -0.944 . . . . 0.91 109.511 -179.982 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 332' ' ' ILE . . . . . 1.013 HG21 ' HA ' ' A' ' 338' ' ' PHE . 96.1 mt -103.44 99.97 9.48 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.552 0 O-C-N 121.162 -0.961 . . . . 0.26 109.417 179.902 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 333' ' ' ARG . . . . . . . . . . . . . 25.7 mtt180 -71.85 145.29 48.69 Favored 'General case' 0 N--CA 1.489 1.49 0 O-C-N 121.2 -0.937 . . . . 2.92 109.27 179.756 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 334' ' ' GLY . . . . . . . . . . . . . . . 82.71 121.3 0.68 Allowed Glycine 0 N--CA 1.489 2.181 0 N-CA-C 109.452 -1.459 . . . . 0.4 109.452 -179.854 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 335' ' ' ARG . . . . . 0.544 ' NH1' ' HG3' ' A' ' 335' ' ' ARG . 1.3 ttm-85 -69.18 -29.36 67.33 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.327 -1.102 . . . . 3.01 109.684 -179.844 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 336' ' ' GLU . . . . . . . . . . . . . 21.6 tt0 -59.31 -65.63 0.64 Allowed 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.267 -0.896 . . . . 2.29 109.906 -179.763 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 337' ' ' ARG . . . . . 0.61 ' CB ' ' CZ ' ' A' ' 337' ' ' ARG . 0.4 OUTLIER -59.0 -31.05 68.45 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.223 -0.923 . . . . 2.93 109.289 -179.906 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 338' ' ' PHE . . . . . 1.013 ' HA ' HG21 ' A' ' 332' ' ' ILE . 54.3 t80 -54.47 -58.09 8.8 Favored 'General case' 0 N--CA 1.488 1.469 0 O-C-N 121.409 -0.807 . . . . 0.38 109.695 -179.856 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 339' ' ' GLU . . . . . . . . . . . . . 12.5 mt-10 -51.19 -34.18 30.58 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.204 -0.935 . . . . 1.97 110.146 -179.709 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 340' ' ' MET . . . . . . . . . . . . . 32.3 ttp -63.9 -51.58 63.87 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.14 -0.975 . . . . 0.31 110.27 -179.388 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 341' ' ' PHE . . . . . 0.435 ' CZ ' ' HA ' ' C' ' 345' ' ' ASN . 39.7 m-85 -62.12 -47.67 83.56 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.11 -0.994 . . . . 0.18 110.029 -179.513 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 342' ' ' ARG . . . . . . . . . . . . . 31.4 ttt180 -48.05 -41.83 26.9 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.246 -0.909 . . . . 2.42 109.95 -179.563 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 343' ' ' GLU . . . . . . . . . . . . . 3.2 tt0 -58.72 -48.27 81.74 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.08 -1.013 . . . . 2.35 109.738 -179.643 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 344' ' ' LEU . . . . . . . . . . . . . 80.9 mt -62.29 -31.2 71.75 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.142 -0.974 . . . . 0.18 109.618 -179.853 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 345' ' ' ASN . . . . . . . . . . . . . 17.5 t-20 -57.16 -60.56 3.43 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.296 -0.878 . . . . 1.09 109.802 -179.67 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 346' ' ' GLU . . . . . 0.422 ' O ' ' HB2' ' A' ' 350' ' ' LEU . 24.9 tt0 -62.35 -25.25 67.8 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.316 -0.865 . . . . 1.65 110.15 -179.684 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 347' ' ' ALA . . . . . 0.593 ' HB1' ' HB1' ' B' ' 347' ' ' ALA . . . -60.33 -59.91 4.65 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.195 -0.941 . . . . 0.18 110.17 -179.568 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 348' ' ' LEU . . . . . 0.594 HD22 ' N ' ' A' ' 348' ' ' LEU . 3.8 mm? -61.34 -49.03 78.6 Favored 'General case' 0 N--CA 1.493 1.711 0 O-C-N 121.274 -0.891 . . . . 0.3 109.901 -179.523 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 349' ' ' GLU . . . . . . . . . . . . . 4.5 mm-40 -57.43 -27.62 62.57 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.223 -0.923 . . . . 1.94 109.798 -179.565 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 350' ' ' LEU . . . . . 0.836 ' O ' HD23 ' A' ' 350' ' ' LEU . 2.9 tt -64.49 -43.59 93.66 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.244 -0.91 . . . . 0.46 109.293 -179.984 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 351' ' ' LYS . . . . . . . . . . . . . 33.3 tttt -59.4 -52.94 63.44 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.41 -0.806 . . . . 1.4 109.868 -179.788 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 352' ' ' ASP . . . . . . . . . . . . . 66.9 m-20 -57.17 -38.54 73.74 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.246 -0.909 . . . . 1.16 109.966 -179.594 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 353' ' ' ALA . . . . . . . . . . . . . . . -67.08 -24.67 65.98 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.104 -0.997 . . . . 0.63 109.886 -179.539 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 354' ' ' GLN . . . . . 0.415 ' NE2' HD11 ' B' ' 350' ' ' LEU . 3.8 tt0 . . . . . 0 N--CA 1.491 1.588 0 O-C-N 121.091 -1.005 . . . . 1.47 109.586 -179.854 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 326' ' ' GLU . . . . . . . . . . . . . 10.4 mm-40 . . . . . 0 N--CA 1.489 1.502 0 N-CA-C 109.349 -0.611 . . . . 2.13 109.349 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' B' B ' 327' ' ' TYR . . . . . 0.44 ' CE2' ' HG2' ' D' ' 333' ' ' ARG . 39.8 m-85 -148.62 109.82 4.36 Favored 'General case' 0 N--CA 1.488 1.474 0 O-C-N 121.302 -0.874 . . . . 0.48 109.767 179.987 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 328' ' ' PHE . . . . . 0.485 ' CD1' ' N ' ' B' ' 328' ' ' PHE . 5.5 m-85 -113.73 -168.89 1.41 Allowed 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.293 -0.879 . . . . 0.32 109.057 179.725 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 329' ' ' THR . . . . . 0.484 ' HA ' ' O ' ' D' ' 330' ' ' LEU . 23.5 p -154.46 171.49 19.28 Favored 'General case' 0 N--CA 1.488 1.466 0 O-C-N 121.08 -1.013 . . . . 0.23 109.682 -179.947 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 330' ' ' LEU . . . . . 0.446 ' O ' ' HA ' ' D' ' 329' ' ' THR . 30.1 tp -150.41 129.67 12.82 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.34 -0.85 . . . . 0.28 109.388 -179.95 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 331' ' ' GLN . . . . . . . . . . . . . 1.7 tp60 -87.06 113.86 23.18 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.192 -0.942 . . . . 0.91 109.575 179.917 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 332' ' ' ILE . . . . . 1.018 HG21 ' HA ' ' B' ' 338' ' ' PHE . 96.2 mt -103.31 99.94 9.41 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.581 0 O-C-N 121.142 -0.974 . . . . 0.24 109.385 179.889 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 333' ' ' ARG . . . . . . . . . . . . . 25.9 mtt180 -71.94 145.59 48.34 Favored 'General case' 0 N--CA 1.489 1.482 0 O-C-N 121.263 -0.898 . . . . 2.93 109.203 179.79 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 334' ' ' GLY . . . . . . . . . . . . . . . 82.58 121.15 0.66 Allowed Glycine 0 N--CA 1.49 2.238 0 N-CA-C 109.424 -1.47 . . . . 0.4 109.424 -179.903 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 335' ' ' ARG . . . . . 0.559 ' NH1' ' HG3' ' B' ' 335' ' ' ARG . 1.3 ttm-85 -69.02 -29.57 67.76 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.341 -1.094 . . . . 3.01 109.678 -179.879 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 336' ' ' GLU . . . . . . . . . . . . . 21.3 tt0 -59.2 -65.68 0.63 Allowed 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.275 -0.891 . . . . 2.28 109.871 -179.786 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 337' ' ' ARG . . . . . 0.609 ' CB ' ' CZ ' ' B' ' 337' ' ' ARG . 0.4 OUTLIER -59.11 -30.84 68.41 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.155 -0.966 . . . . 2.93 109.326 -179.884 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' B' B ' 338' ' ' PHE . . . . . 1.018 ' HA ' HG21 ' B' ' 332' ' ' ILE . 53.5 t80 -54.65 -58.06 9.0 Favored 'General case' 0 N--CA 1.488 1.444 0 O-C-N 121.303 -0.873 . . . . 0.37 109.583 -179.797 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 339' ' ' GLU . . . . . . . . . . . . . 12.6 mt-10 -51.27 -34.08 31.22 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.154 -0.966 . . . . 1.98 110.124 -179.691 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 340' ' ' MET . . . . . . . . . . . . . 32.4 ttp -63.88 -51.75 63.11 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.108 -0.995 . . . . 0.32 110.234 -179.397 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 341' ' ' PHE . . . . . . . . . . . . . 39.5 m-85 -61.96 -47.55 84.34 Favored 'General case' 0 N--CA 1.493 1.675 0 O-C-N 121.108 -0.995 . . . . 0.18 110.089 -179.45 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 342' ' ' ARG . . . . . . . . . . . . . 31.5 ttt180 -48.16 -41.77 27.77 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.28 -0.888 . . . . 2.42 110.006 -179.543 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 343' ' ' GLU . . . . . . . . . . . . . 3.2 tt0 -58.73 -48.15 82.17 Favored 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.14 -0.975 . . . . 2.35 109.781 -179.649 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 344' ' ' LEU . . . . . . . . . . . . . 80.5 mt -62.46 -31.21 71.9 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.151 -0.968 . . . . 0.18 109.624 -179.859 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 345' ' ' ASN . . . . . . . . . . . . . 17.7 t-20 -56.98 -60.73 3.14 Favored 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.163 -0.96 . . . . 1.09 109.786 -179.812 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 346' ' ' GLU . . . . . 0.428 ' O ' ' HB2' ' B' ' 350' ' ' LEU . 24.8 tt0 -62.24 -25.27 67.73 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.304 -0.873 . . . . 1.66 110.152 -179.646 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 347' ' ' ALA . . . . . 0.593 ' HB1' ' HB1' ' A' ' 347' ' ' ALA . . . -60.29 -59.97 4.57 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.087 -1.008 . . . . 0.17 110.17 -179.534 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 348' ' ' LEU . . . . . 0.592 HD22 ' N ' ' B' ' 348' ' ' LEU . 3.7 mm? -61.34 -49.02 78.66 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.262 -0.899 . . . . 0.29 109.994 -179.498 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 349' ' ' GLU . . . . . . . . . . . . . 4.5 mm-40 -57.27 -27.94 62.54 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.165 -0.96 . . . . 1.95 109.784 -179.594 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 350' ' ' LEU . . . . . 0.833 ' O ' HD23 ' B' ' 350' ' ' LEU . 2.8 tt -64.28 -43.5 94.61 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.259 -0.901 . . . . 0.45 109.311 -179.989 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 351' ' ' LYS . . . . . . . . . . . . . 33.4 tttt -59.52 -53.13 61.66 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.305 -0.872 . . . . 1.38 109.833 -179.692 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 352' ' ' ASP . . . . . . . . . . . . . 65.9 m-20 -56.97 -38.63 73.27 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.262 -0.899 . . . . 1.16 109.979 -179.733 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 353' ' ' ALA . . . . . . . . . . . . . . . -66.94 -24.86 66.12 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.209 -0.932 . . . . 0.61 109.876 -179.54 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 354' ' ' GLN . . . . . 0.501 ' NE2' HD11 ' A' ' 350' ' ' LEU . 3.7 tt0 . . . . . 0 N--CA 1.492 1.643 0 O-C-N 121.168 -0.958 . . . . 1.45 109.549 -179.889 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 326' ' ' GLU . . . . . . . . . . . . . 66.3 mm-40 . . . . . 0 N--CA 1.487 1.41 0 CA-C-O 121.445 0.64 . . . . 2.17 109.48 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' C' C ' 327' ' ' TYR . . . . . . . . . . . . . 36.2 m-85 -147.47 105.93 3.79 Favored 'General case' 0 C--N 1.302 -1.484 0 O-C-N 121.441 -0.787 . . . . 0.48 109.226 179.661 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 328' ' ' PHE . . . . . 0.408 ' C ' HG23 ' C' ' 329' ' ' THR . 43.3 m-85 -113.35 -171.81 1.95 Allowed 'General case' 0 C--N 1.302 -1.461 0 O-C-N 121.297 -0.877 . . . . 0.33 108.91 179.902 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' C' C ' 329' ' ' THR . . . . . 0.408 HG23 ' C ' ' C' ' 328' ' ' PHE . 19.0 p -152.5 -175.66 5.38 Favored 'General case' 0 C--N 1.302 -1.461 0 O-C-N 121.091 -1.006 . . . . 0.23 109.645 -179.973 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' C' C ' 330' ' ' LEU . . . . . . . . . . . . . 28.1 tp -153.37 128.99 10.03 Favored 'General case' 0 N--CA 1.489 1.492 0 O-C-N 121.331 -0.855 . . . . 0.28 109.557 -179.65 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 331' ' ' GLN . . . . . . . . . . . . . 8.2 tp-100 -89.08 106.49 18.47 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.253 -0.904 . . . . 1.48 109.418 179.759 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 332' ' ' ILE . . . . . . . . . . . . . 68.3 mt -103.55 108.53 24.69 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.557 0 O-C-N 121.193 -0.942 . . . . 0.24 109.813 -179.96 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 333' ' ' ARG . . . . . 0.464 ' HG2' ' CE2' ' A' ' 327' ' ' TYR . 2.1 mpt_? -74.13 156.54 37.27 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.267 -0.895 . . . . 2.74 109.685 179.935 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' C' C ' 334' ' ' GLY . . . . . . . . . . . . . . . 76.93 132.73 0.52 Allowed Glycine 0 N--CA 1.492 2.4 0 N-CA-C 109.9 -1.28 . . . . 0.35 109.9 179.709 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 335' ' ' ARG . . . . . . . . . . . . . 26.4 ttp180 -77.9 -32.83 52.0 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.3 -1.118 . . . . 2.53 109.595 179.947 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 336' ' ' GLU . . . . . . . . . . . . . 1.6 mt-10 -57.05 -59.72 4.65 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.291 -0.88 . . . . 2.62 109.67 -179.707 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 337' ' ' ARG . . . . . 0.549 ' HG2' ' NH1' ' C' ' 337' ' ' ARG . 0.1 OUTLIER -61.23 -35.22 76.63 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.217 -0.927 . . . . 2.81 109.667 -179.742 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' C' C ' 338' ' ' PHE . . . . . . . . . . . . . 51.5 t80 -54.32 -54.86 34.6 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.185 -0.947 . . . . 0.4 109.598 -179.714 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 339' ' ' GLU . . . . . . . . . . . . . 6.9 mt-10 -53.12 -33.39 52.07 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.165 -0.959 . . . . 2.05 109.942 -179.922 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 340' ' ' MET . . . . . . . . . . . . . 25.7 ttp -65.01 -55.35 19.52 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.239 -0.913 . . . . 0.32 110.366 -179.402 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 341' ' ' PHE . . . . . . . . . . . . . 49.7 m-85 -61.39 -35.23 76.93 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.111 -0.993 . . . . 0.18 110.082 -179.231 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 342' ' ' ARG . . . . . . . . . . . . . 10.7 ttt180 -53.33 -49.44 67.06 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.227 -0.92 . . . . 2.91 110.13 -179.807 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 343' ' ' GLU . . . . . . . . . . . . . 2.3 tt0 -59.28 -47.11 86.59 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.214 -0.929 . . . . 2.14 110.289 -179.33 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 344' ' ' LEU . . . . . . . . . . . . . 85.2 mt -60.33 -30.97 69.86 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.065 -1.022 . . . . 0.22 109.641 -179.457 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 345' ' ' ASN . . . . . 0.46 HD22 HD21 ' A' ' 330' ' ' LEU . 19.4 t-20 -59.15 -58.84 6.85 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.266 -0.896 . . . . 1.08 109.928 -179.873 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' C' C ' 346' ' ' GLU . . . . . . . . . . . . . 8.8 tp10 -61.85 -25.5 67.57 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.356 -0.84 . . . . 2.21 110.321 -179.351 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 347' ' ' ALA . . . . . 0.5 ' HB1' ' HB1' ' D' ' 347' ' ' ALA . . . -58.52 -62.46 1.84 Allowed 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.045 -1.035 . . . . 0.18 110.26 -179.355 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' C' C ' 348' ' ' LEU . . . . . 0.632 HD22 ' N ' ' C' ' 348' ' ' LEU . 3.4 mm? -61.34 -42.44 98.69 Favored 'General case' 0 N--CA 1.494 1.761 0 O-C-N 121.181 -0.949 . . . . 0.32 110.014 -179.274 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' C' C ' 349' ' ' GLU . . . . . . . . . . . . . 34.7 mt-10 -57.25 -31.29 65.41 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.109 -0.994 . . . . 2.19 109.709 -179.697 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 350' ' ' LEU . . . . . 0.831 ' O ' HD23 ' C' ' 350' ' ' LEU . 5.8 tt -62.87 -43.59 98.38 Favored 'General case' 0 N--CA 1.488 1.453 0 O-C-N 121.106 -0.996 . . . . 0.46 109.604 179.993 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' C' C ' 351' ' ' LYS . . . . . . . . . . . . . 6.0 tttp -58.79 -44.77 90.79 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.288 -0.883 . . . . 1.35 109.831 -179.808 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 352' ' ' ASP . . . . . . . . . . . . . 81.6 m-20 -54.99 -44.64 74.64 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.083 -1.011 . . . . 1.19 109.945 -179.753 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 353' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 1.536 0 O-C-N 121.1 -1.0 . . . . 0.57 109.84 -179.607 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' D' D ' 326' ' ' GLU . . . . . . . . . . . . . 11.1 mm-40 . . . . . 0 N--CA 1.488 1.445 0 N-CA-C 109.37 -0.604 . . . . 2.13 109.37 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' D' D ' 327' ' ' TYR . . . . . . . . . . . . . 40.1 m-85 -148.55 110.02 4.43 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.225 -0.922 . . . . 0.47 109.721 -179.985 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' D' D ' 328' ' ' PHE . . . . . 0.478 ' CD1' ' N ' ' D' ' 328' ' ' PHE . 5.4 m-85 -113.96 -168.9 1.42 Allowed 'General case' 0 N--CA 1.489 1.483 0 O-C-N 121.345 -0.847 . . . . 0.3 109.064 179.679 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' D' D ' 329' ' ' THR . . . . . 0.446 ' HA ' ' O ' ' B' ' 330' ' ' LEU . 23.8 p -154.45 171.75 18.86 Favored 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.216 -0.928 . . . . 0.22 109.613 -179.88 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' D' D ' 330' ' ' LEU . . . . . 0.484 ' O ' ' HA ' ' B' ' 329' ' ' THR . 29.8 tp -150.65 129.53 12.48 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.299 -0.876 . . . . 0.28 109.369 -179.943 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' D' D ' 331' ' ' GLN . . . . . . . . . . . . . 1.6 tp60 -87.0 113.92 23.17 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.259 -0.901 . . . . 0.93 109.578 179.958 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' D' D ' 332' ' ' ILE . . . . . 1.0 HG21 ' HA ' ' D' ' 338' ' ' PHE . 96.2 mt -103.29 100.03 9.6 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.522 0 O-C-N 121.223 -0.923 . . . . 0.25 109.421 179.882 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' D' D ' 333' ' ' ARG . . . . . 0.44 ' HG2' ' CE2' ' B' ' 327' ' ' TYR . 26.2 mtt180 -71.88 145.61 48.43 Favored 'General case' 0 N--CA 1.488 1.427 0 O-C-N 121.253 -0.905 . . . . 2.93 109.225 179.761 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' D' D ' 334' ' ' GLY . . . . . . . . . . . . . . . 82.75 121.21 0.68 Allowed Glycine 0 N--CA 1.49 2.253 0 N-CA-C 109.518 -1.433 . . . . 0.41 109.518 -179.93 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' D' D ' 335' ' ' ARG . . . . . 0.546 ' NH1' ' HG3' ' D' ' 335' ' ' ARG . 1.3 ttm-85 -69.02 -29.98 68.27 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.324 -1.103 . . . . 3.03 109.613 -179.94 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' D' D ' 336' ' ' GLU . . . . . . . . . . . . . 21.3 tt0 -58.93 -65.57 0.64 Allowed 'General case' 0 N--CA 1.491 1.625 0 O-C-N 121.239 -0.913 . . . . 2.26 109.95 -179.728 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' D' D ' 337' ' ' ARG . . . . . 0.588 ' CZ ' ' CB ' ' D' ' 337' ' ' ARG . 0.4 OUTLIER -59.22 -30.77 68.48 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.172 -0.955 . . . . 2.92 109.355 -179.877 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' D' D ' 338' ' ' PHE . . . . . 1.0 ' HA ' HG21 ' D' ' 332' ' ' ILE . 54.0 t80 -54.61 -58.01 9.19 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.389 -0.819 . . . . 0.37 109.635 -179.951 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' D' D ' 339' ' ' GLU . . . . . . . . . . . . . 12.6 mt-10 -51.37 -34.2 33.17 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.207 -0.933 . . . . 1.99 110.093 -179.636 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' D' D ' 340' ' ' MET . . . . . . . . . . . . . 32.3 ttp -63.79 -51.53 64.38 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.077 -1.015 . . . . 0.31 110.327 -179.5 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' D' D ' 341' ' ' PHE . . . . . . . . . . . . . 39.2 m-85 -62.17 -47.67 83.48 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.128 -0.982 . . . . 0.18 110.043 -179.438 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' D' D ' 342' ' ' ARG . . . . . . . . . . . . . 31.1 ttt180 -47.89 -41.98 25.73 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.286 -0.883 . . . . 2.41 110.042 -179.606 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' D' D ' 343' ' ' GLU . . . . . . . . . . . . . 3.2 tt0 -58.72 -48.07 82.42 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.156 -0.965 . . . . 2.35 109.729 -179.556 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' D' D ' 344' ' ' LEU . . . . . . . . . . . . . 80.2 mt -62.49 -31.29 72.01 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.244 -0.91 . . . . 0.19 109.624 -179.772 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' D' D ' 345' ' ' ASN . . . . . . . . . . . . . 17.4 t-20 -56.91 -60.42 3.6 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.279 -0.888 . . . . 1.09 109.798 -179.775 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' D' D ' 346' ' ' GLU . . . . . 0.43 ' O ' ' HB2' ' D' ' 350' ' ' LEU . 24.8 tt0 -62.69 -25.4 68.13 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.179 -0.95 . . . . 1.69 110.077 -179.55 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' D' D ' 347' ' ' ALA . . . . . 0.5 ' HB1' ' HB1' ' C' ' 347' ' ' ALA . . . -60.18 -59.87 4.72 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.173 -0.954 . . . . 0.18 110.06 -179.518 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' D' D ' 348' ' ' LEU . . . . . 0.603 HD22 ' N ' ' D' ' 348' ' ' LEU . 3.8 mm? -61.44 -49.11 78.16 Favored 'General case' 0 N--CA 1.493 1.722 0 O-C-N 121.248 -0.907 . . . . 0.31 110.02 -179.48 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' D' D ' 349' ' ' GLU . . . . . . . . . . . . . 4.5 mm-40 -57.21 -27.77 62.27 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.186 -0.946 . . . . 1.95 109.77 -179.602 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' D' D ' 350' ' ' LEU . . . . . 0.818 ' O ' HD23 ' D' ' 350' ' ' LEU . 2.7 tt -64.59 -43.52 93.57 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.142 -0.974 . . . . 0.43 109.268 -179.979 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' D' D ' 351' ' ' LYS . . . . . . . . . . . . . 32.9 tttt -59.28 -53.14 61.59 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.3 -0.875 . . . . 1.4 109.913 -179.84 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' D' D ' 352' ' ' ASP . . . . . . . . . . . . . 66.6 m-20 -56.96 -38.65 73.27 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.146 -0.971 . . . . 1.17 110.006 -179.745 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' D' D ' 353' ' ' ALA . . . . . . . . . . . . . . . -66.89 -24.73 66.14 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.144 -0.972 . . . . 0.59 109.917 -179.555 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' D' D ' 354' ' ' GLN . . . . . 0.502 ' NE2' HD11 ' C' ' 350' ' ' LEU . 3.7 tt0 . . . . . 0 N--CA 1.49 1.556 0 O-C-N 121.205 -0.934 . . . . 1.44 109.621 -179.885 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 326' ' ' GLU . . . . . . . . . . . . . 35.5 mm-40 . . . . . 0 N--CA 1.492 1.63 0 N-CA-C 109.241 -0.651 . . . . 2.13 109.241 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 327' ' ' TYR . . . . . 0.462 ' CE1' ' HG2' ' C' ' 333' ' ' ARG . 49.7 m-85 -150.17 111.75 4.48 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.235 -0.916 . . . . 0.48 109.617 -179.892 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 328' ' ' PHE . . . . . 0.439 ' O ' HG23 ' A' ' 329' ' ' THR . 46.2 m-85 -112.56 -170.07 1.6 Allowed 'General case' 0 N--CA 1.488 1.465 0 O-C-N 121.358 -0.839 . . . . 0.31 109.425 179.934 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 329' ' ' THR . . . . . 0.485 ' HA ' ' O ' ' C' ' 330' ' ' LEU . 9.1 p -153.38 175.62 12.93 Favored 'General case' 0 N--CA 1.487 1.416 0 O-C-N 121.203 -0.936 . . . . 0.22 109.404 -179.899 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 330' ' ' LEU . . . . . 0.488 ' O ' ' HA ' ' C' ' 329' ' ' THR . 29.2 tp -151.49 133.46 15.06 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.192 -0.942 . . . . 0.28 109.665 -179.698 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 331' ' ' GLN . . . . . . . . . . . . . 1.9 tp60 -85.64 110.42 19.26 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.365 -0.834 . . . . 0.91 109.222 179.784 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 332' ' ' ILE . . . . . 0.859 HG21 ' HA ' ' A' ' 338' ' ' PHE . 83.0 mt -103.11 103.99 15.94 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.659 0 O-C-N 121.251 -0.906 . . . . 0.26 109.404 -179.772 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 333' ' ' ARG . . . . . 0.468 ' HG2' ' CE1' ' C' ' 327' ' ' TYR . 85.4 mtt180 -73.34 143.88 46.73 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.178 -0.951 . . . . 2.92 109.424 179.891 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 334' ' ' GLY . . . . . . . . . . . . . . . 88.99 131.94 4.24 Favored Glycine 0 N--CA 1.49 2.279 0 N-CA-C 109.636 -1.386 . . . . 0.4 109.636 179.932 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 335' ' ' ARG . . . . . . . . . . . . . 58.7 ttt180 -80.23 -41.19 25.58 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.304 -1.115 . . . . 3.01 109.76 -179.92 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 336' ' ' GLU . . . . . . . . . . . . . 2.4 tt0 -58.49 -59.25 5.66 Favored 'General case' 0 N--CA 1.489 1.492 0 O-C-N 121.179 -0.951 . . . . 2.29 109.685 -179.754 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 337' ' ' ARG . . . . . 0.492 ' NH2' HD12 ' C' ' 348' ' ' LEU . 1.0 OUTLIER -59.43 -33.29 71.06 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.235 -0.916 . . . . 2.93 109.422 179.993 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 338' ' ' PHE . . . . . 0.859 ' HA ' HG21 ' A' ' 332' ' ' ILE . 43.6 t80 -55.51 -56.74 16.8 Favored 'General case' 0 N--CA 1.488 1.425 0 O-C-N 121.219 -0.926 . . . . 0.38 109.456 179.95 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 339' ' ' GLU . . . . . . . . . . . . . 43.4 mt-10 -51.29 -30.9 19.51 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.23 -0.919 . . . . 1.97 109.925 179.979 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 340' ' ' MET . . . . . . . . . . . . . 6.1 ttp -63.34 -53.15 57.05 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.128 -0.983 . . . . 0.31 109.919 -179.505 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 341' ' ' PHE . . . . . . . . . . . . . 40.6 m-85 -62.03 -43.65 98.39 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.208 -0.933 . . . . 0.18 109.719 -179.918 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 342' ' ' ARG . . . . . 0.456 ' NH1' ' CG ' ' A' ' 342' ' ' ARG . 0.0 OUTLIER -49.58 -41.06 40.79 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.178 -0.951 . . . . 2.42 109.562 -179.924 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 343' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -59.68 -47.54 85.21 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.28 -0.887 . . . . 2.35 109.638 -179.816 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 344' ' ' LEU . . . . . . . . . . . . . 53.2 mt -62.24 -31.68 72.27 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.237 -0.914 . . . . 0.18 109.566 -179.81 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 345' ' ' ASN . . . . . . . . . . . . . 10.4 t-20 -57.11 -57.26 13.35 Favored 'General case' 0 N--CA 1.488 1.467 0 O-C-N 121.257 -0.902 . . . . 1.09 109.772 -179.95 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 346' ' ' GLU . . . . . . . . . . . . . 64.9 tt0 -61.74 -26.47 68.08 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.311 -0.868 . . . . 1.65 109.68 -179.851 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 347' ' ' ALA . . . . . 0.572 ' HB1' ' HB1' ' B' ' 347' ' ' ALA . . . -61.82 -61.18 2.69 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.229 -0.919 . . . . 0.18 110.064 -179.59 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 348' ' ' LEU . . . . . 0.564 HD22 ' N ' ' A' ' 348' ' ' LEU . 4.1 mm? -59.79 -44.84 93.75 Favored 'General case' 0 N--CA 1.493 1.725 0 O-C-N 121.137 -0.977 . . . . 0.3 109.825 -179.519 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 349' ' ' GLU . . . . . . . . . . . . . 92.8 mt-10 -57.95 -32.47 67.85 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.196 -0.94 . . . . 1.94 109.901 -179.571 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 350' ' ' LEU . . . . . 0.625 HD22 HD13 ' B' ' 350' ' ' LEU . 5.9 tt -64.03 -45.55 88.38 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.24 -0.913 . . . . 0.46 109.274 -179.894 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 351' ' ' LYS . . . . . . . . . . . . . 85.9 tttt -60.26 -41.57 93.52 Favored 'General case' 0 C--N 1.303 -1.454 0 O-C-N 121.436 -0.79 . . . . 1.4 109.319 179.991 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 352' ' ' ASP . . . . . . . . . . . . . 21.1 m-20 -57.83 -40.91 81.14 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.406 -0.809 . . . . 1.16 109.841 179.922 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 353' ' ' ALA . . . . . . . . . . . . . . . -66.99 -21.2 65.97 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.293 -0.879 . . . . 0.63 109.798 -179.602 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 354' ' ' GLN . . . . . . . . . . . . . 5.6 tt0 . . . . . 0 C--N 1.302 -1.459 0 O-C-N 121.04 -1.038 . . . . 1.47 109.0 179.729 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' B' B ' 326' ' ' GLU . . . . . . . . . . . . . 37.5 mm-40 . . . . . 0 N--CA 1.49 1.554 0 N-CA-C 109.224 -0.658 . . . . 2.13 109.224 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' B' B ' 327' ' ' TYR . . . . . . . . . . . . . 50.4 m-85 -149.85 112.12 4.67 Favored 'General case' 0 N--CA 1.488 1.469 0 O-C-N 121.205 -0.934 . . . . 0.48 109.489 179.91 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 328' ' ' PHE . . . . . 0.431 ' O ' HG23 ' B' ' 329' ' ' THR . 47.6 m-85 -112.73 -170.21 1.62 Allowed 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.401 -0.812 . . . . 0.32 109.216 179.879 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 329' ' ' THR . . . . . 0.431 HG23 ' O ' ' B' ' 328' ' ' PHE . 9.3 p -153.41 175.51 13.06 Favored 'General case' 0 N--CA 1.489 1.485 0 O-C-N 121.282 -0.886 . . . . 0.23 109.315 -179.89 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 330' ' ' LEU . . . . . 0.46 ' O ' ' HA ' ' D' ' 329' ' ' THR . 27.1 tp -151.21 133.92 15.65 Favored 'General case' 0 N--CA 1.488 1.442 0 O-C-N 121.167 -0.958 . . . . 0.28 109.644 -179.761 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 331' ' ' GLN . . . . . . . . . . . . . 1.9 tp60 -85.79 110.18 19.18 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.416 -0.803 . . . . 0.91 109.158 179.839 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 332' ' ' ILE . . . . . 0.852 HG21 ' HA ' ' B' ' 338' ' ' PHE . 83.5 mt -103.07 103.29 14.87 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.668 0 O-C-N 121.249 -0.907 . . . . 0.24 109.72 -179.737 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 333' ' ' ARG . . . . . 0.425 ' HG2' ' CD1' ' D' ' 327' ' ' TYR . 85.0 mtt180 -72.72 143.95 47.84 Favored 'General case' 0 N--CA 1.489 1.481 0 O-C-N 121.252 -0.905 . . . . 2.93 109.492 179.834 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 334' ' ' GLY . . . . . . . . . . . . . . . 89.11 132.13 4.36 Favored Glycine 0 N--CA 1.492 2.377 0 N-CA-C 109.561 -1.415 . . . . 0.4 109.561 -179.95 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 335' ' ' ARG . . . . . . . . . . . . . 58.4 ttt180 -80.31 -41.7 24.39 Favored 'General case' 0 N--CA 1.489 1.481 0 O-C-N 121.221 -1.164 . . . . 3.01 109.53 -179.99 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 336' ' ' GLU . . . . . . . . . . . . . 2.5 tt0 -58.0 -59.68 4.9 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.27 -0.894 . . . . 2.28 109.685 -179.823 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 337' ' ' ARG . . . . . 0.609 ' CZ ' HD12 ' D' ' 348' ' ' LEU . 1.0 OUTLIER -58.86 -33.59 70.63 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.148 -0.97 . . . . 2.93 109.395 -179.872 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' B' B ' 338' ' ' PHE . . . . . 0.852 ' HA ' HG21 ' B' ' 332' ' ' ILE . 45.8 t80 -55.14 -56.72 16.75 Favored 'General case' 0 N--CA 1.487 1.397 0 O-C-N 121.324 -0.86 . . . . 0.37 109.623 179.963 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 339' ' ' GLU . . . . . . . . . . . . . 44.7 mt-10 -51.58 -30.46 20.98 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.205 -0.934 . . . . 1.98 109.984 -179.98 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 340' ' ' MET . . . . . . . . . . . . . 5.8 ttp -63.55 -53.71 47.51 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.177 -0.952 . . . . 0.32 109.784 -179.461 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 341' ' ' PHE . . . . . . . . . . . . . 39.8 m-85 -61.76 -43.84 98.06 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.282 -0.886 . . . . 0.18 109.637 -179.812 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 342' ' ' ARG . . . . . 0.449 ' CG ' HH11 ' B' ' 342' ' ' ARG . 0.1 OUTLIER -49.02 -41.7 35.62 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.258 -0.901 . . . . 2.42 109.711 -179.948 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' B' B ' 343' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -58.98 -48.69 80.66 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.266 -0.896 . . . . 2.35 109.599 -179.987 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 344' ' ' LEU . . . . . . . . . . . . . 59.6 mt -61.12 -31.18 70.89 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.253 -0.904 . . . . 0.18 109.807 -179.753 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 345' ' ' ASN . . . . . . . . . . . . . 10.5 t-20 -57.95 -56.91 15.92 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.192 -0.943 . . . . 1.09 109.681 -179.833 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 346' ' ' GLU . . . . . . . . . . . . . 62.4 tt0 -62.02 -26.38 68.2 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.226 -0.921 . . . . 1.66 109.572 -179.768 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 347' ' ' ALA . . . . . 0.572 ' HB1' ' HB1' ' A' ' 347' ' ' ALA . . . -61.86 -60.62 3.38 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.192 -0.943 . . . . 0.17 110.202 -179.687 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 348' ' ' LEU . . . . . 0.954 HD12 ' NH2' ' D' ' 337' ' ' ARG . 4.2 mm? -60.27 -45.16 94.27 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.045 -1.034 . . . . 0.29 109.683 -179.441 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 349' ' ' GLU . . . . . . . . . . . . . 93.2 mt-10 -57.34 -33.36 67.67 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.386 -0.821 . . . . 1.95 109.863 -179.649 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 350' ' ' LEU . . . . . 0.625 HD13 HD22 ' A' ' 350' ' ' LEU . 5.9 tt -63.13 -46.63 86.36 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.122 -0.986 . . . . 0.45 109.167 179.988 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 351' ' ' LYS . . . . . . . . . . . . . 87.5 tttt -59.23 -41.41 88.64 Favored 'General case' 0 N--CA 1.488 1.462 0 O-C-N 121.244 -0.91 . . . . 1.38 109.455 179.856 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 352' ' ' ASP . . . . . . . . . . . . . 21.1 m-20 -58.11 -40.99 82.59 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.095 -1.003 . . . . 1.16 110.06 -179.874 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 353' ' ' ALA . . . . . . . . . . . . . . . -66.48 -21.98 66.19 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.251 -0.905 . . . . 0.61 109.66 -179.64 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 354' ' ' GLN . . . . . . . . . . . . . 5.5 tt0 . . . . . 0 N--CA 1.492 1.627 0 O-C-N 121.205 -0.934 . . . . 1.45 109.241 179.853 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' C' C ' 326' ' ' GLU . . . . . . . . . . . . . 45.0 mt-10 . . . . . 0 N--CA 1.491 1.595 0 CA-C-O 121.308 0.575 . . . . 2.17 109.763 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' C' C ' 327' ' ' TYR . . . . . 0.468 ' CE1' ' HG2' ' A' ' 333' ' ' ARG . 59.1 m-85 -150.77 108.04 3.61 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.39 -0.819 . . . . 0.48 109.507 -179.905 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' C' C ' 328' ' ' PHE . . . . . 0.411 ' C ' HG23 ' C' ' 329' ' ' THR . 67.3 m-85 -104.12 -164.02 1.02 Allowed 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.201 -0.937 . . . . 0.33 109.825 -179.885 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' C' C ' 329' ' ' THR . . . . . 0.488 ' HA ' ' O ' ' A' ' 330' ' ' LEU . 56.1 p -156.28 177.8 11.03 Favored 'General case' 0 N--CA 1.491 1.589 0 N-CA-C 108.997 -0.742 . . . . 0.23 108.997 179.748 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' C' C ' 330' ' ' LEU . . . . . 0.485 ' O ' ' HA ' ' A' ' 329' ' ' THR . 39.3 tp -153.48 132.09 12.23 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 120.949 -1.095 . . . . 0.28 109.492 179.823 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' C' C ' 331' ' ' GLN . . . . . . . . . . . . . 1.1 tp60 -87.56 114.04 23.81 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.133 -0.979 . . . . 1.48 109.547 179.791 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 332' ' ' ILE . . . . . 0.762 HG21 ' HA ' ' C' ' 338' ' ' PHE . 48.5 mt -103.91 108.28 24.23 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.526 0 O-C-N 121.197 -0.939 . . . . 0.24 109.728 -179.933 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' C' C ' 333' ' ' ARG . . . . . 0.462 ' HG2' ' CE1' ' A' ' 327' ' ' TYR . 5.1 mtp180 -72.89 144.98 47.18 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.006 -1.058 . . . . 2.74 109.488 179.848 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' C' C ' 334' ' ' GLY . . . . . . . . . . . . . . . 73.05 130.92 0.15 Allowed Glycine 0 N--CA 1.491 2.322 0 N-CA-C 109.93 -1.268 . . . . 0.35 109.93 179.794 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 335' ' ' ARG . . . . . 0.49 ' O ' ' HB3' ' C' ' 338' ' ' PHE . 2.4 ttp180 -73.45 -27.77 61.6 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.238 -1.154 . . . . 2.53 109.667 179.922 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' C' C ' 336' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -57.08 -58.82 6.52 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 120.961 -1.087 . . . . 2.62 109.158 -179.987 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' C' C ' 337' ' ' ARG . . . . . 0.555 ' HG3' ' NH1' ' C' ' 337' ' ' ARG . 0.5 OUTLIER -60.95 -30.83 70.47 Favored 'General case' 0 N--CA 1.488 1.474 0 O-C-N 121.296 -0.877 . . . . 2.81 108.776 179.618 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' C' C ' 338' ' ' PHE . . . . . 0.762 ' HA ' HG21 ' C' ' 332' ' ' ILE . 82.6 t80 -54.89 -58.66 6.68 Favored 'General case' 0 C--N 1.304 -1.378 0 O-C-N 121.345 -0.847 . . . . 0.4 109.646 -179.835 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' C' C ' 339' ' ' GLU . . . . . . . . . . . . . 41.2 mt-10 -50.97 -32.63 21.62 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.07 -1.018 . . . . 2.05 109.989 -179.657 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 340' ' ' MET . . . . . . . . . . . . . 29.8 ttp -65.37 -56.24 13.71 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.242 -0.911 . . . . 0.32 110.208 -179.472 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 341' ' ' PHE . . . . . . . . . . . . . 63.9 m-85 -61.44 -53.51 55.53 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.091 -1.006 . . . . 0.18 110.155 -179.416 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 342' ' ' ARG . . . . . 0.438 ' NH1' ' CG ' ' C' ' 342' ' ' ARG . 0.0 OUTLIER -44.8 -41.15 6.73 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.255 -0.903 . . . . 2.91 110.051 -179.265 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' C' C ' 343' ' ' GLU . . . . . . . . . . . . . 36.6 tt0 -57.89 -51.42 69.67 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.162 -0.961 . . . . 2.14 109.77 -179.91 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 344' ' ' LEU . . . . . . . . . . . . . 55.8 mt -62.73 -26.87 68.9 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.329 -0.857 . . . . 0.22 109.7 179.983 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 345' ' ' ASN . . . . . . . . . . . . . 13.2 t-20 -58.0 -58.54 7.96 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.281 -0.887 . . . . 1.08 109.501 -179.957 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 346' ' ' GLU . . . . . . . . . . . . . 10.0 tp10 -62.2 -28.88 69.99 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.456 -0.778 . . . . 2.21 109.722 -179.667 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 347' ' ' ALA . . . . . 0.675 ' HB1' ' HB1' ' D' ' 347' ' ' ALA . . . -60.7 -57.79 11.21 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.103 -0.998 . . . . 0.18 109.984 -179.72 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' C' C ' 348' ' ' LEU . . . . . 0.526 HD22 ' N ' ' C' ' 348' ' ' LEU . 3.5 mm? -62.5 -45.8 91.35 Favored 'General case' 0 N--CA 1.494 1.761 0 O-C-N 121.096 -1.002 . . . . 0.32 110.044 -179.494 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' C' C ' 349' ' ' GLU . . . . . . . . . . . . . 1.3 mm-40 -55.02 -36.02 65.04 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.276 -0.89 . . . . 2.19 109.886 -179.223 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 350' ' ' LEU . . . . . 0.598 HD22 HD13 ' D' ' 350' ' ' LEU . 7.0 tt -63.46 -46.88 84.22 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.355 -0.841 . . . . 0.46 109.894 -179.632 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' C' C ' 351' ' ' LYS . . . . . . . . . . . . . 22.8 tttt -58.32 -40.24 81.55 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.355 -0.841 . . . . 1.35 109.672 -179.66 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 352' ' ' ASP . . . . . . . . . . . . . 52.0 m-20 -57.12 -51.69 68.29 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.361 -0.837 . . . . 1.19 109.925 179.993 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 353' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 1.538 0 O-C-N 121.154 -0.966 . . . . 0.57 109.923 -179.233 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' D' D ' 326' ' ' GLU . . . . . . . . . . . . . 38.1 mm-40 . . . . . 0 N--CA 1.491 1.575 0 N-CA-C 109.237 -0.653 . . . . 2.13 109.237 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' D' D ' 327' ' ' TYR . . . . . 0.425 ' CD1' ' HG2' ' B' ' 333' ' ' ARG . 49.0 m-85 -149.67 111.92 4.67 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.22 -0.925 . . . . 0.47 109.553 179.977 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' D' D ' 328' ' ' PHE . . . . . 0.422 ' O ' HG23 ' D' ' 329' ' ' THR . 50.6 m-85 -112.12 -170.12 1.6 Allowed 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.265 -0.897 . . . . 0.3 109.206 179.856 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' D' D ' 329' ' ' THR . . . . . 0.46 ' HA ' ' O ' ' B' ' 330' ' ' LEU . 9.8 p -153.2 175.7 12.76 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.231 -0.918 . . . . 0.22 109.147 -179.85 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' D' D ' 330' ' ' LEU . . . . . . . . . . . . . 26.0 tp -151.63 134.03 15.35 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.116 -0.99 . . . . 0.28 109.631 -179.762 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' D' D ' 331' ' ' GLN . . . . . . . . . . . . . 1.9 tp60 -85.81 110.28 19.26 Favored 'General case' 0 N--CA 1.488 1.454 0 O-C-N 121.248 -0.907 . . . . 0.93 109.31 179.88 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' D' D ' 332' ' ' ILE . . . . . 0.853 HG21 ' HA ' ' D' ' 338' ' ' PHE . 86.1 mt -102.85 103.37 14.97 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.573 0 O-C-N 121.226 -0.921 . . . . 0.25 109.541 -179.819 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' D' D ' 333' ' ' ARG . . . . . . . . . . . . . 84.9 mtt180 -73.09 143.31 47.44 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.25 -0.906 . . . . 2.93 109.498 179.81 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' D' D ' 334' ' ' GLY . . . . . . . . . . . . . . . 89.16 131.65 4.22 Favored Glycine 0 N--CA 1.49 2.278 0 N-CA-C 109.49 -1.444 . . . . 0.41 109.49 -179.907 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' D' D ' 335' ' ' ARG . . . . . . . . . . . . . 55.9 ttt180 -79.77 -41.71 26.01 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.352 -1.087 . . . . 3.03 109.835 -179.672 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' D' D ' 336' ' ' GLU . . . . . . . . . . . . . 2.8 tt0 -58.26 -58.73 7.19 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.25 -0.906 . . . . 2.26 109.736 -179.724 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' D' D ' 337' ' ' ARG . . . . . 0.954 ' NH2' HD12 ' B' ' 348' ' ' LEU . 0.9 OUTLIER -59.75 -33.25 71.42 Favored 'General case' 0 N--CA 1.489 1.478 0 O-C-N 121.28 -0.887 . . . . 2.92 109.354 -179.965 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' D' D ' 338' ' ' PHE . . . . . 0.853 ' HA ' HG21 ' D' ' 332' ' ' ILE . 45.7 t80 -55.5 -57.03 13.57 Favored 'General case' 0 N--CA 1.489 1.478 0 O-C-N 121.22 -0.925 . . . . 0.37 109.435 179.978 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' D' D ' 339' ' ' GLU . . . . . . . . . . . . . 45.3 mt-10 -51.25 -31.37 20.69 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.229 -0.919 . . . . 1.99 109.726 -179.856 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' D' D ' 340' ' ' MET . . . . . . . . . . . . . 5.3 ttp -62.59 -53.96 46.8 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.223 -0.923 . . . . 0.31 109.859 -179.576 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' D' D ' 341' ' ' PHE . . . . . . . . . . . . . 40.2 m-85 -61.74 -43.38 98.97 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.145 -0.972 . . . . 0.18 109.692 -179.727 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' D' D ' 342' ' ' ARG . . . . . 0.441 ' CG ' HH11 ' D' ' 342' ' ' ARG . 0.1 OUTLIER -49.51 -41.13 40.14 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.268 -0.895 . . . . 2.41 109.608 -179.789 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' D' D ' 343' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -59.36 -48.0 83.3 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.293 -0.88 . . . . 2.35 109.647 -179.862 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' D' D ' 344' ' ' LEU . . . . . . . . . . . . . 57.4 mt -61.99 -30.94 71.28 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.171 -0.956 . . . . 0.19 109.815 -179.777 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' D' D ' 345' ' ' ASN . . . . . . . . . . . . . 10.6 t-20 -57.91 -57.4 12.98 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.157 -0.964 . . . . 1.09 109.559 -179.913 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' D' D ' 346' ' ' GLU . . . . . . . . . . . . . 60.3 tt0 -61.55 -26.63 68.07 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.104 -0.997 . . . . 1.69 109.543 -179.854 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' D' D ' 347' ' ' ALA . . . . . 0.675 ' HB1' ' HB1' ' C' ' 347' ' ' ALA . . . -60.94 -61.58 2.48 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.137 -0.977 . . . . 0.18 110.136 -179.784 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' D' D ' 348' ' ' LEU . . . . . 0.609 HD12 ' CZ ' ' B' ' 337' ' ' ARG . 4.2 mm? -60.03 -44.13 94.83 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.164 -0.96 . . . . 0.31 109.946 -179.495 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' D' D ' 349' ' ' GLU . . . . . . . . . . . . . 92.8 mt-10 -58.08 -33.1 68.7 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.067 -1.02 . . . . 1.95 109.851 -179.542 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' D' D ' 350' ' ' LEU . . . . . 0.598 HD13 HD22 ' C' ' 350' ' ' LEU . 5.9 tt -63.52 -45.99 88.08 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.201 -0.937 . . . . 0.43 109.352 -179.975 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' D' D ' 351' ' ' LYS . . . . . . . . . . . . . 88.1 tttt -59.68 -41.61 91.08 Favored 'General case' 0 N--CA 1.488 1.456 0 O-C-N 121.298 -0.876 . . . . 1.4 109.383 179.957 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' D' D ' 352' ' ' ASP . . . . . . . . . . . . . 20.9 m-20 -58.17 -40.42 81.41 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.399 -0.813 . . . . 1.17 109.881 179.955 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' D' D ' 353' ' ' ALA . . . . . . . . . . . . . . . -67.56 -20.86 65.45 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.203 -0.936 . . . . 0.59 109.602 -179.39 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' D' D ' 354' ' ' GLN . . . . . . . . . . . . . 5.6 tt0 . . . . . 0 N--CA 1.49 1.55 0 O-C-N 121.1 -1.0 . . . . 1.44 109.169 179.708 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 326' ' ' GLU . . . . . . . . . . . . . 2.9 mm-40 . . . . . 0 N--CA 1.49 1.566 0 N-CA-C 109.343 -0.614 . . . . 2.13 109.343 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 327' ' ' TYR . . . . . . . . . . . . . 44.0 m-85 -149.61 112.21 4.76 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.24 -0.912 . . . . 0.48 109.643 179.994 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 328' ' ' PHE . . . . . 0.496 ' CE2' ' HB2' ' C' ' 335' ' ' ARG . 95.9 m-85 -114.26 -168.07 1.31 Allowed 'General case' 0 N--CA 1.488 1.465 0 O-C-N 121.236 -0.915 . . . . 0.31 109.316 179.957 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 329' ' ' THR . . . . . . . . . . . . . 40.2 p -152.77 162.14 41.65 Favored 'General case' 0 N--CA 1.489 1.482 0 O-C-N 121.284 -0.885 . . . . 0.22 109.575 179.927 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 330' ' ' LEU . . . . . 0.54 HD21 ' HB2' ' C' ' 345' ' ' ASN . 18.4 tp -150.58 130.52 13.38 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.375 -0.828 . . . . 0.28 109.433 -179.958 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 331' ' ' GLN . . . . . 0.418 ' HG3' ' O ' ' C' ' 328' ' ' PHE . 1.5 tt0 -86.81 118.38 26.17 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.265 -0.897 . . . . 0.91 109.439 179.903 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 332' ' ' ILE . . . . . 0.584 HD12 ' CD1' ' A' ' 338' ' ' PHE . 9.9 mt -103.46 110.6 30.39 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.527 0 O-C-N 121.286 -0.884 . . . . 0.26 109.673 179.988 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 333' ' ' ARG . . . . . 0.572 ' HG2' ' CE2' ' C' ' 327' ' ' TYR . 44.7 mtt180 -72.92 149.31 43.52 Favored 'General case' 0 C--N 1.303 -1.448 0 O-C-N 121.373 -0.83 . . . . 2.92 109.238 179.728 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 334' ' ' GLY . . . . . . . . . . . . . . . 85.65 129.65 2.29 Favored Glycine 0 N--CA 1.49 2.251 0 N-CA-C 109.619 -1.392 . . . . 0.4 109.619 -179.982 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 335' ' ' ARG . . . . . 0.44 ' O ' ' HB3' ' A' ' 338' ' ' PHE . 31.5 ttp180 -78.92 -44.52 22.45 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.361 -1.082 . . . . 3.01 109.758 -179.92 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 336' ' ' GLU . . . . . . . . . . . . . 1.3 tt0 -58.7 -57.34 13.45 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.231 -0.918 . . . . 2.29 109.717 -179.743 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 337' ' ' ARG . . . . . 0.455 ' NH1' ' CG ' ' A' ' 337' ' ' ARG . 0.0 OUTLIER -59.21 -31.3 68.91 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.278 -0.889 . . . . 2.93 109.523 -179.83 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 338' ' ' PHE . . . . . 0.584 ' CD1' HD12 ' A' ' 332' ' ' ILE . 60.2 t80 -54.74 -55.86 25.42 Favored 'General case' 0 N--CA 1.489 1.48 0 O-C-N 121.114 -0.991 . . . . 0.38 109.442 179.993 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 339' ' ' GLU . . . . . . . . . . . . . 13.7 mt-10 -51.41 -35.31 38.58 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.196 -0.94 . . . . 1.97 109.903 -179.798 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 340' ' ' MET . . . . . . . . . . . . . 26.2 ttp -63.11 -50.04 72.06 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.222 -0.923 . . . . 0.31 110.068 -179.474 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 341' ' ' PHE . . . . . 0.482 ' HZ ' HD23 ' C' ' 348' ' ' LEU . 41.1 m-85 -61.21 -46.16 91.6 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.12 -0.988 . . . . 0.18 109.561 -179.806 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 342' ' ' ARG . . . . . 0.47 ' NH1' ' CG ' ' A' ' 342' ' ' ARG . 0.0 OUTLIER -51.03 -37.55 45.95 Favored 'General case' 0 C--N 1.301 -1.506 0 O-C-N 121.278 -0.889 . . . . 2.42 109.627 -179.933 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 343' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -59.49 -51.7 68.74 Favored 'General case' 0 N--CA 1.489 1.483 0 O-C-N 121.257 -0.902 . . . . 2.35 109.694 -179.488 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 344' ' ' LEU . . . . . 0.941 HD22 HD22 ' B' ' 344' ' ' LEU . 53.6 mt -60.9 -33.78 73.65 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.308 -0.87 . . . . 0.18 109.375 179.984 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 345' ' ' ASN . . . . . 0.666 ' HB2' HD21 ' C' ' 330' ' ' LEU . 28.5 t-20 -57.95 -56.31 23.6 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.233 -0.917 . . . . 1.09 109.802 -179.984 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 346' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -61.39 -32.79 72.73 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.278 -0.889 . . . . 1.65 110.034 -179.56 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 347' ' ' ALA . . . . . 0.627 ' HB1' ' HB1' ' B' ' 347' ' ' ALA . . . -58.75 -55.1 39.41 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.061 -1.024 . . . . 0.18 109.948 -179.773 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 348' ' ' LEU . . . . . 0.536 HD22 ' N ' ' A' ' 348' ' ' LEU . 4.1 mm? -60.61 -46.45 90.21 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.125 -0.985 . . . . 0.3 109.594 -179.717 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 349' ' ' GLU . . . . . 0.491 ' HG2' ' NH1' ' C' ' 333' ' ' ARG . 1.7 mt-10 -58.11 -29.87 65.83 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.128 -0.982 . . . . 1.94 110.02 -179.648 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 350' ' ' LEU . . . . . 0.629 ' C ' HD23 ' A' ' 350' ' ' LEU . 6.4 tt -64.09 -48.98 74.06 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.028 -1.045 . . . . 0.46 109.173 179.774 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 351' ' ' LYS . . . . . . . . . . . . . 19.3 tttt -58.98 -41.79 88.45 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.421 -0.799 . . . . 1.4 109.447 179.833 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 352' ' ' ASP . . . . . . . . . . . . . 15.1 m-20 -56.7 -39.23 73.48 Favored 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.399 -0.813 . . . . 1.16 109.537 -179.947 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 353' ' ' ALA . . . . . . . . . . . . . . . -66.73 -32.63 74.05 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.294 -0.879 . . . . 0.63 109.611 -179.875 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 354' ' ' GLN . . . . . . . . . . . . . 7.2 tt0 . . . . . 0 C--N 1.303 -1.451 0 O-C-N 121.23 -0.919 . . . . 1.47 109.629 -179.989 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' B' B ' 326' ' ' GLU . . . . . . . . . . . . . 3.0 mm-40 . . . . . 0 N--CA 1.49 1.537 0 N-CA-C 109.372 -0.603 . . . . 2.13 109.372 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' B' B ' 327' ' ' TYR . . . . . 0.562 ' CE1' ' HG2' ' D' ' 333' ' ' ARG . 42.7 m-85 -149.1 111.57 4.73 Favored 'General case' 0 N--CA 1.488 1.458 0 O-C-N 121.254 -0.904 . . . . 0.48 109.62 -179.834 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 328' ' ' PHE . . . . . 0.542 ' CE2' ' HA ' ' D' ' 335' ' ' ARG . 95.3 m-85 -113.72 -167.65 1.23 Allowed 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.245 -0.909 . . . . 0.32 109.415 179.904 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 329' ' ' THR . . . . . . . . . . . . . 38.9 p -153.5 161.35 42.33 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.174 -0.954 . . . . 0.23 109.601 -179.642 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 330' ' ' LEU . . . . . 0.625 HD21 ' HB2' ' D' ' 345' ' ' ASN . 16.3 tp -150.41 131.46 14.36 Favored 'General case' 0 N--CA 1.488 1.432 0 O-C-N 121.235 -0.916 . . . . 0.28 109.249 179.932 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 331' ' ' GLN . . . . . . . . . . . . . 1.5 tt0 -87.25 118.58 26.77 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.368 -0.832 . . . . 0.91 109.495 -179.917 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 332' ' ' ILE . . . . . 0.576 HD12 ' CD1' ' B' ' 338' ' ' PHE . 10.8 mt -103.59 110.14 29.13 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.496 0 O-C-N 121.166 -0.959 . . . . 0.24 109.7 -179.798 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 333' ' ' ARG . . . . . 0.499 ' HG2' ' CE1' ' D' ' 327' ' ' TYR . 46.6 mtt180 -72.65 148.81 44.42 Favored 'General case' 0 N--CA 1.487 1.381 0 O-C-N 121.19 -0.944 . . . . 2.93 109.323 179.585 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 334' ' ' GLY . . . . . . . . . . . . . . . 86.17 129.4 2.43 Favored Glycine 0 N--CA 1.49 2.277 0 N-CA-C 109.553 -1.419 . . . . 0.4 109.553 179.848 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 335' ' ' ARG . . . . . 0.463 ' O ' ' HB3' ' B' ' 338' ' ' PHE . 31.8 ttp180 -78.5 -45.11 22.78 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.242 -1.152 . . . . 3.01 110.016 -179.844 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 336' ' ' GLU . . . . . . . . . . . . . 1.3 tt0 -58.45 -56.86 16.66 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.153 -0.967 . . . . 2.28 109.651 -179.706 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 337' ' ' ARG . . . . . 0.434 ' CG ' HH11 ' B' ' 337' ' ' ARG . 0.0 OUTLIER -59.09 -31.4 68.87 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.294 -0.879 . . . . 2.93 109.544 -179.793 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' B' B ' 338' ' ' PHE . . . . . 0.576 ' CD1' HD12 ' B' ' 332' ' ' ILE . 60.9 t80 -55.02 -55.82 26.62 Favored 'General case' 0 N--CA 1.488 1.441 0 O-C-N 121.33 -0.856 . . . . 0.37 109.417 179.971 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 339' ' ' GLU . . . . . . . . . . . . . 15.4 mt-10 -51.74 -34.96 41.53 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.333 -0.855 . . . . 1.98 109.789 -179.882 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 340' ' ' MET . . . . . . . . . . . . . 28.8 ttp -63.2 -50.57 69.78 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.105 -0.997 . . . . 0.32 109.909 -179.641 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 341' ' ' PHE . . . . . 0.458 ' HB2' HD13 ' B' ' 332' ' ' ILE . 42.7 m-85 -60.62 -46.32 90.72 Favored 'General case' 0 N--CA 1.494 1.725 0 O-C-N 121.079 -1.013 . . . . 0.18 109.842 -179.906 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 342' ' ' ARG . . . . . 0.465 ' NH1' ' CG ' ' B' ' 342' ' ' ARG . 0.0 OUTLIER -50.86 -38.07 47.13 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.219 -0.926 . . . . 2.42 109.651 -179.862 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' B' B ' 343' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -58.8 -51.83 68.32 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.239 -0.913 . . . . 2.35 109.76 -179.823 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 344' ' ' LEU . . . . . 0.941 HD22 HD22 ' A' ' 344' ' ' LEU . 52.6 mt -61.39 -32.94 72.88 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.182 -0.949 . . . . 0.18 109.53 -179.839 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 345' ' ' ASN . . . . . 0.517 ' HB2' HD21 ' D' ' 330' ' ' LEU . 28.8 t-20 -58.48 -56.58 20.23 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.301 -0.874 . . . . 1.09 109.573 -179.996 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 346' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -61.31 -32.12 71.97 Favored 'General case' 0 C--N 1.301 -1.54 0 O-C-N 121.417 -0.802 . . . . 1.66 110.086 -179.52 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 347' ' ' ALA . . . . . 0.627 ' HB1' ' HB1' ' A' ' 347' ' ' ALA . . . -59.15 -55.18 38.32 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.246 -0.909 . . . . 0.17 109.914 -179.577 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 348' ' ' LEU . . . . . 0.528 HD22 ' N ' ' B' ' 348' ' ' LEU . 4.1 mm? -60.61 -45.71 93.0 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.252 -0.905 . . . . 0.29 109.856 -179.717 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 349' ' ' GLU . . . . . . . . . . . . . 1.8 mt-10 -58.74 -29.84 67.04 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.137 -0.977 . . . . 1.95 109.762 -179.482 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 350' ' ' LEU . . . . . 0.602 HD23 ' C ' ' B' ' 350' ' ' LEU . 6.4 tt -64.11 -48.87 74.42 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.26 -0.9 . . . . 0.45 109.159 179.651 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 351' ' ' LYS . . . . . . . . . . . . . 19.4 tttt -59.54 -41.67 90.59 Favored 'General case' 0 C--N 1.302 -1.462 0 O-C-N 121.348 -0.845 . . . . 1.38 109.437 179.966 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 352' ' ' ASP . . . . . . . . . . . . . 16.7 m-20 -56.55 -39.13 72.91 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.217 -0.927 . . . . 1.16 109.515 179.8 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 353' ' ' ALA . . . . . . . . . . . . . . . -66.76 -33.31 75.35 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.253 -0.904 . . . . 0.61 109.759 -179.91 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 354' ' ' GLN . . . . . . . . . . . . . 7.4 tt0 . . . . . 0 N--CA 1.489 1.484 0 O-C-N 121.239 -0.913 . . . . 1.45 109.491 179.927 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' C' C ' 326' ' ' GLU . . . . . . . . . . . . . 16.1 mm-40 . . . . . 0 N--CA 1.488 1.458 0 CA-C-O 121.227 0.537 . . . . 2.17 109.56 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' C' C ' 327' ' ' TYR . . . . . 0.572 ' CE2' ' HG2' ' A' ' 333' ' ' ARG . 46.4 m-85 -148.89 111.85 4.87 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.269 -0.895 . . . . 0.48 109.799 -179.978 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' C' C ' 328' ' ' PHE . . . . . 0.449 ' O ' HG23 ' C' ' 329' ' ' THR . 93.5 m-85 -111.12 -167.03 1.13 Allowed 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.236 -0.915 . . . . 0.33 109.538 -179.924 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' C' C ' 329' ' ' THR . . . . . 0.449 HG23 ' O ' ' C' ' 328' ' ' PHE . 10.8 p -154.11 167.53 29.53 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.283 -0.886 . . . . 0.23 109.705 -179.434 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' C' C ' 330' ' ' LEU . . . . . 0.666 HD21 ' HB2' ' A' ' 345' ' ' ASN . 20.2 tp -152.5 132.06 13.04 Favored 'General case' 0 N--CA 1.489 1.525 0 O-C-N 121.15 -0.969 . . . . 0.28 109.89 179.886 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' C' C ' 331' ' ' GLN . . . . . . . . . . . . . 1.2 tt0 -89.23 116.96 27.85 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.337 -0.852 . . . . 1.48 109.428 179.79 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 332' ' ' ILE . . . . . 0.565 HG21 ' HA ' ' C' ' 338' ' ' PHE . 59.9 mt -103.85 115.96 46.74 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.783 0 O-C-N 121.151 -0.968 . . . . 0.24 109.805 -179.892 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' C' C ' 333' ' ' ARG . . . . . 0.491 ' NH1' ' HG2' ' A' ' 349' ' ' GLU . 0.1 OUTLIER -75.06 144.87 42.77 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.258 -0.901 . . . . 2.74 109.727 179.684 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' C' C ' 334' ' ' GLY . . . . . . . . . . . . . . . 82.53 123.7 0.79 Allowed Glycine 0 N--CA 1.491 2.36 0 C-N-CA 120.005 -1.093 . . . . 0.35 110.472 179.307 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 335' ' ' ARG . . . . . 0.504 ' HG2' ' NH1' ' C' ' 335' ' ' ARG . 0.4 OUTLIER -73.4 -31.19 63.73 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.372 -1.075 . . . . 2.53 109.034 179.438 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' C' C ' 336' ' ' GLU . . . . . 0.459 ' OE1' ' HG3' ' C' ' 337' ' ' ARG . 14.1 tm-20 -59.29 -63.57 1.26 Allowed 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.277 -0.889 . . . . 2.62 109.052 179.747 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' C' C ' 337' ' ' ARG . . . . . 0.459 ' HG3' ' OE1' ' C' ' 336' ' ' GLU . 4.0 mtt180 -60.75 -26.21 67.05 Favored 'General case' 0 N--CA 1.487 1.422 0 O-C-N 121.308 -0.87 . . . . 2.81 109.358 179.65 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' C' C ' 338' ' ' PHE . . . . . 0.565 ' HA ' HG21 ' C' ' 332' ' ' ILE . 86.4 t80 -54.86 -62.2 1.81 Allowed 'General case' 0 C--N 1.305 -1.344 0 O-C-N 121.279 -0.888 . . . . 0.4 109.379 -179.97 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' C' C ' 339' ' ' GLU . . . . . . . . . . . . . 34.2 mt-10 -51.1 -31.58 19.71 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.227 -0.921 . . . . 2.05 110.032 -179.587 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 340' ' ' MET . . . . . 0.434 ' HB3' ' O ' ' C' ' 337' ' ' ARG . 7.1 ttp -63.93 -53.54 48.77 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.213 -0.929 . . . . 0.32 109.841 -179.756 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' C' C ' 341' ' ' PHE . . . . . 0.442 ' HB2' HD13 ' C' ' 332' ' ' ILE . 33.5 m-85 -61.19 -42.53 98.75 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.194 -0.941 . . . . 0.18 109.815 -179.661 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' C' C ' 342' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -46.6 -43.57 17.45 Favored 'General case' 0 C--N 1.301 -1.519 0 O-C-N 121.187 -0.946 . . . . 2.91 109.496 -179.823 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' C' C ' 343' ' ' GLU . . . . . . . . . . . . . 15.8 tp10 -61.45 -40.28 93.9 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 120.988 -1.07 . . . . 2.14 109.635 179.884 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 344' ' ' LEU . . . . . 0.553 ' CD2' HD22 ' D' ' 344' ' ' LEU . 43.6 mt -63.31 -52.93 59.89 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.156 -0.965 . . . . 0.22 109.77 -179.756 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' C' C ' 345' ' ' ASN . . . . . 0.54 ' HB2' HD21 ' A' ' 330' ' ' LEU . 38.2 t30 -53.86 -44.91 70.76 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.277 -0.889 . . . . 1.08 109.656 -179.759 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' C' C ' 346' ' ' GLU . . . . . . . . . . . . . 3.2 tp10 -62.17 -37.58 85.81 Favored 'General case' 0 N--CA 1.488 1.435 0 O-C-N 121.209 -0.932 . . . . 2.21 109.823 -179.93 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 347' ' ' ALA . . . . . 0.721 ' HB1' ' HB1' ' D' ' 347' ' ' ALA . . . -59.35 -47.59 84.86 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.184 -0.948 . . . . 0.18 109.516 -179.662 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' C' C ' 348' ' ' LEU . . . . . 0.541 HD22 ' N ' ' C' ' 348' ' ' LEU . 3.9 mm? -63.66 -42.72 98.05 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.258 -0.901 . . . . 0.32 109.706 179.933 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' C' C ' 349' ' ' GLU . . . . . 0.404 ' OE1' ' CZ ' ' A' ' 333' ' ' ARG . 5.4 mm-40 -57.54 -39.14 75.95 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.046 -1.034 . . . . 2.19 109.341 179.996 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' C' C ' 350' ' ' LEU . . . . . 0.626 HD22 HD13 ' D' ' 350' ' ' LEU . 6.4 tt -61.31 -43.71 98.42 Favored 'General case' 0 N--CA 1.488 1.458 0 O-C-N 121.539 -0.726 . . . . 0.46 109.323 -179.992 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' C' C ' 351' ' ' LYS . . . . . . . . . . . . . 8.9 tttp -60.96 -41.91 97.25 Favored 'General case' 0 C--N 1.304 -1.395 0 O-C-N 121.116 -0.99 . . . . 1.35 109.085 179.867 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 352' ' ' ASP . . . . . . . . . . . . . 77.2 m-20 -52.76 -58.15 7.81 Favored 'General case' 0 N--CA 1.488 1.449 0 O-C-N 121.382 -0.824 . . . . 1.19 109.239 179.898 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 353' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 1.478 0 O-C-N 121.276 -0.89 . . . . 0.57 109.457 -179.956 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' D' D ' 326' ' ' GLU . . . . . . . . . . . . . 3.3 mm-40 . . . . . 0 N--CA 1.49 1.561 0 N-CA-C 109.348 -0.612 . . . . 2.13 109.348 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' D' D ' 327' ' ' TYR . . . . . 0.499 ' CE1' ' HG2' ' B' ' 333' ' ' ARG . 43.3 m-85 -149.75 111.37 4.51 Favored 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.012 -1.055 . . . . 0.47 109.436 179.959 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' D' D ' 328' ' ' PHE . . . . . 0.453 ' CE2' ' HA ' ' B' ' 335' ' ' ARG . 97.1 m-85 -113.4 -167.67 1.23 Allowed 'General case' 0 N--CA 1.488 1.472 0 O-C-N 121.375 -0.828 . . . . 0.3 109.184 -179.791 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' D' D ' 329' ' ' THR . . . . . . . . . . . . . 37.9 p -153.55 161.68 41.98 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.209 -0.932 . . . . 0.22 109.464 -179.957 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' D' D ' 330' ' ' LEU . . . . . 0.517 HD21 ' HB2' ' B' ' 345' ' ' ASN . 17.7 tp -150.48 130.89 13.78 Favored 'General case' 0 N--CA 1.488 1.474 0 O-C-N 121.464 -0.773 . . . . 0.28 109.473 -179.9 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' D' D ' 331' ' ' GLN . . . . . 0.435 ' HG3' ' O ' ' B' ' 328' ' ' PHE . 1.6 tt0 -86.69 119.87 27.38 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.017 -1.052 . . . . 0.93 109.325 179.835 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' D' D ' 332' ' ' ILE . . . . . 0.574 HD12 ' CD1' ' D' ' 338' ' ' PHE . 12.4 mt -104.4 109.58 27.86 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.564 0 O-C-N 121.094 -1.004 . . . . 0.25 109.636 -179.894 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' D' D ' 333' ' ' ARG . . . . . 0.562 ' HG2' ' CE1' ' B' ' 327' ' ' TYR . 46.1 mtt180 -72.28 149.97 44.01 Favored 'General case' 0 C--N 1.302 -1.465 0 O-C-N 121.106 -0.996 . . . . 2.93 109.209 179.827 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' D' D ' 334' ' ' GLY . . . . . . . . . . . . . . . 85.53 129.63 2.25 Favored Glycine 0 N--CA 1.493 2.486 0 N-CA-C 109.645 -1.382 . . . . 0.41 109.645 -179.911 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' D' D ' 335' ' ' ARG . . . . . 0.542 ' HA ' ' CE2' ' B' ' 328' ' ' PHE . 32.2 ttp180 -78.82 -45.96 19.75 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.007 -1.29 . . . . 3.03 109.647 179.898 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' D' D ' 336' ' ' GLU . . . . . . . . . . . . . 1.3 tt0 -57.65 -56.63 19.48 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.101 -0.999 . . . . 2.26 109.665 -179.821 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' D' D ' 337' ' ' ARG . . . . . 0.422 ' NH1' ' CG ' ' D' ' 337' ' ' ARG . 0.0 OUTLIER -59.32 -31.2 68.94 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.159 -0.963 . . . . 2.92 109.669 -179.769 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' D' D ' 338' ' ' PHE . . . . . 0.574 ' CD1' HD12 ' D' ' 332' ' ' ILE . 61.2 t80 -55.26 -54.98 36.69 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.292 -0.88 . . . . 0.37 109.532 179.923 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' D' D ' 339' ' ' GLU . . . . . . . . . . . . . 17.1 mt-10 -52.36 -34.62 48.47 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.197 -0.94 . . . . 1.99 109.756 -179.687 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' D' D ' 340' ' ' MET . . . . . . . . . . . . . 31.1 ttp -63.52 -49.92 71.61 Favored 'General case' 0 N--CA 1.488 1.466 0 O-C-N 121.23 -0.919 . . . . 0.31 109.966 -179.616 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' D' D ' 341' ' ' PHE . . . . . 0.456 ' HB2' HD13 ' D' ' 332' ' ' ILE . 42.1 m-85 -61.37 -47.05 87.63 Favored 'General case' 0 N--CA 1.488 1.467 0 O-C-N 121.108 -0.995 . . . . 0.18 109.551 -179.687 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' D' D ' 342' ' ' ARG . . . . . 0.459 ' NH1' ' CG ' ' D' ' 342' ' ' ARG . 0.0 OUTLIER -50.24 -37.87 37.78 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.175 -0.953 . . . . 2.41 109.86 -179.876 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' D' D ' 343' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -59.07 -51.58 69.42 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.303 -0.873 . . . . 2.35 109.673 -179.701 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' D' D ' 344' ' ' LEU . . . . . 0.553 HD22 ' CD2' ' C' ' 344' ' ' LEU . 56.1 mt -61.52 -33.03 73.12 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.191 -0.943 . . . . 0.19 109.455 179.959 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' D' D ' 345' ' ' ASN . . . . . 0.625 ' HB2' HD21 ' B' ' 330' ' ' LEU . 29.3 t-20 -58.38 -56.29 24.01 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.258 -0.901 . . . . 1.09 109.718 179.932 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' D' D ' 346' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -61.63 -32.61 72.76 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.421 -0.8 . . . . 1.69 109.92 -179.634 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' D' D ' 347' ' ' ALA . . . . . 0.721 ' HB1' ' HB1' ' C' ' 347' ' ' ALA . . . -58.4 -55.22 37.86 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.053 -1.029 . . . . 0.18 109.827 -179.701 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' D' D ' 348' ' ' LEU . . . . . 0.531 HD22 ' N ' ' D' ' 348' ' ' LEU . 4.2 mm? -61.02 -46.47 90.62 Favored 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.17 -0.956 . . . . 0.31 109.844 -179.46 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' D' D ' 349' ' ' GLU . . . . . 0.42 ' OE2' ' ND2' ' D' ' 345' ' ' ASN . 1.8 mt-10 -57.85 -29.89 65.36 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.184 -0.947 . . . . 1.95 109.736 -179.582 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' D' D ' 350' ' ' LEU . . . . . 0.626 HD13 HD22 ' C' ' 350' ' ' LEU . 6.3 tt -63.88 -49.37 72.97 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.099 -1.001 . . . . 0.43 109.292 179.853 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' D' D ' 351' ' ' LYS . . . . . . . . . . . . . 19.8 tttt -59.19 -42.14 90.15 Favored 'General case' 0 C--N 1.303 -1.449 0 O-C-N 121.47 -0.769 . . . . 1.4 109.403 179.78 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' D' D ' 352' ' ' ASP . . . . . . . . . . . . . 17.8 m-20 -56.1 -38.85 71.3 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.396 -0.815 . . . . 1.17 109.562 179.601 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' D' D ' 353' ' ' ALA . . . . . . . . . . . . . . . -67.19 -33.49 75.5 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.116 -0.99 . . . . 0.59 109.608 -179.909 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' D' D ' 354' ' ' GLN . . . . . . . . . . . . . 7.6 tt0 . . . . . 0 N--CA 1.488 1.475 0 O-C-N 121.131 -0.98 . . . . 1.44 109.497 -179.934 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 326' ' ' GLU . . . . . . . . . . . . . 3.0 mt-10 . . . . . 0 N--CA 1.488 1.454 0 N-CA-C 109.07 -0.715 . . . . 2.13 109.07 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 327' ' ' TYR . . . . . . . . . . . . . 47.3 m-85 -148.83 111.4 4.75 Favored 'General case' 0 N--CA 1.489 1.476 0 O-C-N 121.256 -0.902 . . . . 0.48 109.527 -179.835 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 328' ' ' PHE . . . . . 0.411 ' CE2' ' HA ' ' C' ' 335' ' ' ARG . 86.4 m-85 -113.87 -168.47 1.35 Allowed 'General case' 0 N--CA 1.488 1.451 0 O-C-N 121.347 -0.845 . . . . 0.31 109.532 -179.808 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 329' ' ' THR . . . . . 0.459 ' HA ' ' O ' ' C' ' 330' ' ' LEU . 24.4 p -153.56 165.21 36.61 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.346 -0.846 . . . . 0.22 109.078 179.94 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 330' ' ' LEU . . . . . 0.587 HD21 HD22 ' C' ' 345' ' ' ASN . 14.7 tp -151.47 131.33 13.29 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.045 -1.034 . . . . 0.28 109.877 -179.803 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 331' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -87.55 120.77 29.19 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.279 -0.888 . . . . 0.91 109.165 179.615 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 332' ' ' ILE . . . . . 0.647 HD12 ' CD1' ' A' ' 338' ' ' PHE . 59.6 mt -103.56 111.1 32.0 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.548 0 O-C-N 121.235 -0.916 . . . . 0.26 109.664 -179.794 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 333' ' ' ARG . . . . . 0.443 ' NH1' ' CG ' ' A' ' 333' ' ' ARG . 0.0 OUTLIER -72.59 139.56 47.51 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.403 -0.811 . . . . 2.92 109.35 179.83 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 334' ' ' GLY . . . . . . . . . . . . . . . 85.76 136.6 4.09 Favored Glycine 0 N--CA 1.49 2.251 0 N-CA-C 109.697 -1.361 . . . . 0.4 109.697 179.878 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 335' ' ' ARG . . . . . 0.492 ' NH1' ' HG3' ' A' ' 335' ' ' ARG . 0.3 OUTLIER -80.11 -36.17 35.74 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.405 -1.056 . . . . 3.01 109.582 -179.921 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 336' ' ' GLU . . . . . . . . . . . . . 52.2 tt0 -58.58 -57.24 13.84 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.238 -0.914 . . . . 2.29 110.052 -179.634 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 337' ' ' ARG . . . . . 0.552 ' HG3' ' NH1' ' A' ' 337' ' ' ARG . 0.6 OUTLIER -60.0 -30.36 69.09 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.117 -0.989 . . . . 2.93 109.815 -179.625 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 338' ' ' PHE . . . . . 0.647 ' CD1' HD12 ' A' ' 332' ' ' ILE . 88.8 t80 -54.34 -62.99 1.29 Allowed 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.214 -0.929 . . . . 0.38 109.756 -179.73 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 339' ' ' GLU . . . . . . . . . . . . . 80.9 mt-10 -51.88 -31.46 28.22 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.211 -0.93 . . . . 1.97 110.205 -179.667 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 340' ' ' MET . . . . . . . . . . . . . 28.0 ttp -63.8 -53.62 47.94 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.134 -0.979 . . . . 0.31 110.121 -179.432 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 341' ' ' PHE . . . . . . . . . . . . . 39.2 m-85 -62.25 -48.59 79.26 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.171 -0.955 . . . . 0.18 110.023 -179.533 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 342' ' ' ARG . . . . . . . . . . . . . 70.3 ttt180 -48.85 -38.38 22.17 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.161 -0.962 . . . . 2.42 109.858 -179.71 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 343' ' ' GLU . . . . . . . . . . . . . 42.5 tt0 -59.42 -49.45 77.77 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.157 -0.964 . . . . 2.35 109.896 -179.705 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 344' ' ' LEU . . . . . 0.458 HD22 ' CD2' ' B' ' 344' ' ' LEU . 42.2 mt -61.32 -37.96 85.14 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.092 -1.005 . . . . 0.18 109.714 -179.597 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 345' ' ' ASN . . . . . 0.446 ' HA ' ' CZ ' ' C' ' 341' ' ' PHE . 60.6 t-20 -57.01 -50.37 72.94 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.165 -0.959 . . . . 1.09 109.675 -179.936 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 346' ' ' GLU . . . . . . . . . . . . . 2.7 tt0 -60.71 -34.44 74.38 Favored 'General case' 0 N--CA 1.489 1.49 0 O-C-N 121.263 -0.898 . . . . 1.65 109.894 -179.755 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 347' ' ' ALA . . . . . 0.878 ' HB1' ' HB1' ' B' ' 347' ' ' ALA . . . -60.84 -51.65 68.42 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.128 -0.982 . . . . 0.18 110.047 -179.771 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 348' ' ' LEU . . . . . 0.541 HD22 ' N ' ' A' ' 348' ' ' LEU . 3.9 mm? -61.41 -44.84 96.44 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.165 -0.96 . . . . 0.3 110.003 -179.508 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 349' ' ' GLU . . . . . . . . . . . . . 39.3 mt-10 -58.02 -40.58 81.17 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.27 -0.894 . . . . 1.94 110.337 -179.281 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 350' ' ' LEU . . . . . 0.614 ' C ' HD23 ' A' ' 350' ' ' LEU . 8.5 tt -63.59 -48.37 77.67 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.16 -0.963 . . . . 0.46 109.977 -179.317 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 351' ' ' LYS . . . . . . . . . . . . . 25.3 tttt -55.43 -41.84 73.35 Favored 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.259 -0.901 . . . . 1.4 109.329 -179.548 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 352' ' ' ASP . . . . . . . . . . . . . 23.0 m-20 -59.36 -48.32 82.07 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.38 -0.825 . . . . 1.16 109.778 179.902 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 353' ' ' ALA . . . . . . . . . . . . . . . -67.49 -9.5 42.82 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.29 -0.881 . . . . 0.63 110.177 -179.419 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 354' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.49 1.56 0 O-C-N 121.051 -1.03 . . . . 1.47 109.628 -179.945 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 326' ' ' GLU . . . . . . . . . . . . . 2.9 mt-10 . . . . . 0 N--CA 1.488 1.465 0 N-CA-C 109.093 -0.706 . . . . 2.13 109.093 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' B' B ' 327' ' ' TYR . . . . . . . . . . . . . 47.0 m-85 -148.85 111.41 4.75 Favored 'General case' 0 N--CA 1.488 1.44 0 O-C-N 121.203 -0.935 . . . . 0.48 109.531 -179.858 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 328' ' ' PHE . . . . . 0.415 ' CE2' ' HA ' ' D' ' 335' ' ' ARG . 86.3 m-85 -114.01 -168.58 1.37 Allowed 'General case' 0 N--CA 1.489 1.48 0 O-C-N 121.336 -0.852 . . . . 0.32 109.53 -179.845 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 329' ' ' THR . . . . . 0.415 ' HA ' ' O ' ' D' ' 330' ' ' LEU . 23.9 p -153.48 165.23 36.51 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.32 -0.862 . . . . 0.23 109.146 179.989 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 330' ' ' LEU . . . . . 0.537 HD21 HD22 ' D' ' 345' ' ' ASN . 14.8 tp -151.49 131.26 13.2 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.093 -1.004 . . . . 0.28 109.927 -179.739 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 331' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -87.48 120.65 28.99 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.225 -0.922 . . . . 0.91 109.166 179.63 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 332' ' ' ILE . . . . . 0.643 HD12 ' CD1' ' B' ' 338' ' ' PHE . 59.7 mt -103.52 111.1 31.96 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.526 0 O-C-N 121.15 -0.969 . . . . 0.24 109.722 -179.804 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 333' ' ' ARG . . . . . 0.452 ' CG ' HH11 ' B' ' 333' ' ' ARG . 0.0 OUTLIER -72.53 139.56 47.64 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.254 -0.903 . . . . 2.93 109.411 179.852 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' B' B ' 334' ' ' GLY . . . . . . . . . . . . . . . 85.87 136.37 4.08 Favored Glycine 0 N--CA 1.49 2.295 0 N-CA-C 109.655 -1.378 . . . . 0.4 109.655 179.861 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 335' ' ' ARG . . . . . 0.5 ' NH1' ' HG3' ' B' ' 335' ' ' ARG . 0.3 OUTLIER -80.03 -36.15 36.2 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.253 -1.145 . . . . 3.01 109.579 -179.975 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' B' B ' 336' ' ' GLU . . . . . . . . . . . . . 52.5 tt0 -58.56 -57.21 13.97 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.309 -0.87 . . . . 2.28 110.05 -179.719 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 337' ' ' ARG . . . . . 0.54 ' NH1' ' HG3' ' B' ' 337' ' ' ARG . 0.6 OUTLIER -60.04 -30.37 69.14 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.11 -0.994 . . . . 2.93 109.826 -179.548 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' B' B ' 338' ' ' PHE . . . . . 0.643 ' CD1' HD12 ' B' ' 332' ' ' ILE . 88.9 t80 -54.4 -62.86 1.38 Allowed 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.222 -0.924 . . . . 0.37 109.833 -179.751 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 339' ' ' GLU . . . . . . . . . . . . . 81.6 mt-10 -51.97 -31.38 28.92 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.235 -0.916 . . . . 1.98 110.178 -179.666 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 340' ' ' MET . . . . . . . . . . . . . 28.3 ttp -63.73 -53.73 46.56 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.091 -1.005 . . . . 0.32 110.139 -179.491 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 341' ' ' PHE . . . . . . . . . . . . . 39.3 m-85 -62.19 -48.66 79.05 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.167 -0.958 . . . . 0.18 109.978 -179.48 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 342' ' ' ARG . . . . . . . . . . . . . 70.4 ttt180 -48.72 -38.28 21.1 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.2 -0.937 . . . . 2.42 109.964 -179.734 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 343' ' ' GLU . . . . . . . . . . . . . 43.0 tt0 -59.63 -49.3 78.3 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.194 -0.941 . . . . 2.35 109.967 -179.713 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 344' ' ' LEU . . . . . 0.458 ' CD2' HD22 ' A' ' 344' ' ' LEU . 42.6 mt -61.31 -38.03 85.36 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.205 -0.934 . . . . 0.18 109.747 -179.717 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 345' ' ' ASN . . . . . 0.522 HD22 HD21 ' D' ' 330' ' ' LEU . 60.6 t-20 -57.07 -50.15 73.65 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.245 -0.909 . . . . 1.09 109.621 -179.879 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 346' ' ' GLU . . . . . . . . . . . . . 2.7 tt0 -60.87 -34.41 74.58 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.224 -0.922 . . . . 1.66 109.826 -179.709 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 347' ' ' ALA . . . . . 0.878 ' HB1' ' HB1' ' A' ' 347' ' ' ALA . . . -60.9 -51.56 68.77 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.153 -0.967 . . . . 0.17 110.087 -179.693 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 348' ' ' LEU . . . . . 0.541 HD22 ' N ' ' B' ' 348' ' ' LEU . 3.9 mm? -61.41 -44.94 96.27 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.211 -0.931 . . . . 0.29 110.049 -179.561 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 349' ' ' GLU . . . . . . . . . . . . . 39.5 mt-10 -58.08 -40.28 80.69 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.224 -0.922 . . . . 1.95 110.378 -179.343 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 350' ' ' LEU . . . . . 0.61 HD23 ' C ' ' B' ' 350' ' ' LEU . 8.5 tt -63.79 -48.21 77.81 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.256 -0.902 . . . . 0.45 110.067 -179.411 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 351' ' ' LYS . . . . . . . . . . . . . 25.8 tttt -55.61 -41.83 74.02 Favored 'General case' 0 N--CA 1.488 1.441 0 O-C-N 121.198 -0.939 . . . . 1.38 109.27 -179.513 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 352' ' ' ASP . . . . . 0.504 ' OD2' ' NH2' ' D' ' 337' ' ' ARG . 23.3 m-20 -59.27 -48.43 81.66 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.282 -0.886 . . . . 1.16 109.828 179.797 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 353' ' ' ALA . . . . . . . . . . . . . . . -67.46 -9.7 44.46 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.241 -0.912 . . . . 0.61 110.116 -179.469 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 354' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.489 1.524 0 O-C-N 121.046 -1.034 . . . . 1.45 109.536 -179.824 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 326' ' ' GLU . . . . . 0.452 ' OE1' ' HB2' ' A' ' 335' ' ' ARG . 1.3 mp0 . . . . . 0 N--CA 1.489 1.501 0 CA-C-O 121.294 0.569 . . . . 2.17 109.48 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 327' ' ' TYR . . . . . . . . . . . . . 51.6 m-85 -149.66 115.03 5.5 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.33 -0.856 . . . . 0.48 109.394 -179.916 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 328' ' ' PHE . . . . . 0.464 ' CE1' ' HA ' ' A' ' 335' ' ' ARG . 84.4 m-85 -113.36 -169.77 1.56 Allowed 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.319 -0.863 . . . . 0.33 109.562 -179.934 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' C' C ' 329' ' ' THR . . . . . 0.454 ' HA ' ' O ' ' A' ' 330' ' ' LEU . 16.3 p -153.54 162.48 41.22 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.265 -0.897 . . . . 0.23 109.463 -179.873 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' C' C ' 330' ' ' LEU . . . . . 0.459 ' O ' ' HA ' ' A' ' 329' ' ' THR . 14.3 tp -150.26 129.78 13.04 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.206 -0.934 . . . . 0.28 109.782 -179.725 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' C' C ' 331' ' ' GLN . . . . . . . . . . . . . 4.1 tt0 -89.22 119.4 29.68 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.263 -0.898 . . . . 1.48 109.387 179.568 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 332' ' ' ILE . . . . . 0.474 HG21 ' HA ' ' C' ' 338' ' ' PHE . 21.5 mt -103.67 115.58 45.88 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.576 0 O-C-N 121.101 -1.0 . . . . 0.24 109.654 179.811 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' C' C ' 333' ' ' ARG . . . . . 0.565 ' CZ ' ' HB2' ' C' ' 333' ' ' ARG . 5.6 mtm-85 -73.45 151.58 41.05 Favored 'General case' 0 N--CA 1.489 1.493 0 O-C-N 121.348 -0.845 . . . . 2.74 109.375 179.788 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' C' C ' 334' ' ' GLY . . . . . . . . . . . . . . . 71.83 129.99 0.1 OUTLIER Glycine 0 N--CA 1.491 2.305 0 N-CA-C 109.737 -1.345 . . . . 0.35 109.737 179.798 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 335' ' ' ARG . . . . . 0.454 ' NH1' ' CG ' ' C' ' 335' ' ' ARG . 0.2 OUTLIER -73.98 -31.26 62.9 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.273 -1.133 . . . . 2.53 109.358 179.847 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' C' C ' 336' ' ' GLU . . . . . . . . . . . . . 1.7 mp0 -59.22 -57.85 11.21 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.293 -0.88 . . . . 2.62 110.216 -179.768 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 337' ' ' ARG . . . . . 0.524 ' HG2' ' NH1' ' C' ' 337' ' ' ARG . 0.0 OUTLIER -59.03 -32.97 70.21 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.241 -0.912 . . . . 2.81 109.735 -179.471 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' C' C ' 338' ' ' PHE . . . . . 0.474 ' HA ' HG21 ' C' ' 332' ' ' ILE . 80.8 t80 -54.05 -49.53 68.77 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.224 -0.923 . . . . 0.4 109.576 -179.884 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' C' C ' 339' ' ' GLU . . . . . . . . . . . . . 14.5 mt-10 -54.99 -36.67 65.64 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.07 -1.019 . . . . 2.05 110.307 -179.849 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 340' ' ' MET . . . . . . . . . . . . . 19.0 ttp -64.6 -57.7 8.38 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.131 -0.981 . . . . 0.32 110.861 -178.984 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 341' ' ' PHE . . . . . 0.446 ' CZ ' ' HA ' ' A' ' 345' ' ' ASN . 59.1 m-85 -59.74 -51.44 69.75 Favored 'General case' 0 N--CA 1.493 1.713 0 O-C-N 121.091 -1.005 . . . . 0.18 110.246 -178.956 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' C' C ' 342' ' ' ARG . . . . . 0.46 HH11 ' CG ' ' C' ' 342' ' ' ARG . 0.2 OUTLIER -47.21 -45.85 23.58 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.25 -0.906 . . . . 2.91 110.217 -179.374 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' C' C ' 343' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -58.84 -43.19 90.66 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.213 -0.929 . . . . 2.14 109.968 -179.496 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' C' C ' 344' ' ' LEU . . . . . 0.472 ' CD2' HD22 ' D' ' 344' ' ' LEU . 25.6 mt -62.28 -40.66 96.97 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.093 -1.004 . . . . 0.22 109.823 -179.583 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' C' C ' 345' ' ' ASN . . . . . 0.587 HD22 HD21 ' A' ' 330' ' ' LEU . 51.2 t-20 -55.26 -51.79 65.51 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.238 -0.914 . . . . 1.08 109.98 -179.596 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' C' C ' 346' ' ' GLU . . . . . . . . . . . . . 63.1 tt0 -60.14 -31.68 70.31 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.108 -0.995 . . . . 2.21 109.742 -179.602 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 347' ' ' ALA . . . . . 0.793 ' HB1' ' HB1' ' D' ' 347' ' ' ALA . . . -62.7 -48.05 80.95 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.112 -0.993 . . . . 0.18 109.879 -179.998 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' C' C ' 348' ' ' LEU . . . . . 0.538 HD22 ' N ' ' C' ' 348' ' ' LEU . 4.3 mm? -62.16 -53.84 49.64 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.209 -0.932 . . . . 0.32 110.108 -179.637 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' C' C ' 349' ' ' GLU . . . . . . . . . . . . . 6.6 mm-40 -57.65 -34.06 68.96 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.256 -0.902 . . . . 2.19 110.231 -179.097 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 350' ' ' LEU . . . . . 0.725 HD21 HD13 ' D' ' 350' ' ' LEU . 4.2 tt -63.49 -44.04 95.51 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.099 -1.001 . . . . 0.46 109.282 -179.817 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' C' C ' 351' ' ' LYS . . . . . 0.541 ' N ' HD23 ' C' ' 350' ' ' LEU . 41.6 tttp -59.9 -34.43 73.18 Favored 'General case' 0 N--CA 1.488 1.454 0 O-C-N 121.342 -0.849 . . . . 1.35 109.445 -179.923 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' C' C ' 352' ' ' ASP . . . . . . . . . . . . . 3.2 m-20 -56.52 -45.49 81.09 Favored 'General case' 0 N--CA 1.489 1.499 0 O-C-N 121.241 -0.912 . . . . 1.19 109.663 179.978 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 353' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 1.588 0 O-C-N 121.184 -0.947 . . . . 0.57 109.333 -179.971 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' D' D ' 326' ' ' GLU . . . . . . . . . . . . . 3.0 mt-10 . . . . . 0 N--CA 1.488 1.441 0 N-CA-C 109.07 -0.715 . . . . 2.13 109.07 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' D' D ' 327' ' ' TYR . . . . . . . . . . . . . 47.1 m-85 -148.79 111.53 4.8 Favored 'General case' 0 C--N 1.303 -1.427 0 O-C-N 121.173 -0.954 . . . . 0.47 109.469 -179.818 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' D' D ' 328' ' ' PHE . . . . . 0.413 ' CE2' ' HA ' ' B' ' 335' ' ' ARG . 86.2 m-85 -114.08 -168.64 1.38 Allowed 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.292 -0.88 . . . . 0.3 109.561 -179.842 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' D' D ' 329' ' ' THR . . . . . 0.425 ' HA ' ' O ' ' B' ' 330' ' ' LEU . 23.8 p -153.46 165.07 36.98 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.294 -0.879 . . . . 0.22 109.174 179.931 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' D' D ' 330' ' ' LEU . . . . . 0.522 HD21 HD22 ' B' ' 345' ' ' ASN . 14.9 tp -151.43 131.23 13.23 Favored 'General case' 0 N--CA 1.489 1.476 0 O-C-N 121.134 -0.978 . . . . 0.28 109.869 -179.768 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' D' D ' 331' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -87.39 120.75 29.0 Favored 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.341 -0.849 . . . . 0.93 109.234 179.54 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' D' D ' 332' ' ' ILE . . . . . 0.65 HD12 ' CD1' ' D' ' 338' ' ' PHE . 59.5 mt -103.46 111.26 32.51 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.574 0 O-C-N 121.149 -0.97 . . . . 0.25 109.656 -179.778 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' D' D ' 333' ' ' ARG . . . . . 0.433 ' NH1' ' CG ' ' D' ' 333' ' ' ARG . 0.0 OUTLIER -72.77 139.67 47.24 Favored 'General case' 0 N--CA 1.489 1.49 0 O-C-N 121.334 -0.854 . . . . 2.93 109.454 179.778 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' D' D ' 334' ' ' GLY . . . . . . . . . . . . . . . 85.76 136.62 4.1 Favored Glycine 0 N--CA 1.49 2.283 0 N-CA-C 109.658 -1.377 . . . . 0.41 109.658 179.925 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' D' D ' 335' ' ' ARG . . . . . 0.5 ' NH1' ' HG3' ' D' ' 335' ' ' ARG . 0.3 OUTLIER -80.13 -36.08 35.8 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.31 -1.112 . . . . 3.03 109.623 -179.951 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' D' D ' 336' ' ' GLU . . . . . . . . . . . . . 53.1 tt0 -58.72 -57.14 14.32 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.223 -0.923 . . . . 2.26 110.057 -179.666 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' D' D ' 337' ' ' ARG . . . . . 0.546 ' NH1' ' HG3' ' D' ' 337' ' ' ARG . 0.6 OUTLIER -60.07 -30.27 69.11 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.188 -0.945 . . . . 2.92 109.862 -179.608 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' D' D ' 338' ' ' PHE . . . . . 0.65 ' CD1' HD12 ' D' ' 332' ' ' ILE . 88.7 t80 -54.43 -62.89 1.36 Allowed 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.209 -0.932 . . . . 0.37 109.769 -179.756 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' D' D ' 339' ' ' GLU . . . . . . . . . . . . . 81.7 mt-10 -51.99 -31.32 28.93 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.279 -0.888 . . . . 1.99 110.155 -179.632 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' D' D ' 340' ' ' MET . . . . . . . . . . . . . 28.2 ttp -63.9 -53.6 47.95 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.101 -0.999 . . . . 0.31 110.098 -179.426 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' D' D ' 341' ' ' PHE . . . . . 0.423 ' CZ ' ' HA ' ' B' ' 345' ' ' ASN . 39.8 m-85 -62.17 -48.83 78.3 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.183 -0.948 . . . . 0.18 109.977 -179.532 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' D' D ' 342' ' ' ARG . . . . . . . . . . . . . 70.6 ttt180 -48.6 -38.47 20.87 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.185 -0.947 . . . . 2.41 109.827 -179.73 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' D' D ' 343' ' ' GLU . . . . . . . . . . . . . 43.7 tt0 -59.51 -49.29 78.37 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.218 -0.926 . . . . 2.35 109.927 -179.609 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' D' D ' 344' ' ' LEU . . . . . 0.472 HD22 ' CD2' ' C' ' 344' ' ' LEU . 43.1 mt -61.26 -38.08 85.46 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.256 -0.902 . . . . 0.19 109.738 -179.659 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' D' D ' 345' ' ' ASN . . . . . 0.537 HD22 HD21 ' B' ' 330' ' ' LEU . 60.6 t-20 -57.09 -50.35 73.06 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.178 -0.951 . . . . 1.09 109.61 -179.787 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' D' D ' 346' ' ' GLU . . . . . . . . . . . . . 2.6 tt0 -60.56 -34.52 74.28 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.295 -0.878 . . . . 1.69 109.892 -179.774 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' D' D ' 347' ' ' ALA . . . . . 0.793 ' HB1' ' HB1' ' C' ' 347' ' ' ALA . . . -60.85 -51.48 69.12 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.243 -0.911 . . . . 0.18 110.07 -179.645 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' D' D ' 348' ' ' LEU . . . . . 0.548 HD22 ' N ' ' D' ' 348' ' ' LEU . 3.9 mm? -61.48 -45.05 95.88 Favored 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.158 -0.964 . . . . 0.31 109.948 -179.446 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' D' D ' 349' ' ' GLU . . . . . . . . . . . . . 39.2 mt-10 -57.91 -40.34 80.12 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.275 -0.891 . . . . 1.95 110.351 -179.327 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' D' D ' 350' ' ' LEU . . . . . 0.725 HD13 HD21 ' C' ' 350' ' ' LEU . 8.6 tt -63.73 -48.11 78.35 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.087 -1.008 . . . . 0.43 110.144 -179.369 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' D' D ' 351' ' ' LYS . . . . . . . . . . . . . 25.8 tttt -55.73 -41.8 74.41 Favored 'General case' 0 N--CA 1.488 1.451 0 O-C-N 121.244 -0.91 . . . . 1.4 109.291 -179.665 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' D' D ' 352' ' ' ASP . . . . . 0.433 ' OD2' ' NH2' ' B' ' 337' ' ' ARG . 23.5 m-20 -59.36 -48.35 81.96 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.294 -0.879 . . . . 1.17 109.806 179.802 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' D' D ' 353' ' ' ALA . . . . . . . . . . . . . . . -67.57 -9.56 43.85 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.22 -0.925 . . . . 0.59 110.101 -179.43 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' D' D ' 354' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.49 1.566 0 O-C-N 121.063 -1.023 . . . . 1.44 109.532 -179.807 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 326' ' ' GLU . . . . . . . . . . . . . 4.0 mm-40 . . . . . 0 N--CA 1.489 1.518 0 N-CA-C 109.378 -0.601 . . . . 2.13 109.378 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 327' ' ' TYR . . . . . 0.54 ' CE2' ' HG2' ' C' ' 333' ' ' ARG . 40.9 m-85 -148.35 111.05 4.76 Favored 'General case' 0 C--N 1.302 -1.464 0 O-C-N 121.412 -0.805 . . . . 0.48 109.553 179.725 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 328' ' ' PHE . . . . . 0.437 ' O ' ' OE1' ' C' ' 331' ' ' GLN . 59.5 m-85 -113.08 -172.75 2.12 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.431 -0.793 . . . . 0.31 109.291 -179.936 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 329' ' ' THR . . . . . . . . . . . . . 60.0 p -152.92 171.74 17.85 Favored 'General case' 0 C--N 1.302 -1.461 0 O-C-N 121.196 -0.94 . . . . 0.22 108.895 179.847 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 330' ' ' LEU . . . . . . . . . . . . . 24.1 tp -151.86 130.17 12.05 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.378 -0.826 . . . . 0.28 109.71 -179.721 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 331' ' ' GLN . . . . . . . . . . . . . 1.5 tp60 -87.18 111.96 21.5 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.25 -0.906 . . . . 0.91 109.679 179.932 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 332' ' ' ILE . . . . . 0.597 HG21 ' HA ' ' A' ' 338' ' ' PHE . 63.6 mt -103.2 103.1 14.59 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.587 0 O-C-N 121.107 -0.996 . . . . 0.26 109.291 179.891 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 333' ' ' ARG . . . . . 0.6 ' HG2' ' CE2' ' C' ' 327' ' ' TYR . 0.0 OUTLIER -72.45 147.58 45.98 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.253 -0.904 . . . . 2.92 109.41 -179.879 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 334' ' ' GLY . . . . . . . . . . . . . . . 82.0 130.59 1.3 Allowed Glycine 0 N--CA 1.493 2.436 0 N-CA-C 109.452 -1.459 . . . . 0.4 109.452 -179.961 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 335' ' ' ARG . . . . . 0.433 ' HA ' ' CE2' ' C' ' 328' ' ' PHE . 0.2 OUTLIER -76.44 -31.42 57.85 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.133 -1.216 . . . . 3.01 110.022 -179.938 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 336' ' ' GLU . . . . . . . . . . . . . 4.8 tp10 -57.45 -62.88 1.47 Allowed 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.048 -1.033 . . . . 2.29 109.667 -179.627 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 337' ' ' ARG . . . . . 0.429 ' HG3' HH11 ' A' ' 337' ' ' ARG . 8.3 mtm-85 -59.99 -31.43 69.91 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.249 -0.907 . . . . 2.93 109.508 -179.765 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 338' ' ' PHE . . . . . 0.597 ' HA ' HG21 ' A' ' 332' ' ' ILE . 73.1 t80 -56.35 -56.02 26.23 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.304 -0.872 . . . . 0.38 109.851 -179.97 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 339' ' ' GLU . . . . . . . . . . . . . 93.6 mt-10 -52.74 -37.17 58.87 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.151 -0.968 . . . . 1.97 110.446 -179.568 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 340' ' ' MET . . . . . 0.443 ' SD ' ' OE1' ' D' ' 343' ' ' GLU . 28.2 ttp -63.76 -47.99 78.74 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.024 -1.047 . . . . 0.31 110.162 -179.238 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 341' ' ' PHE . . . . . . . . . . . . . 52.4 m-85 -62.43 -40.41 96.48 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.148 -0.97 . . . . 0.18 109.684 -179.515 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 342' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -51.12 -43.68 61.19 Favored 'General case' 0 N--CA 1.488 1.47 0 O-C-N 121.399 -0.813 . . . . 2.42 109.823 -179.939 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 343' ' ' GLU . . . . . 0.559 ' OE2' HD11 ' B' ' 348' ' ' LEU . 1.8 tt0 -57.94 -46.84 84.43 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.374 -0.829 . . . . 2.35 109.706 -179.646 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 344' ' ' LEU . . . . . . . . . . . . . 41.4 mt -61.59 -33.71 74.36 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.176 -0.953 . . . . 0.18 109.247 179.906 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 345' ' ' ASN . . . . . 0.421 ' O ' ' HG3' ' A' ' 349' ' ' GLU . 13.3 t-20 -57.96 -55.68 31.77 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.558 -0.714 . . . . 1.09 109.517 179.979 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 346' ' ' GLU . . . . . . . . . . . . . 65.2 tt0 -63.63 -29.28 70.54 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.224 -0.922 . . . . 1.65 110.205 -179.756 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 347' ' ' ALA . . . . . 0.85 ' HB1' ' HB1' ' B' ' 347' ' ' ALA . . . -60.85 -61.44 2.58 Favored 'General case' 0 N--CA 1.494 1.759 0 O-C-N 120.983 -1.073 . . . . 0.18 109.983 -179.613 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 348' ' ' LEU . . . . . 0.587 HD22 ' N ' ' A' ' 348' ' ' LEU . 3.9 mm? -61.74 -40.47 95.2 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.256 -0.903 . . . . 0.3 109.546 -179.789 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 349' ' ' GLU . . . . . 0.421 ' HG3' ' O ' ' A' ' 345' ' ' ASN . 93.4 mt-10 -58.56 -34.13 70.69 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.244 -0.91 . . . . 1.94 110.15 -179.446 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 350' ' ' LEU . . . . . 0.804 ' O ' HD23 ' A' ' 350' ' ' LEU . 4.1 tt -65.35 -47.08 77.71 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.179 -0.951 . . . . 0.46 109.661 -179.833 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 351' ' ' LYS . . . . . . . . . . . . . 14.4 tttm -58.96 -41.77 88.27 Favored 'General case' 0 N--CA 1.489 1.497 0 O-C-N 121.166 -0.959 . . . . 1.4 109.845 -179.453 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 352' ' ' ASP . . . . . . . . . . . . . 48.2 m-20 -53.45 -40.29 65.12 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.035 -1.041 . . . . 1.16 109.505 -179.837 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 353' ' ' ALA . . . . . . . . . . . . . . . -67.5 -31.45 71.59 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.161 -0.962 . . . . 0.63 109.727 -179.888 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 354' ' ' GLN . . . . . . . . . . . . . 3.7 tt0 . . . . . 0 N--CA 1.493 1.696 0 O-C-N 121.255 -0.903 . . . . 1.47 109.818 -179.767 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' B' B ' 326' ' ' GLU . . . . . . . . . . . . . 3.4 mm-40 . . . . . 0 N--CA 1.49 1.535 0 N-CA-C 109.354 -0.61 . . . . 2.13 109.354 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' B' B ' 327' ' ' TYR . . . . . 0.541 ' CE2' ' HG2' ' D' ' 333' ' ' ARG . 42.0 m-85 -148.13 111.51 4.96 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.373 -0.829 . . . . 0.48 109.446 179.637 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 328' ' ' PHE . . . . . . . . . . . . . 62.8 m-85 -113.08 -173.37 2.24 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.362 -0.836 . . . . 0.32 109.243 -179.904 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 329' ' ' THR . . . . . 0.498 ' HA ' ' O ' ' D' ' 330' ' ' LEU . 77.2 p -152.12 170.77 19.14 Favored 'General case' 0 C--N 1.302 -1.479 0 O-C-N 121.348 -0.845 . . . . 0.23 109.099 179.824 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 330' ' ' LEU . . . . . 0.457 ' O ' ' HA ' ' D' ' 329' ' ' THR . 28.3 tp -151.13 130.31 12.71 Favored 'General case' 0 C--N 1.303 -1.449 0 O-C-N 121.025 -1.047 . . . . 0.28 109.71 -179.661 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 331' ' ' GLN . . . . . . . . . . . . . 1.5 tp60 -87.48 112.28 22.04 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.384 -0.823 . . . . 0.91 109.641 -179.891 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 332' ' ' ILE . . . . . 0.607 HG21 ' HA ' ' B' ' 338' ' ' PHE . 63.6 mt -103.49 103.23 14.83 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.478 0 O-C-N 121.118 -0.989 . . . . 0.24 109.195 179.834 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 333' ' ' ARG . . . . . 0.535 ' HG2' ' NH1' ' B' ' 333' ' ' ARG . 0.0 OUTLIER -72.69 146.56 46.43 Favored 'General case' 0 N--CA 1.488 1.475 0 O-C-N 121.178 -0.951 . . . . 2.93 109.472 -179.924 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' B' B ' 334' ' ' GLY . . . . . . . . . . . . . . . 82.88 130.81 1.57 Allowed Glycine 0 N--CA 1.492 2.428 0 N-CA-C 109.583 -1.407 . . . . 0.4 109.583 179.995 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 335' ' ' ARG . . . . . 0.423 ' HG3' HH11 ' B' ' 335' ' ' ARG . 0.2 OUTLIER -76.37 -31.54 58.09 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.35 -1.088 . . . . 3.01 109.773 -179.657 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' B' B ' 336' ' ' GLU . . . . . . . . . . . . . 4.8 tp10 -57.01 -63.37 1.23 Allowed 'General case' 0 N--CA 1.488 1.454 0 O-C-N 121.092 -1.005 . . . . 2.28 109.881 -179.743 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 337' ' ' ARG . . . . . 0.416 HH11 ' HG3' ' B' ' 337' ' ' ARG . 9.1 mtm-85 -60.1 -31.42 70.02 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.233 -0.917 . . . . 2.93 109.686 -179.712 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 338' ' ' PHE . . . . . 0.607 ' HA ' HG21 ' B' ' 332' ' ' ILE . 72.4 t80 -56.37 -55.72 30.06 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.218 -0.926 . . . . 0.37 109.826 -179.903 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 339' ' ' GLU . . . . . . . . . . . . . 94.1 mt-10 -52.96 -37.33 61.05 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.256 -0.903 . . . . 1.98 110.426 -179.265 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 340' ' ' MET . . . . . . . . . . . . . 29.3 ttp -63.57 -47.88 79.7 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.133 -0.98 . . . . 0.32 110.041 -179.404 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 341' ' ' PHE . . . . . . . . . . . . . 50.9 m-85 -62.03 -40.95 97.47 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 120.963 -1.086 . . . . 0.18 109.818 -179.762 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 342' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -50.7 -43.29 57.66 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.287 -0.883 . . . . 2.42 109.904 -179.859 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 343' ' ' GLU . . . . . . . . . . . . . 1.7 tt0 -58.42 -46.5 86.36 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.303 -0.873 . . . . 2.35 109.665 -179.518 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 344' ' ' LEU . . . . . . . . . . . . . 39.5 mt -61.57 -33.55 74.07 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.324 -0.86 . . . . 0.18 109.07 179.966 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 345' ' ' ASN . . . . . . . . . . . . . 13.0 t-20 -57.88 -56.62 19.61 Favored 'General case' 0 N--CA 1.49 1.525 0 O-C-N 121.413 -0.805 . . . . 1.09 109.686 179.999 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 346' ' ' GLU . . . . . . . . . . . . . 61.9 tt0 -63.31 -29.06 70.45 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.239 -0.913 . . . . 1.66 110.199 -179.783 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 347' ' ' ALA . . . . . 0.85 ' HB1' ' HB1' ' A' ' 347' ' ' ALA . . . -60.76 -62.07 2.13 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 120.86 -1.15 . . . . 0.17 109.922 -179.622 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 348' ' ' LEU . . . . . 0.599 HD22 ' N ' ' B' ' 348' ' ' LEU . 3.9 mm? -61.2 -40.25 93.24 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.076 -1.015 . . . . 0.29 109.764 -179.651 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 349' ' ' GLU . . . . . . . . . . . . . 96.9 mt-10 -59.01 -33.97 71.33 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.295 -0.878 . . . . 1.95 110.077 -179.453 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 350' ' ' LEU . . . . . 0.8 ' O ' HD23 ' B' ' 350' ' ' LEU . 4.0 tt -65.2 -47.09 78.11 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.278 -0.889 . . . . 0.45 109.641 -179.78 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 351' ' ' LYS . . . . . . . . . . . . . 16.2 tttm -58.77 -41.75 87.34 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.303 -0.873 . . . . 1.38 109.788 -179.666 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 352' ' ' ASP . . . . . . . . . . . . . 45.5 m-20 -54.22 -40.1 67.35 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.163 -0.961 . . . . 1.16 109.513 -179.667 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 353' ' ' ALA . . . . . . . . . . . . . . . -67.02 -31.66 72.35 Favored 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.266 -0.897 . . . . 0.61 109.501 179.928 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 354' ' ' GLN . . . . . . . . . . . . . 3.6 tt0 . . . . . 0 N--CA 1.488 1.455 0 O-C-N 121.159 -0.963 . . . . 1.45 109.891 -179.906 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' C' C ' 326' ' ' GLU . . . . . 0.481 ' O ' ' CD1' ' C' ' 327' ' ' TYR . 1.7 mm-40 . . . . . 0 N--CA 1.494 1.741 0 CA-C-O 121.42 0.629 . . . . 2.17 109.645 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 327' ' ' TYR . . . . . 0.6 ' CE2' ' HG2' ' A' ' 333' ' ' ARG . 37.4 m-85 -150.41 113.61 4.87 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.341 -0.849 . . . . 0.48 109.678 179.745 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' C' C ' 328' ' ' PHE . . . . . 0.433 ' CE2' ' HA ' ' A' ' 335' ' ' ARG . 96.3 m-85 -113.62 -170.39 1.69 Allowed 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.317 -0.864 . . . . 0.33 109.356 179.695 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' C' C ' 329' ' ' THR . . . . . 0.415 HG23 ' O ' ' C' ' 328' ' ' PHE . 12.8 p -153.31 167.17 30.28 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.168 -0.957 . . . . 0.23 109.71 -179.748 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' C' C ' 330' ' ' LEU . . . . . . . . . . . . . 56.9 tp -148.57 130.35 15.11 Favored 'General case' 0 N--CA 1.488 1.452 0 O-C-N 121.148 -0.97 . . . . 0.28 109.518 -179.97 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 331' ' ' GLN . . . . . 0.437 ' OE1' ' O ' ' A' ' 328' ' ' PHE . 7.4 tp-100 -87.32 111.24 20.87 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.383 -0.823 . . . . 1.48 109.538 -179.922 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' C' C ' 332' ' ' ILE . . . . . 0.664 HG21 ' HA ' ' C' ' 338' ' ' PHE . 31.1 mt -103.7 101.43 12.23 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.624 0 O-C-N 121.009 -1.057 . . . . 0.24 109.615 179.858 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' C' C ' 333' ' ' ARG . . . . . 0.54 ' HG2' ' CE2' ' A' ' 327' ' ' TYR . 0.0 OUTLIER -73.67 137.23 43.98 Favored 'General case' 0 N--CA 1.489 1.476 0 O-C-N 121.151 -0.968 . . . . 2.74 109.113 179.539 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' C' C ' 334' ' ' GLY . . . . . . . . . . . . . . . 96.33 128.62 5.79 Favored Glycine 0 N--CA 1.488 2.131 0 N-CA-C 109.571 -1.412 . . . . 0.35 109.571 -179.985 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 335' ' ' ARG . . . . . 0.436 ' HD3' ' CZ ' ' A' ' 328' ' ' PHE . 3.6 ttp180 -75.87 -36.59 59.49 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.363 -1.081 . . . . 2.53 109.309 -179.983 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' C' C ' 336' ' ' GLU . . . . . . . . . . . . . 1.3 mt-10 -58.95 -60.28 4.11 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.218 -0.926 . . . . 2.62 109.875 -179.748 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 337' ' ' ARG . . . . . 0.478 ' NE ' ' HA ' ' C' ' 337' ' ' ARG . 10.5 mmm180 -60.04 -35.23 74.66 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.187 -0.946 . . . . 2.81 109.678 -179.731 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' C' C ' 338' ' ' PHE . . . . . 0.664 ' HA ' HG21 ' C' ' 332' ' ' ILE . 16.8 t80 -56.44 -48.66 76.56 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.242 -0.911 . . . . 0.4 109.803 -179.816 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' C' C ' 339' ' ' GLU . . . . . . . . . . . . . 2.2 mt-10 -53.57 -37.52 63.01 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.056 -1.027 . . . . 2.05 110.44 -179.237 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 340' ' ' MET . . . . . . . . . . . . . 32.5 ttp -63.75 -47.32 81.49 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.062 -1.024 . . . . 0.32 109.84 -179.485 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 341' ' ' PHE . . . . . . . . . . . . . 56.8 m-85 -61.75 -45.05 95.59 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.1 -1.0 . . . . 0.18 109.982 -179.523 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 342' ' ' ARG . . . . . 0.436 HH11 ' CG ' ' C' ' 342' ' ' ARG . 0.0 OUTLIER -50.09 -42.34 50.03 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.255 -0.903 . . . . 2.91 109.962 -179.842 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' C' C ' 343' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -59.98 -51.71 68.5 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.262 -0.899 . . . . 2.14 110.173 -179.522 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' C' C ' 344' ' ' LEU . . . . . . . . . . . . . 42.1 mt -60.18 -30.99 69.71 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.128 -0.983 . . . . 0.22 109.68 -179.559 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 345' ' ' ASN . . . . . . . . . . . . . 14.3 t-20 -57.84 -56.61 19.69 Favored 'General case' 0 N--CA 1.488 1.428 0 O-C-N 121.242 -0.911 . . . . 1.08 109.442 179.93 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 346' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -62.05 -29.27 70.18 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.399 -0.813 . . . . 2.21 109.92 -179.898 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' C' C ' 347' ' ' ALA . . . . . 0.717 ' HB1' ' HB1' ' D' ' 347' ' ' ALA . . . -61.1 -60.33 3.94 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.206 -0.934 . . . . 0.18 110.104 -179.695 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' C' C ' 348' ' ' LEU . . . . . 0.547 HD22 ' N ' ' C' ' 348' ' ' LEU . 4.1 mm? -59.4 -48.54 81.26 Favored 'General case' 0 N--CA 1.495 1.795 0 O-C-N 121.017 -1.052 . . . . 0.32 109.872 -179.561 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' C' C ' 349' ' ' GLU . . . . . . . . . . . . . 5.3 mm-40 -57.85 -28.66 64.32 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.196 -0.94 . . . . 2.19 109.354 -179.845 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 350' ' ' LEU . . . . . 1.041 HD22 HD13 ' D' ' 350' ' ' LEU . 5.2 tt -64.1 -46.53 83.82 Favored 'General case' 0 N--CA 1.489 1.501 0 O-C-N 121.207 -0.933 . . . . 0.46 108.928 179.689 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' C' C ' 351' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -59.56 -45.55 91.5 Favored 'General case' 0 N--CA 1.487 1.379 0 O-C-N 121.576 -0.703 . . . . 1.35 109.132 179.83 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' C' C ' 352' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -56.86 -32.5 65.89 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.477 -0.764 . . . . 1.19 109.417 179.729 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 353' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 1.547 0 O-C-N 121.27 -0.893 . . . . 0.57 109.328 -179.992 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' D' D ' 326' ' ' GLU . . . . . . . . . . . . . 3.1 mm-40 . . . . . 0 N--CA 1.489 1.505 0 N-CA-C 109.428 -0.582 . . . . 2.13 109.428 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' D' D ' 327' ' ' TYR . . . . . 0.453 ' CE2' ' HG2' ' B' ' 333' ' ' ARG . 42.6 m-85 -148.54 112.09 5.03 Favored 'General case' 0 N--CA 1.488 1.453 0 O-C-N 121.409 -0.807 . . . . 0.47 109.267 179.675 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' D' D ' 328' ' ' PHE . . . . . . . . . . . . . 58.0 m-85 -113.6 -173.25 2.23 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.533 -0.73 . . . . 0.3 109.281 -179.901 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' D' D ' 329' ' ' THR . . . . . 0.457 ' HA ' ' O ' ' B' ' 330' ' ' LEU . 76.5 p -152.28 170.57 19.72 Favored 'General case' 0 N--CA 1.488 1.472 0 O-C-N 121.276 -0.89 . . . . 0.22 109.004 -179.938 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' D' D ' 330' ' ' LEU . . . . . 0.498 ' O ' ' HA ' ' B' ' 329' ' ' THR . 32.2 tp -150.65 130.65 13.41 Favored 'General case' 0 C--N 1.302 -1.463 0 O-C-N 121.068 -1.02 . . . . 0.28 109.522 -179.901 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' D' D ' 331' ' ' GLN . . . . . . . . . . . . . 1.5 tp60 -87.83 112.27 22.29 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.263 -0.898 . . . . 0.93 109.545 179.968 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' D' D ' 332' ' ' ILE . . . . . 0.611 HG21 ' HA ' ' D' ' 338' ' ' PHE . 64.4 mt -103.33 102.85 14.25 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.45 0 O-C-N 121.217 -0.927 . . . . 0.25 109.415 179.835 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' D' D ' 333' ' ' ARG . . . . . 0.541 ' HG2' ' CE2' ' B' ' 327' ' ' TYR . 0.0 OUTLIER -72.33 144.42 48.31 Favored 'General case' 0 N--CA 1.488 1.463 0 O-C-N 121.361 -0.837 . . . . 2.93 109.724 -179.981 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' D' D ' 334' ' ' GLY . . . . . . . . . . . . . . . 84.75 130.98 2.21 Favored Glycine 0 N--CA 1.492 2.398 0 N-CA-C 109.605 -1.398 . . . . 0.41 109.605 179.933 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' D' D ' 335' ' ' ARG . . . . . 0.445 ' HG3' HH11 ' D' ' 335' ' ' ARG . 0.2 OUTLIER -76.47 -31.79 57.99 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.291 -1.123 . . . . 3.03 109.873 -179.93 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' D' D ' 336' ' ' GLU . . . . . . . . . . . . . 4.5 tp10 -57.13 -62.95 1.4 Allowed 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.107 -0.996 . . . . 2.26 109.651 -179.635 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' D' D ' 337' ' ' ARG . . . . . 0.418 HH11 ' HG3' ' D' ' 337' ' ' ARG . 7.9 mtm-85 -60.23 -31.93 70.64 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.353 -0.842 . . . . 2.92 109.732 -179.824 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' D' D ' 338' ' ' PHE . . . . . 0.611 ' HA ' HG21 ' D' ' 332' ' ' ILE . 72.2 t80 -56.47 -55.74 29.92 Favored 'General case' 0 C--N 1.302 -1.459 0 O-C-N 121.132 -0.98 . . . . 0.37 109.992 -179.858 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' D' D ' 339' ' ' GLU . . . . . . . . . . . . . 96.5 mt-10 -52.16 -37.97 56.18 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.291 -0.881 . . . . 1.99 110.335 -179.399 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' D' D ' 340' ' ' MET . . . . . 0.457 ' SD ' ' OE1' ' A' ' 343' ' ' GLU . 28.3 ttp -62.84 -47.95 81.18 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.208 -0.932 . . . . 0.31 110.199 -179.292 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' D' D ' 341' ' ' PHE . . . . . . . . . . . . . 50.3 m-85 -62.69 -40.75 98.1 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.195 -0.941 . . . . 0.18 109.747 -179.755 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' D' D ' 342' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -50.86 -43.38 59.4 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.219 -0.925 . . . . 2.41 109.926 -179.882 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' D' D ' 343' ' ' GLU . . . . . 0.479 ' OE2' HD11 ' C' ' 348' ' ' LEU . 1.6 tt0 -58.14 -46.87 84.9 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.378 -0.826 . . . . 2.35 109.672 -179.618 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' D' D ' 344' ' ' LEU . . . . . . . . . . . . . 34.5 mt -61.35 -33.15 73.16 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.14 -0.975 . . . . 0.19 109.176 179.96 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' D' D ' 345' ' ' ASN . . . . . . . . . . . . . 12.2 t-20 -57.99 -56.31 23.62 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.449 -0.782 . . . . 1.09 109.723 179.972 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' D' D ' 346' ' ' GLU . . . . . . . . . . . . . 56.8 tt0 -63.63 -28.6 70.03 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.163 -0.96 . . . . 1.69 110.161 -179.518 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' D' D ' 347' ' ' ALA . . . . . 0.717 ' HB1' ' HB1' ' C' ' 347' ' ' ALA . . . -61.16 -61.65 2.41 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.051 -1.031 . . . . 0.18 109.846 -179.674 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' D' D ' 348' ' ' LEU . . . . . 0.589 HD22 ' N ' ' D' ' 348' ' ' LEU . 3.9 mm? -61.74 -40.9 96.73 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.17 -0.956 . . . . 0.31 109.896 -179.695 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' D' D ' 349' ' ' GLU . . . . . . . . . . . . . 96.8 mt-10 -58.49 -34.39 70.87 Favored 'General case' 0 N--CA 1.495 1.787 0 O-C-N 121.281 -0.887 . . . . 1.95 109.895 -179.737 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' D' D ' 350' ' ' LEU . . . . . 1.041 HD13 HD22 ' C' ' 350' ' ' LEU . 3.8 tt -64.75 -46.84 80.48 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.229 -0.919 . . . . 0.43 109.672 -179.688 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' D' D ' 351' ' ' LYS . . . . . . . . . . . . . 18.6 tttm -59.08 -41.97 89.3 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.317 -0.864 . . . . 1.4 109.987 -179.641 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' D' D ' 352' ' ' ASP . . . . . . . . . . . . . 38.3 m-20 -53.83 -39.67 65.77 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.155 -0.966 . . . . 1.17 109.42 179.921 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' D' D ' 353' ' ' ALA . . . . . . . . . . . . . . . -67.24 -31.97 72.69 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.217 -0.927 . . . . 0.59 109.586 -179.995 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' D' D ' 354' ' ' GLN . . . . . . . . . . . . . 3.5 tt0 . . . . . 0 N--CA 1.488 1.463 0 O-C-N 121.209 -0.932 . . . . 1.44 109.667 -179.862 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 326' ' ' GLU . . . . . . . . . . . . . 2.8 mt-10 . . . . . 0 N--CA 1.488 1.454 0 CA-C-O 121.385 0.612 . . . . 2.13 109.397 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 327' ' ' TYR . . . . . 0.535 ' CE1' ' HG2' ' C' ' 333' ' ' ARG . 41.0 m-85 -150.54 112.68 4.6 Favored 'General case' 0 C--N 1.303 -1.449 0 O-C-N 121.071 -1.018 . . . . 0.48 109.56 179.753 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 328' ' ' PHE . . . . . 0.416 ' HB2' ' CD1' ' C' ' 338' ' ' PHE . 69.6 m-85 -112.99 -171.53 1.88 Allowed 'General case' 0 N--CA 1.488 1.475 0 O-C-N 121.386 -0.821 . . . . 0.31 109.083 179.952 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 329' ' ' THR . . . . . . . . . . . . . 35.3 p -152.39 168.88 24.04 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.254 -0.904 . . . . 0.22 109.387 179.908 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 330' ' ' LEU . . . . . 0.463 ' O ' ' HA ' ' C' ' 329' ' ' THR . 23.3 tp -152.15 132.54 13.75 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.207 -0.933 . . . . 0.28 109.679 -179.71 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 331' ' ' GLN . . . . . 0.42 ' OE1' ' O ' ' C' ' 328' ' ' PHE . 9.2 tp-100 -87.05 114.09 23.36 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.15 -0.969 . . . . 0.91 109.325 179.692 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 332' ' ' ILE . . . . . 0.758 HG21 ' HA ' ' A' ' 338' ' ' PHE . 57.9 mt -103.96 103.9 15.92 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.59 0 O-C-N 121.22 -0.925 . . . . 0.26 109.97 -179.572 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 333' ' ' ARG . . . . . 0.488 ' HG3' ' CD2' ' C' ' 327' ' ' TYR . 5.5 mpt_? -74.19 150.96 40.1 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.191 -0.943 . . . . 2.92 109.508 179.477 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 334' ' ' GLY . . . . . . . . . . . . . . . 74.39 131.25 0.22 Allowed Glycine 0 N--CA 1.491 2.349 0 N-CA-C 109.902 -1.279 . . . . 0.4 109.902 179.519 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 335' ' ' ARG . . . . . 0.494 ' NH1' ' HG2' ' A' ' 335' ' ' ARG . 1.9 ttt-85 -79.39 -27.96 41.86 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.47 -1.018 . . . . 3.01 109.585 179.976 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 336' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -58.13 -66.95 0.4 Allowed 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.344 -0.847 . . . . 2.29 109.781 -179.953 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 337' ' ' ARG . . . . . 0.48 ' NH2' ' OD1' ' C' ' 352' ' ' ASP . 3.0 mtt180 -60.17 -29.57 68.77 Favored 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.091 -1.006 . . . . 2.93 109.456 -179.817 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 338' ' ' PHE . . . . . 0.758 ' HA ' HG21 ' A' ' 332' ' ' ILE . 54.9 t80 -55.56 -60.09 3.92 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.129 -0.982 . . . . 0.38 109.802 -179.901 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 339' ' ' GLU . . . . . . . . . . . . . 1.6 mm-40 -50.41 -34.88 26.06 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.291 -0.881 . . . . 1.97 109.701 -179.609 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 340' ' ' MET . . . . . . . . . . . . . 41.8 ttp -63.3 -48.4 78.23 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.155 -0.966 . . . . 0.31 109.751 -179.83 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 341' ' ' PHE . . . . . . . . . . . . . 44.6 m-85 -62.21 -53.15 59.39 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.213 -0.929 . . . . 0.18 109.704 -179.956 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 342' ' ' ARG . . . . . 0.458 ' NH1' ' CG ' ' A' ' 342' ' ' ARG . 0.0 OUTLIER -45.68 -41.27 10.24 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.351 -0.843 . . . . 2.42 109.832 -179.881 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 343' ' ' GLU . . . . . . . . . . . . . 8.8 tp10 -59.37 -46.65 88.07 Favored 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.2 -0.937 . . . . 2.35 109.661 -179.816 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 344' ' ' LEU . . . . . 0.681 HD22 HD22 ' B' ' 344' ' ' LEU . 56.9 mt -62.06 -44.49 96.58 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.153 -0.967 . . . . 0.18 110.112 -179.586 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 345' ' ' ASN . . . . . 0.614 HD22 HD11 ' C' ' 330' ' ' LEU . 41.5 t-20 -55.68 -43.15 76.09 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.176 -0.953 . . . . 1.09 109.626 -179.625 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 346' ' ' GLU . . . . . . . . . . . . . 43.4 tt0 -61.13 -38.69 87.25 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.085 -1.009 . . . . 1.65 109.362 -179.921 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 347' ' ' ALA . . . . . 1.003 ' HB1' ' HB1' ' B' ' 347' ' ' ALA . . . -60.03 -50.27 74.39 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.305 -0.872 . . . . 0.18 109.898 -179.758 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 348' ' ' LEU . . . . . 0.559 HD22 ' N ' ' A' ' 348' ' ' LEU . 3.9 mm? -61.05 -47.3 86.99 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.235 -0.916 . . . . 0.3 110.065 -179.413 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 349' ' ' GLU . . . . . . . . . . . . . 1.6 mm-40 -57.54 -36.27 71.4 Favored 'General case' 0 N--CA 1.489 1.485 0 O-C-N 121.213 -0.929 . . . . 1.94 109.821 -179.347 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 350' ' ' LEU . . . . . 0.696 HD13 HD22 ' B' ' 350' ' ' LEU . 5.2 tt -62.07 -44.71 96.09 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.13 -0.981 . . . . 0.46 109.073 -179.992 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 351' ' ' LYS . . . . . . . . . . . . . 26.1 tttp -58.21 -44.83 88.35 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.31 -0.869 . . . . 1.4 109.239 179.762 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 352' ' ' ASP . . . . . . . . . . . . . 5.4 m-20 -56.46 -41.16 76.03 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.256 -0.903 . . . . 1.16 109.461 179.893 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 353' ' ' ALA . . . . . . . . . . . . . . . -67.45 -32.83 73.95 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.35 -0.844 . . . . 0.63 109.32 -179.963 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 354' ' ' GLN . . . . . . . . . . . . . 7.4 tt0 . . . . . 0 N--CA 1.489 1.489 0 O-C-N 121.179 -0.951 . . . . 1.47 109.167 179.693 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' B' B ' 326' ' ' GLU . . . . . . . . . . . . . 2.7 mt-10 . . . . . 0 N--CA 1.489 1.489 0 CA-C-O 121.247 0.546 . . . . 2.13 109.631 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' B' B ' 327' ' ' TYR . . . . . . . . . . . . . 41.3 m-85 -149.91 112.65 4.78 Favored 'General case' 0 N--CA 1.489 1.491 0 O-C-N 121.089 -1.007 . . . . 0.48 109.635 179.751 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 328' ' ' PHE . . . . . 0.446 ' O ' ' OE1' ' D' ' 331' ' ' GLN . 67.7 m-85 -113.57 -172.75 2.13 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.439 -0.788 . . . . 0.32 109.244 179.879 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 329' ' ' THR . . . . . . . . . . . . . 37.1 p -151.81 168.95 23.48 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.134 -0.979 . . . . 0.23 109.515 -179.799 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 330' ' ' LEU . . . . . . . . . . . . . 20.8 tp -152.29 132.66 13.71 Favored 'General case' 0 C--N 1.304 -1.398 0 O-C-N 121.039 -1.038 . . . . 0.28 109.532 -179.726 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 331' ' ' GLN . . . . . . . . . . . . . 9.0 tp-100 -87.03 114.01 23.27 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.33 -0.856 . . . . 0.91 109.354 179.727 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 332' ' ' ILE . . . . . 0.753 HG21 ' HA ' ' B' ' 338' ' ' PHE . 57.4 mt -103.94 103.54 15.37 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.633 0 O-C-N 121.151 -0.968 . . . . 0.24 110.11 -179.598 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 333' ' ' ARG . . . . . 0.494 ' CG ' ' CE1' ' D' ' 327' ' ' TYR . 5.7 mpt_? -73.65 150.8 41.07 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.193 -0.942 . . . . 2.93 109.399 179.798 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 334' ' ' GLY . . . . . . . . . . . . . . . 74.8 131.07 0.24 Allowed Glycine 0 N--CA 1.49 2.264 0 N-CA-C 109.857 -1.297 . . . . 0.4 109.857 179.417 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 335' ' ' ARG . . . . . 0.507 ' HG2' ' NH1' ' B' ' 335' ' ' ARG . 1.9 ttt-85 -79.46 -27.48 41.6 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.442 -1.034 . . . . 3.01 109.605 -179.976 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 336' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -58.42 -66.84 0.42 Allowed 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.341 -0.849 . . . . 2.28 109.63 -179.902 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 337' ' ' ARG . . . . . . . . . . . . . 3.0 mtt180 -60.23 -29.4 68.73 Favored 'General case' 0 N--CA 1.489 1.492 0 O-C-N 121.202 -0.936 . . . . 2.93 109.653 -179.841 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 338' ' ' PHE . . . . . 0.753 ' HA ' HG21 ' B' ' 332' ' ' ILE . 58.5 t80 -55.53 -60.0 4.04 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.257 -0.902 . . . . 0.37 109.872 -179.877 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 339' ' ' GLU . . . . . . . . . . . . . 1.9 mm-40 -50.66 -35.16 29.38 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.347 -0.845 . . . . 1.98 109.687 -179.615 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 340' ' ' MET . . . . . . . . . . . . . 43.4 ttp -63.19 -48.49 78.14 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.164 -0.96 . . . . 0.32 109.722 -179.702 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 341' ' ' PHE . . . . . . . . . . . . . 45.4 m-85 -62.56 -52.31 63.91 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.124 -0.985 . . . . 0.18 109.81 179.933 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 342' ' ' ARG . . . . . 0.439 ' CG ' HH11 ' B' ' 342' ' ' ARG . 0.0 OUTLIER -46.26 -40.98 12.4 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.266 -0.896 . . . . 2.42 109.693 -179.803 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' B' B ' 343' ' ' GLU . . . . . . . . . . . . . 8.9 tp10 -59.52 -46.47 88.75 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.255 -0.903 . . . . 2.35 109.611 -179.816 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 344' ' ' LEU . . . . . 0.681 HD22 HD22 ' A' ' 344' ' ' LEU . 57.7 mt -62.18 -44.88 95.62 Favored 'General case' 0 N--CA 1.49 1.525 0 O-C-N 121.177 -0.952 . . . . 0.18 110.219 -179.608 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 345' ' ' ASN . . . . . 0.535 HD22 HD11 ' D' ' 330' ' ' LEU . 43.1 t-20 -55.59 -42.64 75.08 Favored 'General case' 0 N--CA 1.489 1.476 0 O-C-N 121.177 -0.952 . . . . 1.09 109.694 -179.532 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 346' ' ' GLU . . . . . . . . . . . . . 40.9 tt0 -61.06 -39.02 88.28 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.251 -0.905 . . . . 1.66 109.391 -179.894 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 347' ' ' ALA . . . . . 1.003 ' HB1' ' HB1' ' A' ' 347' ' ' ALA . . . -60.21 -50.17 74.71 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.324 -0.86 . . . . 0.17 109.964 -179.857 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 348' ' ' LEU . . . . . 0.56 HD22 ' N ' ' B' ' 348' ' ' LEU . 3.9 mm? -60.81 -47.53 85.91 Favored 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.285 -0.884 . . . . 0.29 109.973 -179.369 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 349' ' ' GLU . . . . . . . . . . . . . 1.5 mm-40 -57.65 -35.56 70.69 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.222 -0.923 . . . . 1.95 109.983 -179.574 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 350' ' ' LEU . . . . . 0.696 HD22 HD13 ' A' ' 350' ' ' LEU . 5.2 tt -62.67 -44.69 95.6 Favored 'General case' 0 N--CA 1.489 1.505 0 O-C-N 120.968 -1.083 . . . . 0.45 108.999 179.799 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 351' ' ' LYS . . . . . . . . . . . . . 28.2 tttp -58.82 -44.69 90.9 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.195 -0.941 . . . . 1.38 109.428 179.647 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 352' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 -56.44 -41.85 77.15 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.261 -0.899 . . . . 1.16 109.286 179.659 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 353' ' ' ALA . . . . . . . . . . . . . . . -66.63 -32.77 74.31 Favored 'General case' 0 N--CA 1.494 1.749 0 O-C-N 121.27 -0.894 . . . . 0.61 109.47 179.656 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 354' ' ' GLN . . . . . 0.424 ' NE2' HD11 ' A' ' 350' ' ' LEU . 7.8 tt0 . . . . . 0 C--N 1.304 -1.387 0 O-C-N 121.222 -0.924 . . . . 1.45 109.38 179.951 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' C' C ' 326' ' ' GLU . . . . . . . . . . . . . 11.6 mm-40 . . . . . 0 N--CA 1.49 1.572 0 CA-C-O 121.248 0.547 . . . . 2.17 109.578 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' C' C ' 327' ' ' TYR . . . . . 0.488 ' CD2' ' HG3' ' A' ' 333' ' ' ARG . 59.5 m-85 -150.85 103.21 3.05 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.176 -0.953 . . . . 0.48 109.698 -179.877 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' C' C ' 328' ' ' PHE . . . . . 0.439 ' C ' HG23 ' C' ' 329' ' ' THR . 38.3 m-85 -102.13 -169.13 1.63 Allowed 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.294 -0.879 . . . . 0.33 109.432 -179.984 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' C' C ' 329' ' ' THR . . . . . 0.463 ' HA ' ' O ' ' A' ' 330' ' ' LEU . 68.1 p -154.41 170.4 21.46 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.107 -0.996 . . . . 0.23 109.259 179.991 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' C' C ' 330' ' ' LEU . . . . . 0.614 HD11 HD22 ' A' ' 345' ' ' ASN . 22.6 tp -151.31 124.76 8.91 Favored 'General case' 0 N--CA 1.489 1.495 0 O-C-N 121.272 -0.893 . . . . 0.28 109.746 -179.692 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' C' C ' 331' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -87.24 112.49 22.07 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.289 -0.882 . . . . 1.48 109.189 179.522 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' C' C ' 332' ' ' ILE . . . . . 0.541 HG21 ' HA ' ' C' ' 338' ' ' PHE . 94.2 mt -103.84 111.12 32.28 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.528 0 O-C-N 121.105 -0.997 . . . . 0.24 109.632 -179.895 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' C' C ' 333' ' ' ARG . . . . . 0.535 ' HG2' ' CE1' ' A' ' 327' ' ' TYR . 61.2 mtm180 -74.24 141.78 45.36 Favored 'General case' 0 C--N 1.301 -1.503 0 O-C-N 121.458 -0.776 . . . . 2.74 109.517 179.718 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' C' C ' 334' ' ' GLY . . . . . . . . . . . . . . . 86.73 132.85 3.43 Favored Glycine 0 N--CA 1.492 2.381 0 N-CA-C 109.667 -1.373 . . . . 0.35 109.667 179.921 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' C' C ' 335' ' ' ARG . . . . . . . . . . . . . 6.6 ttm180 -78.28 -27.21 47.36 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.264 -1.139 . . . . 2.53 109.437 179.889 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' C' C ' 336' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -58.02 -70.76 0.13 Allowed 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.411 -0.805 . . . . 2.62 110.126 -179.864 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' C' C ' 337' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -57.98 -30.66 66.21 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.328 -0.857 . . . . 2.81 109.677 -179.372 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' C' C ' 338' ' ' PHE . . . . . 0.541 ' HA ' HG21 ' C' ' 332' ' ' ILE . 77.8 t80 -53.38 -60.39 3.36 Favored 'General case' 0 C--N 1.303 -1.438 0 O-C-N 121.167 -0.958 . . . . 0.4 109.545 -179.797 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' C' C ' 339' ' ' GLU . . . . . . . . . . . . . 51.5 mt-10 -51.22 -32.41 23.94 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.391 -0.818 . . . . 2.05 109.954 -179.64 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' C' C ' 340' ' ' MET . . . . . . . . . . . . . 59.2 ttp -64.16 -51.12 65.38 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.222 -0.923 . . . . 0.32 109.643 -179.944 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' C' C ' 341' ' ' PHE . . . . . . . . . . . . . 49.3 m-85 -62.08 -49.86 74.25 Favored 'General case' 0 N--CA 1.489 1.495 0 O-C-N 121.184 -0.948 . . . . 0.18 110.022 -179.597 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' C' C ' 342' ' ' ARG . . . . . 0.419 ' O ' ' HB3' ' C' ' 345' ' ' ASN . 22.7 tpt180 -49.32 -37.41 24.21 Favored 'General case' 0 N--CA 1.488 1.451 0 O-C-N 121.09 -1.006 . . . . 2.91 109.552 -179.879 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' C' C ' 343' ' ' GLU . . . . . . . . . . . . . 1.1 tp10 -59.18 -52.33 66.16 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.233 -0.917 . . . . 2.14 109.566 179.868 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' C' C ' 344' ' ' LEU . . . . . 0.626 HD22 HD22 ' D' ' 344' ' ' LEU . 60.0 mt -62.59 -25.5 68.11 Favored 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.157 -0.964 . . . . 0.22 109.242 179.803 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' C' C ' 345' ' ' ASN . . . . . 0.419 ' HB3' ' O ' ' C' ' 342' ' ' ARG . 16.2 t-20 -57.86 -56.8 17.28 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.414 -0.803 . . . . 1.08 109.383 -179.896 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' C' C ' 346' ' ' GLU . . . . . . . . . . . . . 20.8 tt0 -62.03 -29.45 70.29 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.34 -0.85 . . . . 2.21 110.042 -179.641 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' C' C ' 347' ' ' ALA . . . . . 0.996 ' HB1' ' HB1' ' D' ' 347' ' ' ALA . . . -61.29 -54.54 42.75 Favored 'General case' 0 N--CA 1.494 1.74 0 O-C-N 121.018 -1.051 . . . . 0.18 110.199 -179.311 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' C' C ' 348' ' ' LEU . . . . . 0.568 HD22 ' N ' ' C' ' 348' ' ' LEU . 4.2 mm? -61.7 -51.49 68.18 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.318 -0.864 . . . . 0.32 110.463 -179.402 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' C' C ' 349' ' ' GLU . . . . . . . . . . . . . 11.5 mt-10 -57.41 -33.37 67.79 Favored 'General case' 0 N--CA 1.494 1.757 0 O-C-N 121.11 -0.994 . . . . 2.19 110.244 -179.352 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' C' C ' 350' ' ' LEU . . . . . 0.809 HD22 HD13 ' D' ' 350' ' ' LEU . 9.3 tt -62.9 -42.86 99.93 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.116 -0.99 . . . . 0.46 109.365 -179.758 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' C' C ' 351' ' ' LYS . . . . . . . . . . . . . 38.4 tttp -60.14 -51.62 68.82 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.288 -0.882 . . . . 1.35 109.445 179.547 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' C' C ' 352' ' ' ASP . . . . . 0.48 ' OD1' ' NH2' ' A' ' 337' ' ' ARG . 18.1 m-20 -55.46 -37.91 68.37 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.297 -0.877 . . . . 1.19 109.84 179.887 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' C' C ' 353' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 1.565 0 O-C-N 121.298 -0.876 . . . . 0.57 109.958 -179.581 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' D' D ' 326' ' ' GLU . . . . . . . . . . . . . 2.6 mt-10 . . . . . 0 N--CA 1.491 1.578 0 N-CA-C 109.469 -0.567 . . . . 2.13 109.469 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' D' D ' 327' ' ' TYR . . . . . 0.494 ' CE1' ' CG ' ' B' ' 333' ' ' ARG . 42.5 m-85 -150.53 112.49 4.55 Favored 'General case' 0 N--CA 1.488 1.442 0 O-C-N 121.204 -0.935 . . . . 0.47 109.421 179.913 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' D' D ' 328' ' ' PHE . . . . . 0.411 ' HB2' ' CD1' ' B' ' 338' ' ' PHE . 69.7 m-85 -114.06 -173.02 2.2 Favored 'General case' 0 N--CA 1.489 1.52 0 N-CA-C 108.985 -0.746 . . . . 0.3 108.985 179.802 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' D' D ' 329' ' ' THR . . . . . . . . . . . . . 39.7 p -151.44 169.65 21.52 Favored 'General case' 0 C--N 1.302 -1.473 0 O-C-N 121.288 -0.883 . . . . 0.22 109.379 -179.916 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' D' D ' 330' ' ' LEU . . . . . 0.535 HD11 HD22 ' B' ' 345' ' ' ASN . 19.5 tp -152.4 132.4 13.41 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.311 -0.868 . . . . 0.28 109.706 -179.767 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' D' D ' 331' ' ' GLN . . . . . 0.446 ' OE1' ' O ' ' B' ' 328' ' ' PHE . 9.0 tp-100 -86.83 113.77 22.92 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.313 -0.867 . . . . 0.93 109.306 179.639 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' D' D ' 332' ' ' ILE . . . . . 0.747 HG21 ' HA ' ' D' ' 338' ' ' PHE . 54.3 mt -103.72 102.97 14.46 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.746 0 O-C-N 121.242 -0.911 . . . . 0.25 110.235 -179.593 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' D' D ' 333' ' ' ARG . . . . . . . . . . . . . 5.6 mpt_? -73.45 150.92 41.31 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.027 -1.045 . . . . 2.93 109.639 179.615 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' D' D ' 334' ' ' GLY . . . . . . . . . . . . . . . 74.86 130.73 0.24 Allowed Glycine 0 N--CA 1.491 2.33 0 N-CA-C 109.836 -1.305 . . . . 0.41 109.836 179.57 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' D' D ' 335' ' ' ARG . . . . . 0.507 ' HG2' ' NH1' ' D' ' 335' ' ' ARG . 1.9 ttt-85 -79.06 -27.88 43.14 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.299 -1.118 . . . . 3.03 109.642 -179.997 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' D' D ' 336' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -57.71 -66.54 0.45 Allowed 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.21 -0.931 . . . . 2.26 109.695 -179.937 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' D' D ' 337' ' ' ARG . . . . . . . . . . . . . 2.9 mpt_? -60.73 -29.29 69.28 Favored 'General case' 0 N--CA 1.489 1.486 0 O-C-N 121.223 -0.923 . . . . 2.92 109.386 -179.772 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' D' D ' 338' ' ' PHE . . . . . 0.747 ' HA ' HG21 ' D' ' 332' ' ' ILE . 57.1 t80 -55.52 -60.55 3.26 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.19 -0.944 . . . . 0.37 109.611 -179.785 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' D' D ' 339' ' ' GLU . . . . . . . . . . . . . 2.2 mm-40 -49.91 -34.9 21.8 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.259 -0.901 . . . . 1.99 109.898 -179.745 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' D' D ' 340' ' ' MET . . . . . . . . . . . . . 42.0 ttp -63.36 -48.87 76.15 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.144 -0.972 . . . . 0.31 109.796 -179.663 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' D' D ' 341' ' ' PHE . . . . . . . . . . . . . 45.9 m-85 -62.39 -52.64 62.81 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.137 -0.977 . . . . 0.18 109.583 -179.875 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' D' D ' 342' ' ' ARG . . . . . 0.457 ' CG ' HH11 ' D' ' 342' ' ' ARG . 0.0 OUTLIER -45.78 -40.58 9.8 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.24 -0.913 . . . . 2.41 109.638 -179.896 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' D' D ' 343' ' ' GLU . . . . . . . . . . . . . 9.1 tp10 -59.67 -46.56 88.67 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.171 -0.956 . . . . 2.35 109.724 -179.835 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' D' D ' 344' ' ' LEU . . . . . 0.626 HD22 HD22 ' C' ' 344' ' ' LEU . 57.1 mt -62.5 -44.92 95.19 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.289 -0.882 . . . . 0.19 110.186 -179.374 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' D' D ' 345' ' ' ASN . . . . . . . . . . . . . 44.9 t-20 -55.52 -42.47 74.58 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.176 -0.953 . . . . 1.09 109.632 -179.622 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' D' D ' 346' ' ' GLU . . . . . . . . . . . . . 33.7 tt0 -60.86 -39.49 89.36 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.204 -0.935 . . . . 1.69 109.614 -179.962 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' D' D ' 347' ' ' ALA . . . . . 0.996 ' HB1' ' HB1' ' C' ' 347' ' ' ALA . . . -60.5 -49.62 76.83 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.393 -0.817 . . . . 0.18 109.97 -179.861 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' D' D ' 348' ' ' LEU . . . . . 0.555 HD22 ' N ' ' D' ' 348' ' ' LEU . 3.9 mm? -60.93 -47.18 87.62 Favored 'General case' 0 N--CA 1.493 1.711 0 O-C-N 121.237 -0.914 . . . . 0.31 110.024 -179.327 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' D' D ' 349' ' ' GLU . . . . . . . . . . . . . 1.4 mm-40 -58.12 -36.01 72.32 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.11 -0.994 . . . . 1.95 109.796 -179.66 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' D' D ' 350' ' ' LEU . . . . . 0.809 HD13 HD22 ' C' ' 350' ' ' LEU . 5.2 tt -62.32 -44.54 96.26 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.124 -0.985 . . . . 0.43 109.01 -179.971 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' D' D ' 351' ' ' LYS . . . . . . . . . . . . . 28.4 tttp -59.09 -44.64 91.93 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.292 -0.88 . . . . 1.4 109.289 179.767 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' D' D ' 352' ' ' ASP . . . . . . . . . . . . . 4.2 m-20 -56.66 -41.2 76.81 Favored 'General case' 0 N--CA 1.488 1.434 0 O-C-N 121.343 -0.848 . . . . 1.17 109.255 179.823 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' D' D ' 353' ' ' ALA . . . . . . . . . . . . . . . -67.63 -31.81 72.08 Favored 'General case' 0 N--CA 1.488 1.447 0 O-C-N 121.22 -0.925 . . . . 0.59 109.31 -179.799 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' D' D ' 354' ' ' GLN . . . . . . . . . . . . . 7.6 tt0 . . . . . 0 N--CA 1.49 1.557 0 O-C-N 121.442 -0.786 . . . . 1.44 109.485 179.897 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 326' ' ' GLU . . . . . . . . . . . . . 19.9 mm-40 . . . . . 0 N--CA 1.487 1.422 0 N-CA-C 109.217 -0.66 . . . . 2.13 109.217 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 327' ' ' TYR . . . . . 0.606 ' CE2' ' HG2' ' C' ' 333' ' ' ARG . 42.4 m-85 -148.14 109.24 4.29 Favored 'General case' 0 C--N 1.302 -1.499 0 O-C-N 121.317 -0.864 . . . . 0.48 109.318 -179.938 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 328' ' ' PHE . . . . . 0.417 ' C ' HG23 ' A' ' 329' ' ' THR . 81.5 m-85 -110.65 -170.22 1.6 Allowed 'General case' 0 N--CA 1.488 1.446 0 O-C-N 121.356 -0.84 . . . . 0.31 109.344 -179.901 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 329' ' ' THR . . . . . 0.417 HG23 ' C ' ' A' ' 328' ' ' PHE . 73.2 p -153.7 162.22 41.43 Favored 'General case' 0 C--N 1.302 -1.462 0 O-C-N 121.267 -0.896 . . . . 0.22 109.3 -179.905 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 330' ' ' LEU . . . . . 0.481 ' O ' ' HA ' ' C' ' 329' ' ' THR . 15.8 tp -149.32 130.06 14.14 Favored 'General case' 0 N--CA 1.488 1.434 0 O-C-N 121.166 -0.959 . . . . 0.28 109.367 -179.752 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 331' ' ' GLN . . . . . . . . . . . . . 2.0 tp60 -86.03 121.64 28.93 Favored 'General case' 0 N--CA 1.489 1.482 0 O-C-N 121.35 -0.844 . . . . 0.91 109.54 -179.906 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 332' ' ' ILE . . . . . 0.875 HG21 ' HA ' ' A' ' 338' ' ' PHE . 72.1 mt -103.45 103.73 15.59 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.561 0 O-C-N 121.238 -0.914 . . . . 0.26 109.425 -179.999 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 333' ' ' ARG . . . . . 0.559 ' HG2' ' CE1' ' C' ' 327' ' ' TYR . 0.3 OUTLIER -72.68 146.24 46.66 Favored 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.258 -0.901 . . . . 2.92 109.461 -179.985 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 334' ' ' GLY . . . . . . . . . . . . . . . 75.68 119.67 0.13 Allowed Glycine 0 N--CA 1.491 2.319 0 N-CA-C 109.621 -1.392 . . . . 0.4 109.621 179.993 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 335' ' ' ARG . . . . . 0.456 ' O ' ' HB3' ' A' ' 338' ' ' PHE . 1.8 ttt180 -65.6 -27.31 68.31 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.308 -1.113 . . . . 3.01 109.612 179.951 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 336' ' ' GLU . . . . . . . . . . . . . 23.4 tt0 -57.37 -63.79 1.11 Allowed 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.198 -0.939 . . . . 2.29 109.656 -179.941 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 337' ' ' ARG . . . . . 0.54 ' HG3' ' NH1' ' A' ' 337' ' ' ARG . 0.6 OUTLIER -60.03 -27.15 66.68 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.193 -0.942 . . . . 2.93 109.376 -179.93 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 338' ' ' PHE . . . . . 0.875 ' HA ' HG21 ' A' ' 332' ' ' ILE . 83.8 t80 -55.31 -61.61 2.22 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.38 -0.825 . . . . 0.38 109.841 -179.808 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 339' ' ' GLU . . . . . . . . . . . . . 18.0 mt-10 -51.54 -33.62 32.89 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.26 -0.9 . . . . 1.97 110.164 -179.543 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 340' ' ' MET . . . . . . . . . . . . . 38.0 ttp -64.38 -52.7 56.96 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.126 -0.984 . . . . 0.31 110.453 -179.353 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 341' ' ' PHE . . . . . . . . . . . . . 42.5 m-85 -62.1 -46.22 90.02 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.164 -0.96 . . . . 0.18 110.142 -179.284 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 342' ' ' ARG . . . . . 0.451 ' CG ' HH11 ' A' ' 342' ' ' ARG . 0.0 OUTLIER -48.17 -38.51 18.27 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.054 -1.029 . . . . 2.42 109.883 -179.678 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 343' ' ' GLU . . . . . . . . . . . . . 33.3 tt0 -59.76 -51.27 70.5 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.113 -0.992 . . . . 2.35 109.833 -179.757 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 344' ' ' LEU . . . . . 0.652 HD22 HD22 ' B' ' 344' ' ' LEU . 34.9 mt -61.57 -31.39 71.43 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.154 -0.966 . . . . 0.18 109.556 -179.817 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 345' ' ' ASN . . . . . . . . . . . . . 13.2 t-20 -57.82 -60.3 3.91 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.297 -0.877 . . . . 1.09 109.72 -179.868 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 346' ' ' GLU . . . . . . . . . . . . . 26.1 tt0 -61.25 -26.45 67.77 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.295 -0.878 . . . . 1.65 109.916 -179.723 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 347' ' ' ALA . . . . . 0.879 ' HB1' ' HB1' ' B' ' 347' ' ' ALA . . . -61.11 -58.98 6.12 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.196 -0.94 . . . . 0.18 109.966 -179.81 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 348' ' ' LEU . . . . . 0.784 HD12 ' NH2' ' C' ' 337' ' ' ARG . 3.8 mm? -62.22 -42.19 99.08 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.237 -0.914 . . . . 0.3 109.974 -179.541 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 349' ' ' GLU . . . . . . . . . . . . . 31.5 mt-10 -57.67 -37.51 73.54 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.209 -0.932 . . . . 1.94 110.209 -179.287 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 350' ' ' LEU . . . . . 0.699 HD13 HD22 ' B' ' 350' ' ' LEU . 6.0 tt -64.37 -44.38 91.58 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.142 -0.974 . . . . 0.46 109.943 -179.573 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 351' ' ' LYS . . . . . . . . . . . . . 40.1 tttp -57.96 -37.67 74.6 Favored 'General case' 0 N--CA 1.488 1.466 0 O-C-N 121.093 -1.004 . . . . 1.4 109.508 -179.676 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 352' ' ' ASP . . . . . . . . . . . . . 11.3 m-20 -55.34 -41.44 72.51 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.278 -0.889 . . . . 1.16 109.42 179.868 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 353' ' ' ALA . . . . . . . . . . . . . . . -67.81 -30.76 70.26 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.282 -0.886 . . . . 0.63 109.707 -179.866 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 354' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 N--CA 1.492 1.636 0 O-C-N 121.154 -0.966 . . . . 1.47 109.631 -179.948 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 326' ' ' GLU . . . . . . . . . . . . . 20.0 mm-40 . . . . . 0 N--CA 1.487 1.421 0 N-CA-C 109.138 -0.689 . . . . 2.13 109.138 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' B' B ' 327' ' ' TYR . . . . . 0.466 ' CE1' ' HG2' ' D' ' 333' ' ' ARG . 41.7 m-85 -148.4 109.24 4.24 Favored 'General case' 0 N--CA 1.488 1.471 0 O-C-N 121.24 -0.913 . . . . 0.48 109.345 179.988 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 328' ' ' PHE . . . . . 0.413 ' C ' HG23 ' B' ' 329' ' ' THR . 81.3 m-85 -110.56 -170.23 1.6 Allowed 'General case' 0 N--CA 1.489 1.488 0 O-C-N 121.287 -0.883 . . . . 0.32 109.374 -179.869 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 329' ' ' THR . . . . . 0.413 HG23 ' C ' ' B' ' 328' ' ' PHE . 73.6 p -153.68 162.17 41.48 Favored 'General case' 0 N--CA 1.488 1.443 0 O-C-N 121.254 -0.904 . . . . 0.23 109.312 -179.99 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 330' ' ' LEU . . . . . . . . . . . . . 15.9 tp -149.13 130.18 14.42 Favored 'General case' 0 N--CA 1.488 1.469 0 O-C-N 121.288 -0.883 . . . . 0.28 109.476 -179.869 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 331' ' ' GLN . . . . . . . . . . . . . 2.0 tp60 -86.02 121.52 28.76 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.283 -0.885 . . . . 0.91 109.563 -179.957 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 332' ' ' ILE . . . . . 0.873 HG21 ' HA ' ' B' ' 338' ' ' PHE . 71.7 mt -103.37 103.7 15.53 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.526 0 O-C-N 121.248 -0.907 . . . . 0.24 109.519 179.889 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 333' ' ' ARG . . . . . 0.5 ' HG2' ' CE1' ' D' ' 327' ' ' TYR . 0.3 OUTLIER -72.6 146.22 46.81 Favored 'General case' 0 N--CA 1.489 1.487 0 O-C-N 121.219 -0.925 . . . . 2.93 109.527 179.941 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' B' B ' 334' ' ' GLY . . . . . . . . . . . . . . . 75.78 119.56 0.13 Allowed Glycine 0 N--CA 1.49 2.242 0 N-CA-C 109.63 -1.388 . . . . 0.4 109.63 179.992 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 335' ' ' ARG . . . . . 0.483 ' HG3' ' CZ ' ' D' ' 328' ' ' PHE . 1.8 ttt180 -65.61 -27.39 68.37 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.267 -1.137 . . . . 3.01 109.462 -179.961 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 336' ' ' GLU . . . . . . . . . . . . . 23.5 tt0 -57.38 -63.73 1.13 Allowed 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.264 -0.897 . . . . 2.28 109.615 -179.873 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 337' ' ' ARG . . . . . 0.562 ' NH1' ' HG3' ' B' ' 337' ' ' ARG . 0.5 OUTLIER -59.88 -27.24 66.53 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.237 -0.914 . . . . 2.93 109.417 179.937 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' B' B ' 338' ' ' PHE . . . . . 0.873 ' HA ' HG21 ' B' ' 332' ' ' ILE . 84.4 t80 -55.38 -61.48 2.31 Favored 'General case' 0 N--CA 1.488 1.455 0 O-C-N 121.273 -0.892 . . . . 0.37 109.865 -179.722 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 339' ' ' GLU . . . . . . . . . . . . . 18.0 mt-10 -51.67 -33.48 34.03 Favored 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.176 -0.953 . . . . 1.98 110.171 -179.533 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 340' ' ' MET . . . . . . . . . . . . . 38.1 ttp -64.5 -52.75 56.23 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.08 -1.012 . . . . 0.32 110.388 -179.312 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 341' ' ' PHE . . . . . . . . . . . . . 42.2 m-85 -61.96 -46.42 89.35 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.115 -0.99 . . . . 0.18 110.08 -179.285 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 342' ' ' ARG . . . . . 0.455 ' NH1' ' CG ' ' B' ' 342' ' ' ARG . 0.0 OUTLIER -47.98 -38.83 17.78 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.202 -0.936 . . . . 2.42 109.868 -179.691 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' B' B ' 343' ' ' GLU . . . . . . . . . . . . . 33.1 tt0 -59.45 -51.35 70.26 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.139 -0.976 . . . . 2.35 109.818 -179.731 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 344' ' ' LEU . . . . . 0.652 HD22 HD22 ' A' ' 344' ' ' LEU . 34.3 mt -61.57 -31.5 71.55 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.144 -0.972 . . . . 0.18 109.586 -179.757 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 345' ' ' ASN . . . . . . . . . . . . . 13.1 t-20 -57.86 -60.14 4.16 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.302 -0.874 . . . . 1.09 109.747 -179.849 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 346' ' ' GLU . . . . . . . . . . . . . 26.1 tt0 -61.28 -26.63 67.9 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.34 -0.85 . . . . 1.66 109.745 -179.736 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 347' ' ' ALA . . . . . 0.879 ' HB1' ' HB1' ' A' ' 347' ' ' ALA . . . -60.93 -59.17 5.8 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.125 -0.984 . . . . 0.17 109.934 -179.702 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 348' ' ' LEU . . . . . 0.578 HD22 ' N ' ' B' ' 348' ' ' LEU . 3.8 mm? -62.01 -42.15 98.85 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.212 -0.93 . . . . 0.29 110.042 -179.526 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 349' ' ' GLU . . . . . . . . . . . . . 31.6 mt-10 -57.81 -37.38 73.68 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.145 -0.972 . . . . 1.95 110.246 -179.303 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 350' ' ' LEU . . . . . 0.699 HD22 HD13 ' A' ' 350' ' ' LEU . 6.0 tt -64.45 -44.28 91.59 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.163 -0.96 . . . . 0.45 109.969 -179.565 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 351' ' ' LYS . . . . . . . . . . . . . 40.1 tttp -58.01 -37.73 74.85 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.161 -0.962 . . . . 1.38 109.43 -179.704 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 352' ' ' ASP . . . . . . . . . . . . . 11.4 m-20 -55.3 -41.44 72.34 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.219 -0.926 . . . . 1.16 109.45 179.829 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 353' ' ' ALA . . . . . . . . . . . . . . . -67.78 -30.75 70.27 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.29 -0.881 . . . . 0.61 109.705 -179.891 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 354' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 N--CA 1.491 1.587 0 O-C-N 121.18 -0.95 . . . . 1.45 109.577 -179.863 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' C' C ' 326' ' ' GLU . . . . . . . . . . . . . 9.9 mm-40 . . . . . 0 N--CA 1.488 1.47 0 N-CA-C 109.241 -0.652 . . . . 2.17 109.241 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' C' C ' 327' ' ' TYR . . . . . 0.559 ' CE1' ' HG2' ' A' ' 333' ' ' ARG . 41.1 m-85 -148.95 108.16 3.92 Favored 'General case' 0 N--CA 1.488 1.464 0 O-C-N 121.395 -0.816 . . . . 0.48 109.257 179.906 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' C' C ' 328' ' ' PHE . . . . . 0.551 ' CD1' ' N ' ' C' ' 328' ' ' PHE . 5.0 m-85 -112.95 -168.41 1.32 Allowed 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.374 -0.829 . . . . 0.33 109.251 -179.887 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' C' C ' 329' ' ' THR . . . . . 0.481 ' HA ' ' O ' ' A' ' 330' ' ' LEU . 57.0 p -151.65 174.59 13.29 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.202 -0.936 . . . . 0.23 109.376 -179.926 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' C' C ' 330' ' ' LEU . . . . . . . . . . . . . 14.8 tp -151.28 125.93 9.59 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.186 -0.946 . . . . 0.28 109.695 -179.736 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' C' C ' 331' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -87.91 114.49 24.57 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.246 -0.909 . . . . 1.48 108.999 179.636 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' C' C ' 332' ' ' ILE . . . . . 0.52 HD13 ' CD2' ' C' ' 341' ' ' PHE . 11.2 mt -103.36 112.36 36.55 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.566 0 O-C-N 121.15 -0.969 . . . . 0.24 110.006 -179.73 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' C' C ' 333' ' ' ARG . . . . . 0.606 ' HG2' ' CE2' ' A' ' 327' ' ' TYR . 0.7 OUTLIER -72.6 154.46 40.75 Favored 'General case' 0 N--CA 1.488 1.44 0 O-C-N 121.283 -0.886 . . . . 2.74 109.127 179.443 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' C' C ' 334' ' ' GLY . . . . . . . . . . . . . . . 73.84 128.17 0.14 Allowed Glycine 0 N--CA 1.489 2.223 0 N-CA-C 109.552 -1.419 . . . . 0.35 109.552 179.956 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' C' C ' 335' ' ' ARG . . . . . 0.414 ' HA ' ' CE1' ' A' ' 328' ' ' PHE . 9.0 ttt180 -73.64 -40.0 64.08 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.324 -1.103 . . . . 2.53 109.656 -179.853 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' C' C ' 336' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -56.97 -48.84 77.45 Favored 'General case' 0 N--CA 1.494 1.739 0 O-C-N 121.262 -0.899 . . . . 2.62 109.684 -179.789 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' C' C ' 337' ' ' ARG . . . . . 0.784 ' NH2' HD12 ' A' ' 348' ' ' LEU . 0.0 OUTLIER -62.9 -37.76 88.24 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.139 -0.976 . . . . 2.81 109.502 179.822 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' C' C ' 338' ' ' PHE . . . . . . . . . . . . . 82.2 t80 -55.16 -51.18 67.3 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.35 -0.844 . . . . 0.4 109.861 -179.73 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' C' C ' 339' ' ' GLU . . . . . . . . . . . . . 10.3 mt-10 -52.55 -36.64 56.18 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.113 -0.992 . . . . 2.05 110.38 -179.557 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' C' C ' 340' ' ' MET . . . . . . . . . . . . . 35.5 ttp -63.77 -51.52 64.45 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.073 -1.017 . . . . 0.32 110.402 -179.262 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' C' C ' 341' ' ' PHE . . . . . 0.52 ' CD2' HD13 ' C' ' 332' ' ' ILE . 40.2 m-85 -61.84 -41.24 97.56 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.146 -0.971 . . . . 0.18 110.1 -179.281 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' C' C ' 342' ' ' ARG . . . . . . . . . . . . . 1.4 ttt180 -52.24 -40.97 62.36 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.093 -1.004 . . . . 2.91 109.526 179.934 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' C' C ' 343' ' ' GLU . . . . . . . . . . . . . 25.2 tt0 -58.95 -53.87 53.49 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.25 -0.906 . . . . 2.14 109.59 -179.743 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' C' C ' 344' ' ' LEU . . . . . 0.512 HD22 HD22 ' D' ' 344' ' ' LEU . 30.6 mt -59.87 -26.08 65.58 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.217 -0.927 . . . . 0.22 108.939 179.915 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' C' C ' 345' ' ' ASN . . . . . . . . . . . . . 6.4 t-20 -59.52 -64.09 1.07 Allowed 'General case' 0 N--CA 1.488 1.453 0 O-C-N 121.414 -0.804 . . . . 1.08 109.534 179.823 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' C' C ' 346' ' ' GLU . . . . . . . . . . . . . 9.1 tp10 -62.77 -25.42 68.21 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.396 -0.815 . . . . 2.21 109.972 -179.743 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' C' C ' 347' ' ' ALA . . . . . 0.683 ' HB1' ' HB1' ' D' ' 347' ' ' ALA . . . -60.58 -57.32 13.21 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.185 -0.947 . . . . 0.18 109.862 -179.687 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' C' C ' 348' ' ' LEU . . . . . 0.529 HD22 ' N ' ' C' ' 348' ' ' LEU . 3.6 mm? -62.57 -45.0 94.93 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.184 -0.948 . . . . 0.32 110.045 -179.503 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' C' C ' 349' ' ' GLU . . . . . 0.42 ' O ' ' HB2' ' C' ' 352' ' ' ASP . 97.7 mt-10 -57.37 -34.4 68.79 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.267 -0.895 . . . . 2.19 110.157 -179.312 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' C' C ' 350' ' ' LEU . . . . . 0.814 HD22 HD13 ' D' ' 350' ' ' LEU . 7.9 tt -63.23 -44.55 94.93 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.067 -1.021 . . . . 0.46 109.209 -179.929 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' C' C ' 351' ' ' LYS . . . . . . . . . . . . . 62.9 tttm -60.65 -33.29 72.58 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.323 -0.861 . . . . 1.35 109.576 179.955 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' C' C ' 352' ' ' ASP . . . . . 0.42 ' HB2' ' O ' ' C' ' 349' ' ' GLU . 4.0 m-20 -52.75 -50.76 62.83 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.164 -0.96 . . . . 1.19 109.172 -179.979 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' C' C ' 353' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.488 1.447 0 O-C-N 121.316 -0.865 . . . . 0.57 108.968 179.564 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' D' D ' 326' ' ' GLU . . . . . . . . . . . . . 20.0 mm-40 . . . . . 0 N--CA 1.487 1.418 0 N-CA-C 109.229 -0.656 . . . . 2.13 109.229 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' D' D ' 327' ' ' TYR . . . . . 0.5 ' CE1' ' HG2' ' B' ' 333' ' ' ARG . 42.1 m-85 -148.23 109.28 4.28 Favored 'General case' 0 C--N 1.303 -1.453 0 O-C-N 121.339 -0.85 . . . . 0.47 109.368 -179.998 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' D' D ' 328' ' ' PHE . . . . . 0.483 ' CZ ' ' HG3' ' B' ' 335' ' ' ARG . 81.6 m-85 -110.59 -170.11 1.58 Allowed 'General case' 0 N--CA 1.489 1.487 0 O-C-N 121.346 -0.846 . . . . 0.3 109.319 -179.867 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' D' D ' 329' ' ' THR . . . . . 0.42 HG23 ' C ' ' D' ' 328' ' ' PHE . 73.4 p -153.8 162.14 41.49 Favored 'General case' 0 N--CA 1.488 1.449 0 O-C-N 121.222 -0.924 . . . . 0.22 109.271 -179.963 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' D' D ' 330' ' ' LEU . . . . . . . . . . . . . 16.0 tp -149.05 130.24 14.55 Favored 'General case' 0 N--CA 1.489 1.491 0 O-C-N 121.295 -0.878 . . . . 0.28 109.43 -179.753 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' D' D ' 331' ' ' GLN . . . . . . . . . . . . . 2.0 tp60 -86.24 121.6 29.06 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.251 -0.906 . . . . 0.93 109.474 -179.92 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' D' D ' 332' ' ' ILE . . . . . 0.848 HG21 ' HA ' ' D' ' 338' ' ' PHE . 71.9 mt -103.5 103.54 15.31 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.537 0 O-C-N 121.263 -0.898 . . . . 0.25 109.461 179.969 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' D' D ' 333' ' ' ARG . . . . . 0.466 ' HG2' ' CE1' ' B' ' 327' ' ' TYR . 0.3 OUTLIER -72.5 146.35 46.9 Favored 'General case' 0 N--CA 1.489 1.495 0 O-C-N 121.241 -0.912 . . . . 2.93 109.407 179.976 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' D' D ' 334' ' ' GLY . . . . . . . . . . . . . . . 75.76 119.39 0.13 Allowed Glycine 0 N--CA 1.491 2.364 0 N-CA-C 109.574 -1.411 . . . . 0.41 109.574 179.921 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' D' D ' 335' ' ' ARG . . . . . 0.449 ' O ' ' HB3' ' D' ' 338' ' ' PHE . 1.8 ttt180 -65.49 -27.49 68.52 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.245 -1.15 . . . . 3.03 109.513 179.911 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' D' D ' 336' ' ' GLU . . . . . . . . . . . . . 23.2 tt0 -57.24 -63.75 1.12 Allowed 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.209 -0.932 . . . . 2.26 109.643 -179.897 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' D' D ' 337' ' ' ARG . . . . . 0.561 ' NH1' ' HG3' ' D' ' 337' ' ' ARG . 0.6 OUTLIER -60.04 -27.16 66.7 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.225 -0.922 . . . . 2.92 109.374 179.999 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' D' D ' 338' ' ' PHE . . . . . 0.848 ' HA ' HG21 ' D' ' 332' ' ' ILE . 83.8 t80 -55.39 -61.6 2.23 Favored 'General case' 0 N--CA 1.488 1.474 0 O-C-N 121.351 -0.843 . . . . 0.37 109.893 -179.8 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' D' D ' 339' ' ' GLU . . . . . . . . . . . . . 17.8 mt-10 -51.5 -33.72 32.8 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.173 -0.955 . . . . 1.99 110.131 -179.551 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' D' D ' 340' ' ' MET . . . . . . . . . . . . . 37.9 ttp -64.24 -52.85 56.75 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.143 -0.973 . . . . 0.31 110.382 -179.336 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' D' D ' 341' ' ' PHE . . . . . . . . . . . . . 42.5 m-85 -62.01 -46.16 90.44 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.223 -0.923 . . . . 0.18 110.147 -179.228 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' D' D ' 342' ' ' ARG . . . . . 0.455 ' CG ' HH11 ' D' ' 342' ' ' ARG . 0.0 OUTLIER -48.28 -38.63 19.26 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.113 -0.992 . . . . 2.41 109.869 -179.676 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' D' D ' 343' ' ' GLU . . . . . . . . . . . . . 33.1 tt0 -59.7 -51.32 70.27 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.121 -0.987 . . . . 2.35 109.779 -179.705 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' D' D ' 344' ' ' LEU . . . . . 0.512 HD22 HD22 ' C' ' 344' ' ' LEU . 34.1 mt -61.45 -31.35 71.3 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.176 -0.953 . . . . 0.19 109.667 -179.911 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' D' D ' 345' ' ' ASN . . . . . . . . . . . . . 13.0 t-20 -57.91 -60.21 4.06 Favored 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.297 -0.877 . . . . 1.09 109.758 -179.907 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' D' D ' 346' ' ' GLU . . . . . . . . . . . . . 25.9 tt0 -61.19 -26.76 67.94 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.279 -0.888 . . . . 1.69 109.782 -179.741 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' D' D ' 347' ' ' ALA . . . . . 0.683 ' HB1' ' HB1' ' C' ' 347' ' ' ALA . . . -60.83 -59.1 5.91 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.127 -0.983 . . . . 0.18 110.016 -179.743 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' D' D ' 348' ' ' LEU . . . . . 0.586 HD22 ' N ' ' D' ' 348' ' ' LEU . 3.8 mm? -62.17 -42.04 98.89 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.166 -0.959 . . . . 0.31 110.016 -179.533 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' D' D ' 349' ' ' GLU . . . . . . . . . . . . . 30.9 mt-10 -57.89 -37.31 73.76 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.195 -0.941 . . . . 1.95 110.182 -179.249 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' D' D ' 350' ' ' LEU . . . . . 0.814 HD13 HD22 ' C' ' 350' ' ' LEU . 6.0 tt -64.58 -44.28 91.19 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.106 -0.996 . . . . 0.43 109.904 -179.563 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' D' D ' 351' ' ' LYS . . . . . . . . . . . . . 40.1 tttp -57.95 -37.82 74.85 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.208 -0.932 . . . . 1.4 109.501 -179.746 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' D' D ' 352' ' ' ASP . . . . . . . . . . . . . 11.6 m-20 -55.22 -41.5 72.14 Favored 'General case' 0 N--CA 1.489 1.49 0 O-C-N 121.22 -0.925 . . . . 1.17 109.433 179.834 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' D' D ' 353' ' ' ALA . . . . . . . . . . . . . . . -67.89 -30.71 70.12 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.316 -0.865 . . . . 0.59 109.692 -179.837 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' D' D ' 354' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 N--CA 1.491 1.609 0 O-C-N 121.112 -0.993 . . . . 1.44 109.59 -179.94 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 326' ' ' GLU . . . . . 0.443 ' HB2' ' CE1' ' A' ' 328' ' ' PHE . 30.6 mm-40 . . . . . 0 N--CA 1.489 1.489 0 CA-C-O 121.274 0.559 . . . . 2.13 109.779 . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 327' ' ' TYR . . . . . 0.632 ' CE2' ' CG ' ' C' ' 333' ' ' ARG . 44.2 m-85 -148.87 107.16 3.75 Favored 'General case' 0 N--CA 1.489 1.485 0 O-C-N 121.326 -0.859 . . . . 0.48 109.523 -179.967 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 328' ' ' PHE . . . . . 0.443 ' CE1' ' HB2' ' A' ' 326' ' ' GLU . 5.5 m-85 -112.93 -166.17 1.06 Allowed 'General case' 0 N--CA 1.488 1.45 0 O-C-N 121.533 -0.729 . . . . 0.31 109.081 -179.891 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 329' ' ' THR . . . . . 0.444 ' HA ' ' O ' ' C' ' 330' ' ' LEU . 36.5 p -155.32 178.5 10.15 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.109 -0.995 . . . . 0.22 109.552 179.768 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 330' ' ' LEU . . . . . 0.465 ' O ' ' HA ' ' C' ' 329' ' ' THR . 67.8 tp -151.98 130.15 11.94 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.241 -0.912 . . . . 0.28 109.024 179.937 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 331' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -87.54 109.2 19.45 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.365 -0.834 . . . . 0.91 109.688 -179.724 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 332' ' ' ILE . . . . . 0.522 HG21 ' HA ' ' A' ' 338' ' ' PHE . 52.7 mt -102.25 110.7 29.69 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.521 0 O-C-N 120.941 -1.099 . . . . 0.26 109.577 179.794 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 333' ' ' ARG . . . . . 0.533 ' HG2' ' CE1' ' C' ' 327' ' ' TYR . 0.0 OUTLIER -73.33 142.74 47.09 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.461 -0.774 . . . . 2.92 109.632 179.523 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 334' ' ' GLY . . . . . . . . . . . . . . . 82.64 132.78 1.8 Allowed Glycine 0 N--CA 1.488 2.106 0 N-CA-C 109.653 -1.379 . . . . 0.4 109.653 179.815 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 335' ' ' ARG . . . . . . . . . . . . . 10.2 ttp180 -79.95 -26.14 40.17 Favored 'General case' 0 C--N 1.302 -1.493 0 O-C-N 121.416 -1.049 . . . . 3.01 109.002 179.696 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 336' ' ' GLU . . . . . . . . . . . . . 2.2 tt0 -58.2 -68.77 0.22 Allowed 'General case' 0 N--CA 1.488 1.467 0 O-C-N 121.14 -0.975 . . . . 2.29 109.649 -179.732 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 337' ' ' ARG . . . . . . . . . . . . . 2.8 mmt180 -60.17 -27.45 67.12 Favored 'General case' 0 N--CA 1.489 1.481 0 O-C-N 121.115 -0.991 . . . . 2.93 109.421 179.752 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 338' ' ' PHE . . . . . 0.522 ' HA ' HG21 ' A' ' 332' ' ' ILE . 47.1 t80 -54.79 -58.72 6.45 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.254 -0.904 . . . . 0.38 109.604 179.914 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 339' ' ' GLU . . . . . . . . . . . . . 11.4 mt-10 -53.42 -31.82 46.93 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.176 -0.953 . . . . 1.97 109.996 -179.675 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 340' ' ' MET . . . . . . . . . . . . . 9.4 ttp -64.19 -50.64 67.32 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.249 -0.907 . . . . 0.31 109.953 -179.781 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 341' ' ' PHE . . . . . . . . . . . . . 48.2 m-85 -63.58 -50.38 69.68 Favored 'General case' 0 C--N 1.3 -1.57 0 O-C-N 121.246 -0.909 . . . . 0.18 110.001 -179.327 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 342' ' ' ARG . . . . . . . . . . . . . 71.5 ttt180 -48.87 -40.39 29.5 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.142 -0.974 . . . . 2.42 110.041 -179.373 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 343' ' ' GLU . . . . . . . . . . . . . 3.2 tt0 -61.57 -43.68 98.41 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.121 -0.987 . . . . 2.35 110.038 -179.441 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 344' ' ' LEU . . . . . 0.995 HD22 HD22 ' B' ' 344' ' ' LEU . 45.9 mt -63.4 -41.69 98.74 Favored 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.084 -1.01 . . . . 0.18 109.587 179.985 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 345' ' ' ASN . . . . . 0.494 HD22 HD11 ' C' ' 330' ' ' LEU . 46.4 t30 -56.45 -49.19 75.31 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.149 -0.969 . . . . 1.09 109.932 -179.746 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 346' ' ' GLU . . . . . . . . . . . . . 11.5 tt0 -61.27 -30.16 70.3 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.177 -0.952 . . . . 1.65 109.686 -179.702 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 347' ' ' ALA . . . . . 1.023 ' HB1' ' HB1' ' B' ' 347' ' ' ALA . . . -63.28 -49.21 74.96 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.333 -0.854 . . . . 0.18 109.745 -179.983 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 348' ' ' LEU . . . . . 0.584 HD22 ' N ' ' A' ' 348' ' ' LEU . 4.3 mm? -62.66 -51.44 67.23 Favored 'General case' 0 N--CA 1.494 1.754 0 O-C-N 121.444 -0.785 . . . . 0.3 109.833 -179.789 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 349' ' ' GLU . . . . . . . . . . . . . 26.2 mt-10 -58.09 -30.83 66.55 Favored 'General case' 0 N--CA 1.488 1.446 0 O-C-N 121.352 -0.842 . . . . 1.94 109.738 -179.406 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 350' ' ' LEU . . . . . 0.845 ' O ' HD23 ' A' ' 350' ' ' LEU . 4.1 tt -63.93 -41.62 97.58 Favored 'General case' 0 C--N 1.304 -1.393 0 O-C-N 121.271 -0.893 . . . . 0.46 109.064 179.972 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 351' ' ' LYS . . . . . . . . . . . . . 15.8 tttt -60.41 -41.8 94.66 Favored 'General case' 0 N--CA 1.486 1.37 0 O-C-N 121.336 -0.853 . . . . 1.4 109.5 -179.863 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 352' ' ' ASP . . . . . . . . . . . . . 94.9 m-20 -55.71 -39.45 71.08 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.083 -1.01 . . . . 1.16 109.951 -179.8 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 353' ' ' ALA . . . . . . . . . . . . . . . -66.05 -40.13 90.7 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.079 -1.013 . . . . 0.63 109.815 -179.669 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 354' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.489 1.512 0 O-C-N 121.127 -0.983 . . . . 1.47 109.573 -179.722 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 326' ' ' GLU . . . . . 0.429 ' HB2' ' CE1' ' B' ' 328' ' ' PHE . 26.2 mm-40 . . . . . 0 N--CA 1.492 1.642 0 CA-C-O 121.189 0.519 . . . . 2.13 109.846 . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 327' ' ' TYR . . . . . 0.518 ' CE2' ' HG2' ' D' ' 333' ' ' ARG . 42.0 m-85 -147.38 108.04 4.14 Favored 'General case' 0 N--CA 1.488 1.457 0 O-C-N 121.149 -0.969 . . . . 0.48 109.699 -179.934 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 328' ' ' PHE . . . . . 0.433 ' O ' HG23 ' B' ' 329' ' ' THR . 4.9 m-85 -113.04 -166.46 1.08 Allowed 'General case' 0 N--CA 1.488 1.438 0 O-C-N 121.441 -0.787 . . . . 0.32 109.486 179.772 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 329' ' ' THR . . . . . 0.459 ' HA ' ' O ' ' D' ' 330' ' ' LEU . 28.8 p -155.27 178.66 9.97 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.003 -1.061 . . . . 0.23 109.847 179.917 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 330' ' ' LEU . . . . . 0.458 HD21 ' HB2' ' D' ' 345' ' ' ASN . 62.9 tp -151.24 129.98 12.36 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.557 -0.714 . . . . 0.28 109.396 179.823 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 331' ' ' GLN . . . . . 0.415 ' HA ' HG22 ' D' ' 329' ' ' THR . 0.3 OUTLIER -88.45 110.81 21.14 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.126 -0.984 . . . . 0.91 109.557 -179.75 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' B' B ' 332' ' ' ILE . . . . . 0.579 HG21 ' HA ' ' B' ' 338' ' ' PHE . 50.7 mt -103.68 109.27 26.61 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.759 0 O-C-N 121.257 -0.902 . . . . 0.24 110.075 -179.516 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 333' ' ' ARG . . . . . 0.5 ' HG2' ' CE2' ' D' ' 327' ' ' TYR . 0.0 OUTLIER -72.1 142.72 49.17 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.086 -1.009 . . . . 2.93 109.349 179.798 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' B' B ' 334' ' ' GLY . . . . . . . . . . . . . . . 82.12 132.63 1.61 Allowed Glycine 0 N--CA 1.489 2.224 0 N-CA-C 109.814 -1.314 . . . . 0.4 109.814 179.68 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 335' ' ' ARG . . . . . . . . . . . . . 11.3 ttp180 -78.95 -26.71 43.55 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.488 -1.007 . . . . 3.01 109.437 179.77 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 336' ' ' GLU . . . . . . . . . . . . . 2.5 tt0 -58.04 -69.16 0.19 Allowed 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.191 -0.943 . . . . 2.28 109.578 179.864 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 337' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -59.86 -28.0 67.14 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.273 -0.892 . . . . 2.93 109.336 -179.898 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 338' ' ' PHE . . . . . 0.579 ' HA ' HG21 ' B' ' 332' ' ' ILE . 49.7 t80 -55.15 -59.58 4.57 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.214 -0.929 . . . . 0.37 109.534 179.775 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 339' ' ' GLU . . . . . . . . . . . . . 9.4 mt-10 -53.13 -33.08 50.78 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.199 -0.938 . . . . 1.98 109.748 -179.873 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 340' ' ' MET . . . . . . . . . . . . . 9.7 ttp -62.95 -51.33 67.33 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 120.955 -1.091 . . . . 0.32 109.808 -179.637 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 341' ' ' PHE . . . . . . . . . . . . . 48.7 m-85 -62.6 -48.78 77.94 Favored 'General case' 0 N--CA 1.488 1.465 0 O-C-N 121.171 -0.956 . . . . 0.18 109.968 -179.606 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 342' ' ' ARG . . . . . . . . . . . . . 70.7 ttt180 -48.62 -44.11 36.97 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.066 -1.021 . . . . 2.42 109.834 -179.791 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 343' ' ' GLU . . . . . . . . . . . . . 3.1 tt0 -58.05 -44.14 87.27 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.321 -0.862 . . . . 2.35 110.086 -179.309 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 344' ' ' LEU . . . . . 0.995 HD22 HD22 ' A' ' 344' ' ' LEU . 58.8 mt -63.85 -40.85 97.55 Favored 'General case' 0 N--CA 1.494 1.74 0 O-C-N 121.186 -0.946 . . . . 0.18 109.746 -179.982 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 345' ' ' ASN . . . . . 0.426 ' HA ' ' CZ ' ' D' ' 341' ' ' PHE . 48.6 t30 -57.02 -50.21 73.43 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.354 -0.841 . . . . 1.09 109.753 -179.852 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 346' ' ' GLU . . . . . . . . . . . . . 12.4 tt0 -61.58 -30.37 70.63 Favored 'General case' 0 N--CA 1.488 1.447 0 O-C-N 121.04 -1.038 . . . . 1.66 109.552 -179.876 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 347' ' ' ALA . . . . . 1.023 ' HB1' ' HB1' ' A' ' 347' ' ' ALA . . . -62.46 -48.85 77.8 Favored 'General case' 0 N--CA 1.493 1.692 0 O-C-N 121.2 -0.938 . . . . 0.17 110.038 -179.836 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 348' ' ' LEU . . . . . 0.577 HD22 ' N ' ' B' ' 348' ' ' LEU . 4.2 mm? -64.07 -50.87 66.65 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 120.996 -1.065 . . . . 0.29 109.584 -179.859 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 349' ' ' GLU . . . . . . . . . . . . . 29.3 mt-10 -56.5 -31.63 64.26 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.401 -0.812 . . . . 1.95 110.055 -179.321 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 350' ' ' LEU . . . . . 0.829 ' O ' HD23 ' B' ' 350' ' ' LEU . 3.6 tt -63.88 -40.56 96.83 Favored 'General case' 0 N--CA 1.489 1.493 0 O-C-N 121.352 -0.842 . . . . 0.45 109.321 -179.934 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 351' ' ' LYS . . . . . . . . . . . . . 15.9 tttt -60.68 -41.99 96.19 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.199 -0.938 . . . . 1.38 109.452 179.949 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 352' ' ' ASP . . . . . . . . . . . . . 94.6 m-20 -56.0 -40.22 73.04 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.311 -0.868 . . . . 1.16 109.883 -179.723 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 353' ' ' ALA . . . . . . . . . . . . . . . -66.22 -40.34 90.22 Favored 'General case' 0 N--CA 1.494 1.74 0 O-C-N 121.073 -1.017 . . . . 0.61 109.572 -179.644 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 354' ' ' GLN . . . . . 0.502 ' NE2' HD11 ' A' ' 350' ' ' LEU . 0.5 OUTLIER . . . . . 0 C--N 1.302 -1.471 0 O-C-N 121.323 -0.861 . . . . 1.45 109.817 -179.588 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' C' C ' 326' ' ' GLU . . . . . . . . . . . . . 69.0 mm-40 . . . . . 0 N--CA 1.491 1.613 0 N-CA-C 109.098 -0.705 . . . . 2.17 109.098 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' C' C ' 327' ' ' TYR . . . . . 0.533 ' CE1' ' HG2' ' A' ' 333' ' ' ARG . 47.9 m-85 -151.76 90.61 1.56 Allowed 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.005 -1.06 . . . . 0.48 109.961 -179.514 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' C' C ' 328' ' ' PHE . . . . . 0.489 ' O ' ' CG2' ' C' ' 329' ' ' THR . 37.4 m-85 -99.34 -159.57 0.75 Allowed 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.171 -0.955 . . . . 0.33 109.361 179.588 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' C' C ' 329' ' ' THR . . . . . 0.489 ' CG2' ' O ' ' C' ' 328' ' ' PHE . 75.7 p -157.55 -177.96 6.98 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.452 -0.78 . . . . 0.23 109.481 -179.948 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' C' C ' 330' ' ' LEU . . . . . 0.494 HD11 HD22 ' A' ' 345' ' ' ASN . 38.6 tp -154.45 127.61 8.37 Favored 'General case' 0 C--N 1.302 -1.492 0 O-C-N 121.32 -0.862 . . . . 0.28 109.798 -179.705 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' C' C ' 331' ' ' GLN . . . . . . . . . . . . . 37.5 tp60 -84.68 107.21 16.76 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.163 -0.961 . . . . 1.48 109.625 179.776 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' C' C ' 332' ' ' ILE . . . . . 0.519 HG21 ' HA ' ' C' ' 338' ' ' PHE . 61.1 mt -104.63 107.88 23.52 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.56 0 O-C-N 121.148 -0.97 . . . . 0.24 109.8 -179.831 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' C' C ' 333' ' ' ARG . . . . . 0.632 ' CG ' ' CE2' ' A' ' 327' ' ' TYR . 6.8 mpt_? -74.14 139.52 44.57 Favored 'General case' 0 N--CA 1.488 1.43 0 O-C-N 121.454 -0.779 . . . . 2.74 109.757 179.969 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' C' C ' 334' ' ' GLY . . . . . . . . . . . . . . . 87.92 129.98 3.21 Favored Glycine 0 N--CA 1.494 2.528 0 N-CA-C 109.985 -1.246 . . . . 0.35 109.985 179.506 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' C' C ' 335' ' ' ARG . . . . . 0.469 ' NH2' ' OE1' ' C' ' 339' ' ' GLU . 2.9 ttp180 -79.87 -28.76 39.91 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.522 -0.987 . . . . 2.53 110.002 -179.95 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' C' C ' 336' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -56.04 -72.7 0.07 Allowed 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.136 -0.977 . . . . 2.62 109.873 -179.388 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' C' C ' 337' ' ' ARG . . . . . . . . . . . . . 99.3 mtt180 -60.09 -27.47 67.03 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.355 -0.841 . . . . 2.81 109.566 179.942 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' C' C ' 338' ' ' PHE . . . . . 0.519 ' HA ' HG21 ' C' ' 332' ' ' ILE . 45.7 t80 -53.15 -61.34 2.36 Favored 'General case' 0 N--CA 1.487 1.39 0 O-C-N 121.19 -0.944 . . . . 0.4 109.249 179.942 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' C' C ' 339' ' ' GLU . . . . . 0.469 ' OE1' ' NH2' ' C' ' 335' ' ' ARG . 57.6 mt-10 -50.01 -30.74 11.22 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.406 -0.809 . . . . 2.05 109.823 -180.0 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' C' C ' 340' ' ' MET . . . . . . . . . . . . . 27.1 ttp -64.72 -51.04 64.52 Favored 'General case' 0 N--CA 1.496 1.833 0 O-C-N 121.361 -0.837 . . . . 0.32 109.995 -179.49 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' C' C ' 341' ' ' PHE . . . . . . . . . . . . . 49.7 m-85 -63.82 -49.58 72.3 Favored 'General case' 0 N--CA 1.494 1.732 0 O-C-N 121.229 -0.919 . . . . 0.18 109.888 -179.507 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' C' C ' 342' ' ' ARG . . . . . . . . . . . . . 16.3 ttp180 -48.3 -43.16 32.68 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.172 -0.955 . . . . 2.91 109.804 -179.916 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' C' C ' 343' ' ' GLU . . . . . . . . . . . . . 4.0 tt0 -59.4 -44.32 92.84 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.075 -1.016 . . . . 2.14 110.408 -179.361 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' C' C ' 344' ' ' LEU . . . . . 0.614 HD22 HD22 ' D' ' 344' ' ' LEU . 46.2 mt -64.19 -37.03 85.99 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 120.802 -1.186 . . . . 0.22 109.96 -179.604 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' C' C ' 345' ' ' ASN . . . . . 0.448 ' HB2' HD21 ' A' ' 330' ' ' LEU . 52.2 t-20 -56.68 -46.91 80.87 Favored 'General case' 0 C--N 1.301 -1.536 0 O-C-N 121.065 -1.022 . . . . 1.08 109.107 -179.825 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' C' C ' 346' ' ' GLU . . . . . . . . . . . . . 32.6 tt0 -62.11 -30.65 71.16 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.281 -0.887 . . . . 2.21 109.518 179.737 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' C' C ' 347' ' ' ALA . . . . . 1.007 ' HB1' ' HB1' ' D' ' 347' ' ' ALA . . . -61.66 -51.55 67.99 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.098 -1.001 . . . . 0.18 109.735 179.668 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' C' C ' 348' ' ' LEU . . . . . 0.548 HD22 ' N ' ' C' ' 348' ' ' LEU . 4.4 mm? -61.88 -53.22 58.82 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.162 -0.961 . . . . 0.32 110.471 -179.249 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' C' C ' 349' ' ' GLU . . . . . 0.412 ' O ' ' HB2' ' C' ' 352' ' ' ASP . 9.6 mt-10 -57.23 -32.47 66.57 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.097 -1.002 . . . . 2.19 109.21 -179.727 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' C' C ' 350' ' ' LEU . . . . . 0.925 ' CD2' HD13 ' D' ' 350' ' ' LEU . 5.1 tt -62.48 -42.51 99.54 Favored 'General case' 0 C--N 1.301 -1.506 0 N-CA-C 109.383 -0.599 . . . . 0.46 109.383 179.926 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' C' C ' 351' ' ' LYS . . . . . 0.51 ' N ' HD23 ' C' ' 350' ' ' LEU . 0.0 OUTLIER -58.6 -34.06 70.69 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.158 -0.964 . . . . 1.35 109.593 179.983 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' C' C ' 352' ' ' ASP . . . . . 0.412 ' HB2' ' O ' ' C' ' 349' ' ' GLU . 7.9 m-20 -55.62 -40.3 71.94 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.254 -0.904 . . . . 1.19 109.015 179.98 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' C' C ' 353' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.488 1.467 0 O-C-N 121.244 -0.91 . . . . 0.57 109.114 179.809 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' D' D ' 326' ' ' GLU . . . . . 0.421 ' HB2' ' CE1' ' D' ' 328' ' ' PHE . 24.9 mm-40 . . . . . 0 N--CA 1.49 1.569 0 CA-C-O 121.167 0.508 . . . . 2.13 109.721 . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' D' D ' 327' ' ' TYR . . . . . 0.5 ' CE2' ' HG2' ' B' ' 333' ' ' ARG . 42.5 m-85 -149.01 108.8 4.03 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.353 -0.842 . . . . 0.47 109.674 -179.988 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' D' D ' 328' ' ' PHE . . . . . 0.423 ' CD1' ' N ' ' D' ' 328' ' ' PHE . 4.3 m-85 -114.02 -167.51 1.22 Allowed 'General case' 0 N--CA 1.489 1.499 0 O-C-N 121.473 -0.767 . . . . 0.3 108.986 179.813 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' D' D ' 329' ' ' THR . . . . . 0.457 ' HA ' ' O ' ' B' ' 330' ' ' LEU . 27.0 p -154.71 176.7 12.11 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.017 -1.052 . . . . 0.22 109.701 179.953 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' D' D ' 330' ' ' LEU . . . . . 0.459 ' O ' ' HA ' ' B' ' 329' ' ' THR . 64.5 tp -149.81 129.32 13.05 Favored 'General case' 0 N--CA 1.489 1.488 0 O-C-N 121.057 -1.027 . . . . 0.28 109.508 -179.786 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' D' D ' 331' ' ' GLN . . . . . 0.406 ' HA ' HG22 ' B' ' 329' ' ' THR . 0.0 OUTLIER -87.79 111.01 20.91 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.395 -0.816 . . . . 0.93 109.695 -179.882 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' D' D ' 332' ' ' ILE . . . . . 0.588 HG21 ' HA ' ' D' ' 338' ' ' PHE . 57.8 mt -103.57 111.89 34.99 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.595 0 O-C-N 121.308 -0.87 . . . . 0.25 109.793 179.987 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' D' D ' 333' ' ' ARG . . . . . 0.518 ' HG2' ' CE2' ' B' ' 327' ' ' TYR . 0.0 OUTLIER -73.86 141.13 46.12 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.145 -0.972 . . . . 2.93 109.4 179.72 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' D' D ' 334' ' ' GLY . . . . . . . . . . . . . . . 83.29 132.27 1.94 Allowed Glycine 0 N--CA 1.493 2.473 0 N-CA-C 109.866 -1.294 . . . . 0.41 109.866 179.921 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' D' D ' 335' ' ' ARG . . . . . . . . . . . . . 11.7 ttp180 -78.32 -25.86 46.67 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.206 -1.173 . . . . 3.03 109.12 179.668 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' D' D ' 336' ' ' GLU . . . . . . . . . . . . . 2.8 tt0 -58.93 -67.96 0.32 Allowed 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.318 -0.864 . . . . 2.26 109.991 -179.692 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' D' D ' 337' ' ' ARG . . . . . 0.402 ' HA ' ' HD2' ' D' ' 337' ' ' ARG . 1.0 OUTLIER -61.97 -26.46 68.22 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 120.857 -1.152 . . . . 2.92 109.026 179.951 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' D' D ' 338' ' ' PHE . . . . . 0.588 ' HA ' HG21 ' D' ' 332' ' ' ILE . 47.7 t80 -54.67 -60.9 2.72 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.344 -0.847 . . . . 0.37 109.303 179.553 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' D' D ' 339' ' ' GLU . . . . . . . . . . . . . 8.4 mt-10 -52.02 -34.03 41.13 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.247 -0.908 . . . . 1.99 109.848 -179.754 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' D' D ' 340' ' ' MET . . . . . . . . . . . . . 8.9 ttp -62.02 -50.26 72.76 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.2 -0.937 . . . . 0.31 109.923 -179.735 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' D' D ' 341' ' ' PHE . . . . . 0.426 ' CZ ' ' HA ' ' B' ' 345' ' ' ASN . 52.2 m-85 -63.73 -48.9 75.17 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 120.797 -1.19 . . . . 0.18 110.209 -179.638 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' D' D ' 342' ' ' ARG . . . . . . . . . . . . . 71.3 ttt180 -48.66 -44.96 38.13 Favored 'General case' 0 C--N 1.302 -1.498 0 O-C-N 121.296 -0.878 . . . . 2.41 109.834 -179.358 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' D' D ' 343' ' ' GLU . . . . . . . . . . . . . 3.0 tt0 -56.49 -45.48 80.95 Favored 'General case' 0 N--CA 1.489 1.494 0 O-C-N 121.204 -0.935 . . . . 2.35 109.902 -179.489 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' D' D ' 344' ' ' LEU . . . . . 0.614 HD22 HD22 ' C' ' 344' ' ' LEU . 47.4 mt -62.94 -40.51 97.86 Favored 'General case' 0 N--CA 1.494 1.757 0 O-C-N 121.147 -0.971 . . . . 0.19 110.088 -179.712 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' D' D ' 345' ' ' ASN . . . . . 0.458 ' HB2' HD21 ' B' ' 330' ' ' LEU . 55.5 t30 -56.86 -49.47 75.4 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.173 -0.954 . . . . 1.09 109.71 -179.605 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' D' D ' 346' ' ' GLU . . . . . . . . . . . . . 9.2 tt0 -61.9 -29.91 70.53 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.365 -0.834 . . . . 1.69 109.747 -179.929 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' D' D ' 347' ' ' ALA . . . . . 1.007 ' HB1' ' HB1' ' C' ' 347' ' ' ALA . . . -62.52 -49.47 75.19 Favored 'General case' 0 N--CA 1.494 1.739 0 O-C-N 121.112 -0.993 . . . . 0.18 109.977 -179.984 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' D' D ' 348' ' ' LEU . . . . . 0.592 HD22 ' N ' ' D' ' 348' ' ' LEU . 4.2 mm? -63.23 -52.61 61.51 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.154 -0.966 . . . . 0.31 109.524 -179.683 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' D' D ' 349' ' ' GLU . . . . . . . . . . . . . 25.1 mt-10 -55.36 -31.18 61.54 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.494 -0.754 . . . . 1.95 109.948 -179.683 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' D' D ' 350' ' ' LEU . . . . . 0.925 HD13 ' CD2' ' C' ' 350' ' ' LEU . 4.4 tt -64.6 -41.3 96.31 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.316 -0.865 . . . . 0.43 109.106 179.982 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' D' D ' 351' ' ' LYS . . . . . . . . . . . . . 17.8 tttt -59.04 -44.01 91.72 Favored 'General case' 0 N--CA 1.489 1.497 0 O-C-N 121.278 -0.889 . . . . 1.4 109.648 -179.973 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' D' D ' 352' ' ' ASP . . . . . . . . . . . . . 86.6 m-20 -55.1 -40.32 70.32 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.421 -0.799 . . . . 1.17 110.125 -179.404 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' D' D ' 353' ' ' ALA . . . . . . . . . . . . . . . -66.19 -38.39 87.9 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.239 -0.913 . . . . 0.59 109.741 -179.658 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' D' D ' 354' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--N 1.302 -1.484 0 O-C-N 121.238 -0.914 . . . . 1.44 109.873 -179.541 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 326' ' ' GLU . . . . . . . . . . . . . 4.3 mm-40 . . . . . 0 N--CA 1.491 1.595 0 CA-C-O 121.283 0.563 . . . . 2.13 109.499 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 327' ' ' TYR . . . . . 0.604 ' CE2' ' HG2' ' C' ' 333' ' ' ARG . 43.4 m-85 -149.52 106.11 3.53 Favored 'General case' 0 N--CA 1.488 1.444 0 O-C-N 121.289 -0.882 . . . . 0.48 109.56 179.837 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 328' ' ' PHE . . . . . 0.442 ' O ' ' NE2' ' C' ' 331' ' ' GLN . 22.6 m-85 -111.98 -167.57 1.2 Allowed 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.388 -0.82 . . . . 0.31 108.938 179.717 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 329' ' ' THR . . . . . 0.422 ' HA ' ' O ' ' C' ' 330' ' ' LEU . 77.7 p -153.59 -179.73 8.05 Favored 'General case' 0 C--N 1.303 -1.441 0 O-C-N 121.152 -0.968 . . . . 0.22 109.374 179.883 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 330' ' ' LEU . . . . . 0.428 ' O ' ' HA ' ' C' ' 329' ' ' THR . 52.1 tp -152.73 131.96 12.76 Favored 'General case' 0 N--CA 1.488 1.469 0 O-C-N 121.18 -0.95 . . . . 0.28 109.564 -179.892 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 331' ' ' GLN . . . . . . . . . . . . . 44.6 tp60 -87.99 106.64 18.27 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.359 -0.838 . . . . 0.91 109.5 179.933 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 332' ' ' ILE . . . . . . . . . . . . . 31.9 mt -103.49 103.1 14.63 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.541 0 O-C-N 121.129 -0.982 . . . . 0.26 109.534 179.926 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 333' ' ' ARG . . . . . 0.531 ' NH1' ' HG2' ' A' ' 333' ' ' ARG . 0.0 OUTLIER -72.46 151.49 42.51 Favored 'General case' 0 N--CA 1.488 1.464 0 O-C-N 121.265 -0.897 . . . . 2.92 109.445 179.861 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 334' ' ' GLY . . . . . . . . . . . . . . . 86.47 128.99 2.45 Favored Glycine 0 N--CA 1.491 2.315 0 N-CA-C 109.593 -1.403 . . . . 0.4 109.593 -179.984 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 335' ' ' ARG . . . . . 0.451 ' HA ' ' CE2' ' C' ' 328' ' ' PHE . 3.5 ttm180 -79.66 -39.09 32.2 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.278 -1.131 . . . . 3.01 109.586 179.988 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 336' ' ' GLU . . . . . . . . . . . . . 2.2 mt-10 -58.05 -61.42 2.56 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.225 -0.922 . . . . 2.29 109.7 -179.916 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 337' ' ' ARG . . . . . 0.457 ' NH1' ' CG ' ' A' ' 337' ' ' ARG . 0.0 OUTLIER -59.75 -29.33 68.08 Favored 'General case' 0 N--CA 1.489 1.494 0 O-C-N 121.168 -0.957 . . . . 2.93 109.528 -179.842 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 338' ' ' PHE . . . . . 0.449 ' HB3' ' O ' ' A' ' 335' ' ' ARG . 48.3 t80 -55.69 -56.03 25.17 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.145 -0.972 . . . . 0.38 109.465 179.993 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 339' ' ' GLU . . . . . . . . . . . . . 24.0 mt-10 -50.24 -33.27 19.05 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.195 -0.941 . . . . 1.97 110.045 -179.647 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 340' ' ' MET . . . . . . . . . . . . . 32.1 ttp -63.19 -51.0 68.13 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.158 -0.963 . . . . 0.31 109.878 -179.713 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 341' ' ' PHE . . . . . . . . . . . . . 38.9 m-85 -62.67 -52.02 64.93 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.177 -0.952 . . . . 0.18 109.704 -179.741 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 342' ' ' ARG . . . . . . . . . . . . . 9.7 ttm180 -47.63 -36.65 11.21 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.188 -0.945 . . . . 2.42 109.438 -179.948 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 343' ' ' GLU . . . . . . . . . . . . . 32.2 tt0 -59.18 -49.61 77.18 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.219 -0.926 . . . . 2.35 109.433 -179.92 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 344' ' ' LEU . . . . . 0.687 HD22 ' CD2' ' B' ' 344' ' ' LEU . 57.5 mt -62.42 -32.31 73.14 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.223 -0.923 . . . . 0.18 109.437 179.984 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 345' ' ' ASN . . . . . . . . . . . . . 9.6 t-20 -56.81 -54.93 40.77 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.302 -0.874 . . . . 1.09 109.618 -179.886 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 346' ' ' GLU . . . . . . . . . . . . . 43.8 tp10 -61.35 -31.66 71.54 Favored 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.274 -0.891 . . . . 1.65 109.813 -179.797 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 347' ' ' ALA . . . . . 0.772 ' HB1' ' HB1' ' B' ' 347' ' ' ALA . . . -59.91 -57.86 11.04 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.204 -0.935 . . . . 0.18 109.988 -179.73 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 348' ' ' LEU . . . . . 0.71 HD12 ' HE ' ' C' ' 337' ' ' ARG . 4.2 mm? -61.59 -41.91 98.11 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.206 -0.934 . . . . 0.3 109.81 -179.584 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 349' ' ' GLU . . . . . . . . . . . . . 98.5 mt-10 -58.08 -34.93 70.69 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.264 -0.898 . . . . 1.94 110.007 -179.53 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 350' ' ' LEU . . . . . 0.86 HD13 HD22 ' B' ' 350' ' ' LEU . 5.7 tt -63.54 -46.46 85.89 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.111 -0.993 . . . . 0.46 109.523 -179.819 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 351' ' ' LYS . . . . . . . . . . . . . 42.4 tttt -59.38 -38.0 79.37 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.274 -0.891 . . . . 1.4 109.443 -179.978 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 352' ' ' ASP . . . . . . . . . . . . . 23.0 m-20 -55.71 -36.14 66.86 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.199 -0.938 . . . . 1.16 109.671 -179.995 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 353' ' ' ALA . . . . . . . . . . . . . . . -66.88 -35.75 80.74 Favored 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.235 -0.916 . . . . 0.63 109.76 -179.745 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 354' ' ' GLN . . . . . . . . . . . . . 5.9 mt-30 . . . . . 0 N--CA 1.49 1.556 0 O-C-N 121.215 -0.928 . . . . 1.47 109.657 -179.92 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' B' B ' 326' ' ' GLU . . . . . . . . . . . . . 4.3 mm-40 . . . . . 0 N--CA 1.49 1.568 0 N-CA-C 109.43 -0.582 . . . . 2.13 109.43 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' B' B ' 327' ' ' TYR . . . . . 0.517 ' CE2' ' HG2' ' D' ' 333' ' ' ARG . 43.1 m-85 -149.59 106.1 3.52 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.365 -0.835 . . . . 0.48 109.46 179.823 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 328' ' ' PHE . . . . . 0.488 ' CE1' ' HA ' ' D' ' 335' ' ' ARG . 22.5 m-85 -111.97 -167.74 1.22 Allowed 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.236 -0.915 . . . . 0.32 108.974 179.653 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 329' ' ' THR . . . . . 0.414 HG23 ' C ' ' B' ' 328' ' ' PHE . 75.7 p -153.38 -179.55 7.85 Favored 'General case' 0 N--CA 1.488 1.453 0 O-C-N 121.195 -0.941 . . . . 0.23 109.331 179.899 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 330' ' ' LEU . . . . . . . . . . . . . 52.2 tp -152.93 131.87 12.53 Favored 'General case' 0 N--CA 1.489 1.484 0 O-C-N 121.274 -0.891 . . . . 0.28 109.484 -179.867 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 331' ' ' GLN . . . . . . . . . . . . . 44.6 tp60 -88.09 106.41 18.14 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.284 -0.885 . . . . 0.91 109.505 179.967 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 332' ' ' ILE . . . . . . . . . . . . . 31.5 mt -103.28 103.26 14.84 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.601 0 O-C-N 121.198 -0.939 . . . . 0.24 109.609 179.86 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 333' ' ' ARG . . . . . 0.566 ' HG2' ' CE2' ' D' ' 327' ' ' TYR . 0.0 OUTLIER -72.55 151.39 42.45 Favored 'General case' 0 N--CA 1.489 1.5 0 O-C-N 121.278 -0.889 . . . . 2.93 109.465 179.835 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' B' B ' 334' ' ' GLY . . . . . . . . . . . . . . . 86.6 128.96 2.48 Favored Glycine 0 N--CA 1.49 2.254 0 N-CA-C 109.556 -1.418 . . . . 0.4 109.556 -179.977 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 335' ' ' ARG . . . . . 0.444 ' O ' ' HB3' ' B' ' 338' ' ' PHE . 3.4 ttm180 -79.58 -39.29 32.06 Favored 'General case' 0 N--CA 1.489 1.495 0 O-C-N 121.3 -1.117 . . . . 3.01 109.506 -179.994 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 336' ' ' GLU . . . . . . . . . . . . . 2.2 mt-10 -57.89 -61.36 2.59 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.221 -0.924 . . . . 2.28 109.77 -179.921 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 337' ' ' ARG . . . . . 0.455 ' NH1' ' CG ' ' B' ' 337' ' ' ARG . 0.0 OUTLIER -59.82 -29.35 68.19 Favored 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.226 -0.921 . . . . 2.93 109.502 -179.871 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' B' B ' 338' ' ' PHE . . . . . 0.444 ' HB3' ' O ' ' B' ' 335' ' ' ARG . 48.0 t80 -55.54 -56.12 23.96 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.184 -0.948 . . . . 0.37 109.469 179.943 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 339' ' ' GLU . . . . . . . . . . . . . 23.9 mt-10 -50.36 -33.17 19.49 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.27 -0.894 . . . . 1.98 109.99 -179.657 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 340' ' ' MET . . . . . . . . . . . . . 32.3 ttp -63.39 -50.85 68.24 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.052 -1.03 . . . . 0.32 109.812 -179.73 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 341' ' ' PHE . . . . . . . . . . . . . 39.3 m-85 -62.74 -51.8 65.75 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.19 -0.944 . . . . 0.18 109.819 -179.812 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 342' ' ' ARG . . . . . . . . . . . . . 9.7 ttm180 -47.78 -36.83 12.26 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.245 -0.91 . . . . 2.42 109.522 -179.988 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 343' ' ' GLU . . . . . . . . . . . . . 32.5 tt0 -58.88 -49.72 76.72 Favored 'General case' 0 N--CA 1.489 1.486 0 O-C-N 121.214 -0.929 . . . . 2.35 109.47 179.957 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 344' ' ' LEU . . . . . 0.687 ' CD2' HD22 ' A' ' 344' ' ' LEU . 56.8 mt -62.39 -32.34 73.14 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.174 -0.954 . . . . 0.18 109.466 179.947 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 345' ' ' ASN . . . . . . . . . . . . . 9.6 t-20 -56.81 -54.88 41.26 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.352 -0.842 . . . . 1.09 109.678 -179.87 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 346' ' ' GLU . . . . . . . . . . . . . 43.8 tp10 -61.37 -31.66 71.56 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.237 -0.914 . . . . 1.66 109.787 -179.849 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 347' ' ' ALA . . . . . 0.772 ' HB1' ' HB1' ' A' ' 347' ' ' ALA . . . -59.93 -57.8 11.29 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.235 -0.916 . . . . 0.17 109.974 -179.663 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 348' ' ' LEU . . . . . 0.6 HD22 ' N ' ' B' ' 348' ' ' LEU . 4.2 mm? -61.6 -41.91 98.11 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.198 -0.939 . . . . 0.29 109.828 -179.558 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 349' ' ' GLU . . . . . . . . . . . . . 98.5 mt-10 -57.97 -35.18 70.81 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.246 -0.909 . . . . 1.95 109.946 -179.492 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 350' ' ' LEU . . . . . 0.86 HD22 HD13 ' A' ' 350' ' ' LEU . 5.7 tt -63.33 -46.59 85.92 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.157 -0.964 . . . . 0.45 109.576 -179.836 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 351' ' ' LYS . . . . . . . . . . . . . 42.4 tttt -59.37 -37.86 78.98 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.294 -0.879 . . . . 1.38 109.398 -179.899 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 352' ' ' ASP . . . . . . . . . . . . . 22.8 m-20 -55.72 -36.17 66.93 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.349 -0.844 . . . . 1.16 109.717 179.992 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 353' ' ' ALA . . . . . . . . . . . . . . . -66.91 -35.75 80.7 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.217 -0.927 . . . . 0.61 109.838 -179.752 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 354' ' ' GLN . . . . . . . . . . . . . 5.9 mt-30 . . . . . 0 N--CA 1.491 1.597 0 O-C-N 121.115 -0.991 . . . . 1.45 109.543 -179.892 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' C' C ' 326' ' ' GLU . . . . . 0.522 ' O ' ' CD1' ' C' ' 327' ' ' TYR . 5.2 mt-10 . . . . . 0 N--CA 1.49 1.542 0 N-CA-C 109.428 -0.582 . . . . 2.17 109.428 . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' C' C ' 327' ' ' TYR . . . . . 0.522 ' CD1' ' O ' ' C' ' 326' ' ' GLU . 40.3 m-85 -149.77 109.11 3.96 Favored 'General case' 0 N--CA 1.489 1.494 0 O-C-N 121.149 -0.97 . . . . 0.48 109.723 -179.973 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' C' C ' 328' ' ' PHE . . . . . 0.451 ' CE2' ' HA ' ' A' ' 335' ' ' ARG . 83.7 m-85 -113.89 -167.04 1.15 Allowed 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.401 -0.812 . . . . 0.33 109.137 179.81 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' C' C ' 329' ' ' THR . . . . . 0.431 HG23 ' C ' ' C' ' 328' ' ' PHE . 22.4 p -153.73 179.19 9.08 Favored 'General case' 0 N--CA 1.489 1.487 0 O-C-N 121.124 -0.985 . . . . 0.23 109.494 179.988 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' C' C ' 330' ' ' LEU . . . . . 0.422 ' O ' ' HA ' ' A' ' 329' ' ' THR . 54.1 tp -152.99 131.61 12.27 Favored 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.243 -0.911 . . . . 0.28 109.761 -179.802 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' C' C ' 331' ' ' GLN . . . . . 0.442 ' NE2' ' O ' ' A' ' 328' ' ' PHE . 0.0 OUTLIER -88.52 102.35 14.83 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.268 -0.895 . . . . 1.48 108.838 179.818 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' C' C ' 332' ' ' ILE . . . . . . . . . . . . . 53.6 mt -104.01 112.04 36.01 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.704 0 O-C-N 121.118 -0.988 . . . . 0.24 110.204 -179.606 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' C' C ' 333' ' ' ARG . . . . . 0.604 ' HG2' ' CE2' ' A' ' 327' ' ' TYR . 1.4 mpp_? -75.18 163.94 27.01 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.294 -0.879 . . . . 2.74 109.656 179.407 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' C' C ' 334' ' ' GLY . . . . . . . . . . . . . . . 72.55 130.3 0.12 Allowed Glycine 0 N--CA 1.493 2.476 0 N-CA-C 110.344 -1.102 . . . . 0.35 110.344 179.172 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' C' C ' 335' ' ' ARG . . . . . 0.481 ' O ' ' HB3' ' C' ' 338' ' ' PHE . 3.9 ttp180 -80.67 -37.98 29.88 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.401 -1.058 . . . . 2.53 109.414 179.684 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' C' C ' 336' ' ' GLU . . . . . . . . . . . . . 4.0 mt-10 -58.36 -60.98 2.94 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.218 -0.927 . . . . 2.62 109.676 -179.738 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' C' C ' 337' ' ' ARG . . . . . 0.71 ' HE ' HD12 ' A' ' 348' ' ' LEU . 0.0 OUTLIER -59.47 -29.24 67.68 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.208 -0.932 . . . . 2.81 109.463 -179.789 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' C' C ' 338' ' ' PHE . . . . . 0.481 ' HB3' ' O ' ' C' ' 335' ' ' ARG . 47.6 t80 -54.87 -55.55 29.2 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.228 -0.92 . . . . 0.4 109.245 179.825 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' C' C ' 339' ' ' GLU . . . . . . . . . . . . . 85.4 mt-10 -50.84 -29.17 11.08 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.297 -0.877 . . . . 2.05 109.672 -179.985 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' C' C ' 340' ' ' MET . . . . . . . . . . . . . 14.9 ttp -63.4 -53.83 46.29 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.132 -0.98 . . . . 0.32 109.64 -179.766 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' C' C ' 341' ' ' PHE . . . . . . . . . . . . . 38.8 m-85 -62.76 -46.1 89.61 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.211 -0.931 . . . . 0.18 109.729 -179.783 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' C' C ' 342' ' ' ARG . . . . . 0.445 HH11 ' CG ' ' C' ' 342' ' ' ARG . 0.0 OUTLIER -49.72 -42.45 46.01 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.215 -0.928 . . . . 2.91 109.621 -179.89 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' C' C ' 343' ' ' GLU . . . . . . . . . . . . . 23.1 tt0 -57.89 -47.26 83.32 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.134 -0.978 . . . . 2.14 109.298 -179.966 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' C' C ' 344' ' ' LEU . . . . . 0.615 HD22 HD22 ' D' ' 344' ' ' LEU . 76.3 mt -62.61 -29.07 70.33 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.211 -0.93 . . . . 0.22 109.232 179.704 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' C' C ' 345' ' ' ASN . . . . . . . . . . . . . 13.1 t-20 -58.84 -58.33 9.1 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.491 -0.756 . . . . 1.08 109.837 179.998 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' C' C ' 346' ' ' GLU . . . . . . . . . . . . . 6.6 tm-20 -60.8 -25.86 66.87 Favored 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.322 -0.861 . . . . 2.21 109.785 -179.644 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' C' C ' 347' ' ' ALA . . . . . 0.854 ' HB1' ' HB1' ' D' ' 347' ' ' ALA . . . -63.84 -58.2 7.53 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.137 -0.977 . . . . 0.18 110.028 -179.945 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' C' C ' 348' ' ' LEU . . . . . 0.567 HD22 ' N ' ' C' ' 348' ' ' LEU . 3.9 mm? -62.6 -49.61 74.54 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.202 -0.936 . . . . 0.32 110.582 -179.355 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' C' C ' 349' ' ' GLU . . . . . . . . . . . . . 54.3 mt-10 -56.97 -39.05 73.88 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.187 -0.946 . . . . 2.19 110.301 -179.096 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' C' C ' 350' ' ' LEU . . . . . 0.794 ' CD2' HD13 ' D' ' 350' ' ' LEU . 7.1 tt -64.57 -30.42 71.44 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.046 -1.033 . . . . 0.46 109.653 -179.761 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' C' C ' 351' ' ' LYS . . . . . . . . . . . . . 10.2 tttt -59.34 -48.88 79.94 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.308 -0.87 . . . . 1.35 109.414 -179.854 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' C' C ' 352' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -60.03 -47.06 87.41 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.331 -0.856 . . . . 1.19 109.588 179.867 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' C' C ' 353' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 1.597 0 O-C-N 121.224 -0.922 . . . . 0.57 109.461 -179.787 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' D' D ' 326' ' ' GLU . . . . . 0.401 ' O ' ' CD1' ' D' ' 327' ' ' TYR . 4.3 mm-40 . . . . . 0 N--CA 1.49 1.54 0 N-CA-C 109.451 -0.574 . . . . 2.13 109.451 . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' D' D ' 327' ' ' TYR . . . . . 0.566 ' CE2' ' HG2' ' B' ' 333' ' ' ARG . 43.7 m-85 -149.61 106.04 3.51 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.268 -0.895 . . . . 0.47 109.534 179.824 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' D' D ' 328' ' ' PHE . . . . . 0.434 ' CE1' ' HA ' ' B' ' 335' ' ' ARG . 23.4 m-85 -111.87 -167.5 1.19 Allowed 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.339 -0.85 . . . . 0.3 109.007 179.683 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' D' D ' 329' ' ' THR . . . . . 0.408 HG23 ' C ' ' D' ' 328' ' ' PHE . 75.5 p -153.59 -179.76 8.08 Favored 'General case' 0 N--CA 1.488 1.452 0 O-C-N 121.158 -0.964 . . . . 0.22 109.424 179.925 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' D' D ' 330' ' ' LEU . . . . . . . . . . . . . 52.2 tp -152.75 131.91 12.71 Favored 'General case' 0 N--CA 1.488 1.467 0 O-C-N 121.205 -0.934 . . . . 0.28 109.532 -179.877 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' D' D ' 331' ' ' GLN . . . . . . . . . . . . . 44.6 tp60 -88.13 106.55 18.25 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.274 -0.891 . . . . 0.93 109.521 179.922 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' D' D ' 332' ' ' ILE . . . . . . . . . . . . . 31.9 mt -103.41 103.37 15.04 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.545 0 O-C-N 121.168 -0.957 . . . . 0.25 109.519 179.919 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' D' D ' 333' ' ' ARG . . . . . 0.547 ' HG2' ' NH1' ' D' ' 333' ' ' ARG . 0.0 OUTLIER -72.66 151.45 42.25 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.249 -0.907 . . . . 2.93 109.398 179.861 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' D' D ' 334' ' ' GLY . . . . . . . . . . . . . . . 86.56 128.87 2.46 Favored Glycine 0 N--CA 1.49 2.235 0 N-CA-C 109.595 -1.402 . . . . 0.41 109.595 -179.978 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' D' D ' 335' ' ' ARG . . . . . 0.488 ' HA ' ' CE1' ' B' ' 328' ' ' PHE . 3.4 ttm180 -79.54 -39.18 32.51 Favored 'General case' 0 N--CA 1.489 1.487 0 O-C-N 121.202 -1.175 . . . . 3.03 109.524 -179.975 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' D' D ' 336' ' ' GLU . . . . . . . . . . . . . 2.2 mt-10 -57.98 -61.4 2.57 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.252 -0.905 . . . . 2.26 109.731 -179.89 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' D' D ' 337' ' ' ARG . . . . . 0.457 HH11 ' CG ' ' D' ' 337' ' ' ARG . 0.0 OUTLIER -59.85 -29.35 68.23 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.18 -0.95 . . . . 2.92 109.504 -179.84 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' D' D ' 338' ' ' PHE . . . . . 0.44 ' HB3' ' O ' ' D' ' 335' ' ' ARG . 48.2 t80 -55.53 -56.2 23.04 Favored 'General case' 0 N--CA 1.488 1.474 0 O-C-N 121.219 -0.926 . . . . 0.37 109.483 179.886 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' D' D ' 339' ' ' GLU . . . . . . . . . . . . . 24.1 mt-10 -50.09 -33.49 18.76 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.23 -0.919 . . . . 1.99 110.03 -179.716 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' D' D ' 340' ' ' MET . . . . . . . . . . . . . 32.2 ttp -63.13 -51.11 67.78 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.2 -0.938 . . . . 0.31 109.814 -179.674 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' D' D ' 341' ' ' PHE . . . . . . . . . . . . . 39.3 m-85 -62.46 -51.99 65.28 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.146 -0.971 . . . . 0.18 109.757 -179.741 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' D' D ' 342' ' ' ARG . . . . . . . . . . . . . 9.7 ttm180 -47.69 -36.76 11.69 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.156 -0.965 . . . . 2.41 109.483 -179.926 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' D' D ' 343' ' ' GLU . . . . . . . . . . . . . 32.7 tt0 -58.91 -49.64 77.03 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.278 -0.889 . . . . 2.35 109.504 179.935 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' D' D ' 344' ' ' LEU . . . . . 0.615 HD22 HD22 ' C' ' 344' ' ' LEU . 57.5 mt -62.47 -32.37 73.25 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.177 -0.952 . . . . 0.19 109.453 -179.996 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' D' D ' 345' ' ' ASN . . . . . . . . . . . . . 9.6 t-20 -56.77 -54.93 40.6 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.266 -0.896 . . . . 1.09 109.63 -179.858 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' D' D ' 346' ' ' GLU . . . . . . . . . . . . . 44.0 tp10 -61.4 -31.61 71.53 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.258 -0.902 . . . . 1.69 109.755 -179.746 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' D' D ' 347' ' ' ALA . . . . . 0.854 ' HB1' ' HB1' ' C' ' 347' ' ' ALA . . . -59.93 -57.82 11.21 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.236 -0.915 . . . . 0.18 109.988 -179.709 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' D' D ' 348' ' ' LEU . . . . . 0.608 HD22 ' N ' ' D' ' 348' ' ' LEU . 4.2 mm? -61.53 -42.0 98.18 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.219 -0.926 . . . . 0.31 109.885 -179.664 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' D' D ' 349' ' ' GLU . . . . . . . . . . . . . 98.5 mt-10 -57.9 -35.12 70.59 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.245 -0.91 . . . . 1.95 109.943 -179.541 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' D' D ' 350' ' ' LEU . . . . . 0.794 HD13 ' CD2' ' C' ' 350' ' ' LEU . 5.7 tt -63.39 -46.37 86.73 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.125 -0.985 . . . . 0.43 109.603 -179.814 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' D' D ' 351' ' ' LYS . . . . . . . . . . . . . 42.4 tttt -59.48 -37.87 79.36 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.253 -0.904 . . . . 1.4 109.475 -179.996 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' D' D ' 352' ' ' ASP . . . . . . . . . . . . . 22.9 m-20 -55.76 -36.15 66.99 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.258 -0.901 . . . . 1.17 109.635 179.975 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' D' D ' 353' ' ' ALA . . . . . . . . . . . . . . . -66.95 -35.83 80.85 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.239 -0.913 . . . . 0.59 109.738 -179.739 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' D' D ' 354' ' ' GLN . . . . . . . . . . . . . 5.8 mt-30 . . . . . 0 N--CA 1.49 1.541 0 O-C-N 121.229 -0.919 . . . . 1.44 109.595 -179.829 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 326' ' ' GLU . . . . . . . . . . . . . 20.8 mt-10 . . . . . 0 N--CA 1.49 1.572 0 N-CA-C 109.354 -0.61 . . . . 2.13 109.354 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 327' ' ' TYR . . . . . 0.588 ' CE1' ' HG2' ' C' ' 333' ' ' ARG . 48.0 m-85 -148.54 111.36 4.81 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.303 -0.873 . . . . 0.48 109.338 179.978 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 328' ' ' PHE . . . . . . . . . . . . . 94.5 m-85 -113.3 -169.88 1.58 Allowed 'General case' 0 N--CA 1.488 1.467 0 O-C-N 121.114 -0.991 . . . . 0.31 109.466 -179.706 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 329' ' ' THR . . . . . 0.502 ' HA ' ' O ' ' C' ' 330' ' ' LEU . 29.4 p -152.16 166.31 32.1 Favored 'General case' 0 C--N 1.303 -1.424 0 O-C-N 121.298 -0.876 . . . . 0.22 109.022 179.879 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 330' ' ' LEU . . . . . . . . . . . . . 49.2 tp -149.71 128.32 12.35 Favored 'General case' 0 C--N 1.303 -1.444 0 O-C-N 121.107 -0.996 . . . . 0.28 109.972 -179.396 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 331' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -86.74 109.92 19.55 Favored 'General case' 0 N--CA 1.488 1.471 0 O-C-N 121.321 -0.862 . . . . 0.91 109.184 179.681 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 332' ' ' ILE . . . . . 0.63 HD12 ' HD1' ' A' ' 338' ' ' PHE . 10.6 mt -103.65 108.44 24.54 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.536 0 O-C-N 121.203 -0.936 . . . . 0.26 109.766 -179.716 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 333' ' ' ARG . . . . . 0.52 ' HG2' ' CE1' ' C' ' 327' ' ' TYR . 37.8 mtm-85 -71.95 151.86 42.95 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.192 -0.942 . . . . 2.92 109.337 179.804 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 334' ' ' GLY . . . . . . . . . . . . . . . 79.8 129.85 0.77 Allowed Glycine 0 N--CA 1.491 2.335 0 N-CA-C 109.703 -1.359 . . . . 0.4 109.703 179.746 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 335' ' ' ARG . . . . . . . . . . . . . 9.6 ttm180 -79.92 -37.47 34.54 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.275 -1.132 . . . . 3.01 109.579 179.919 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 336' ' ' GLU . . . . . . . . . . . . . 4.2 mm-40 -57.15 -63.48 1.2 Allowed 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.325 -0.859 . . . . 2.29 109.807 -179.744 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 337' ' ' ARG . . . . . 0.442 HH11 ' HG2' ' A' ' 337' ' ' ARG . 5.0 mmt-85 -60.39 -30.44 69.59 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.266 -0.896 . . . . 2.93 109.788 -179.737 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 338' ' ' PHE . . . . . 0.63 ' HD1' HD12 ' A' ' 332' ' ' ILE . 25.8 t80 -55.26 -56.89 14.82 Favored 'General case' 0 N--CA 1.489 1.487 0 O-C-N 121.063 -1.023 . . . . 0.38 109.122 179.716 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 339' ' ' GLU . . . . . . . . . . . . . 32.1 mt-10 -51.32 -30.6 18.82 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.428 -0.795 . . . . 1.97 109.574 -179.755 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 340' ' ' MET . . . . . . . . . . . . . 41.5 ttp -63.66 -50.57 68.74 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.286 -0.884 . . . . 0.31 109.593 -179.834 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 341' ' ' PHE . . . . . 0.416 ' CZ ' ' HA ' ' C' ' 345' ' ' ASN . 75.7 m-85 -62.74 -46.49 87.81 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.205 -0.934 . . . . 0.18 109.718 -179.873 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 342' ' ' ARG . . . . . 0.453 HH11 ' HG3' ' A' ' 342' ' ' ARG . 0.3 OUTLIER -49.03 -42.69 39.11 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.257 -0.902 . . . . 2.42 109.987 -179.578 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 343' ' ' GLU . . . . . . . . . . . . . 25.1 tt0 -59.82 -44.62 93.94 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.38 -0.825 . . . . 2.35 109.846 -179.72 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 344' ' ' LEU . . . . . . . . . . . . . 41.1 mt -62.49 -36.01 81.17 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.1 -1.0 . . . . 0.18 109.933 -179.661 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 345' ' ' ASN . . . . . . . . . . . . . 63.8 t-20 -57.41 -54.66 44.34 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.298 -0.876 . . . . 1.09 109.906 -179.626 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 346' ' ' GLU . . . . . . . . . . . . . 83.5 tt0 -60.92 -30.33 70.13 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.139 -0.976 . . . . 1.65 109.946 -179.59 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 347' ' ' ALA . . . . . 0.876 ' HB1' ' HB1' ' B' ' 347' ' ' ALA . . . -60.58 -56.34 22.5 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.176 -0.953 . . . . 0.18 110.014 -179.616 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 348' ' ' LEU . . . . . 0.575 HD22 ' N ' ' A' ' 348' ' ' LEU . 3.9 mm? -61.33 -48.93 79.08 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.16 -0.962 . . . . 0.3 110.073 -179.398 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 349' ' ' GLU . . . . . . . . . . . . . 80.6 mm-40 -57.13 -30.27 64.26 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.24 -0.912 . . . . 1.94 110.127 -179.453 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 350' ' ' LEU . . . . . 0.73 ' O ' HD23 ' A' ' 350' ' ' LEU . 4.2 tt -64.28 -48.0 77.38 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.127 -0.983 . . . . 0.46 109.419 -179.984 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 351' ' ' LYS . . . . . . . . . . . . . 68.0 tttt -59.17 -48.83 80.15 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.277 -0.889 . . . . 1.4 109.538 -179.964 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 352' ' ' ASP . . . . . . . . . . . . . 3.4 m-20 -54.82 -29.36 54.62 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.251 -0.905 . . . . 1.16 109.478 -179.995 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 353' ' ' ALA . . . . . . . . . . . . . . . -67.2 -37.98 84.56 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.276 -0.89 . . . . 0.63 109.512 179.945 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 354' ' ' GLN . . . . . . . . . . . . . 26.0 mt-30 . . . . . 0 N--CA 1.488 1.461 0 O-C-N 121.252 -0.905 . . . . 1.47 109.475 -179.999 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' B' B ' 326' ' ' GLU . . . . . . . . . . . . . 20.0 mt-10 . . . . . 0 N--CA 1.488 1.475 0 CA-C-O 121.354 0.597 . . . . 2.13 109.449 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' B' B ' 327' ' ' TYR . . . . . 0.473 ' CE1' ' HG2' ' D' ' 333' ' ' ARG . 48.7 m-85 -148.86 112.04 4.93 Favored 'General case' 0 N--CA 1.488 1.454 0 O-C-N 121.286 -0.884 . . . . 0.48 109.322 179.891 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 328' ' ' PHE . . . . . 0.4 ' CE1' ' HB2' ' D' ' 335' ' ' ARG . 94.0 m-85 -113.5 -169.45 1.5 Allowed 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.246 -0.908 . . . . 0.32 109.514 -179.865 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 329' ' ' THR . . . . . . . . . . . . . 29.6 p -152.64 166.46 32.04 Favored 'General case' 0 N--CA 1.487 1.42 0 O-C-N 121.274 -0.891 . . . . 0.23 109.055 179.771 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 330' ' ' LEU . . . . . 0.547 HD11 HD22 ' D' ' 345' ' ' ASN . 49.3 tp -149.87 128.85 12.61 Favored 'General case' 0 C--N 1.302 -1.473 0 O-C-N 121.033 -1.042 . . . . 0.28 109.812 -179.46 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 331' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -87.3 109.69 19.69 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.398 -0.813 . . . . 0.91 109.184 179.773 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 332' ' ' ILE . . . . . 0.61 HD12 ' HD1' ' B' ' 338' ' ' PHE . 10.3 mt -103.61 108.67 25.03 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.499 0 O-C-N 121.16 -0.962 . . . . 0.24 109.778 -179.686 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 333' ' ' ARG . . . . . 0.504 ' NH1' ' HG3' ' B' ' 333' ' ' ARG . 39.3 mtm-85 -71.93 152.24 42.69 Favored 'General case' 0 N--CA 1.488 1.455 0 O-C-N 121.312 -0.868 . . . . 2.93 109.387 179.73 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 334' ' ' GLY . . . . . . . . . . . . . . . 78.46 129.83 0.57 Allowed Glycine 0 N--CA 1.49 2.236 0 N-CA-C 109.719 -1.352 . . . . 0.4 109.719 179.811 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 335' ' ' ARG . . . . . . . . . . . . . 9.6 ttm180 -79.77 -37.99 34.15 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.29 -1.123 . . . . 3.01 109.65 -179.938 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 336' ' ' GLU . . . . . . . . . . . . . 4.5 mm-40 -56.21 -63.68 1.11 Allowed 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.232 -0.917 . . . . 2.28 109.783 -179.8 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 337' ' ' ARG . . . . . 0.447 HH11 ' HG2' ' B' ' 337' ' ' ARG . 4.7 mmt-85 -60.53 -30.44 69.74 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.282 -0.886 . . . . 2.93 109.608 -179.634 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 338' ' ' PHE . . . . . 0.61 ' HD1' HD12 ' B' ' 332' ' ' ILE . 25.6 t80 -55.09 -57.49 11.51 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.185 -0.947 . . . . 0.37 109.015 179.599 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 339' ' ' GLU . . . . . . . . . . . . . 31.5 mt-10 -50.76 -30.78 14.92 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.313 -0.867 . . . . 1.98 109.695 -179.82 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 340' ' ' MET . . . . . . . . . . . . . 41.5 ttp -63.54 -50.94 67.57 Favored 'General case' 0 N--CA 1.488 1.468 0 O-C-N 121.325 -0.859 . . . . 0.32 109.58 -179.93 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 341' ' ' PHE . . . . . . . . . . . . . 76.6 m-85 -62.35 -46.78 87.11 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.086 -1.009 . . . . 0.18 109.685 -179.905 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 342' ' ' ARG . . . . . 0.452 ' HG3' HH11 ' B' ' 342' ' ' ARG . 0.2 OUTLIER -48.41 -43.37 34.07 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.294 -0.878 . . . . 2.42 109.795 -179.612 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' B' B ' 343' ' ' GLU . . . . . . . . . . . . . 26.0 tt0 -59.42 -44.79 92.81 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.298 -0.876 . . . . 2.35 109.895 -179.569 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 344' ' ' LEU . . . . . . . . . . . . . 41.2 mt -62.17 -36.47 81.97 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.197 -0.939 . . . . 0.18 109.889 -179.618 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 345' ' ' ASN . . . . . 0.425 ' HA ' ' CZ ' ' D' ' 341' ' ' PHE . 62.7 t-20 -57.05 -54.86 41.98 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.203 -0.935 . . . . 1.09 109.982 -179.669 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 346' ' ' GLU . . . . . . . . . . . . . 83.7 tt0 -61.06 -30.49 70.36 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.14 -0.975 . . . . 1.66 109.842 -179.472 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 347' ' ' ALA . . . . . 0.876 ' HB1' ' HB1' ' A' ' 347' ' ' ALA . . . -60.31 -56.29 23.35 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.2 -0.937 . . . . 0.17 110.116 -179.741 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 348' ' ' LEU . . . . . 0.585 HD22 ' N ' ' B' ' 348' ' ' LEU . 3.9 mm? -61.66 -48.4 81.02 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.087 -1.008 . . . . 0.29 110.06 -179.366 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 349' ' ' GLU . . . . . . . . . . . . . 80.8 mm-40 -57.32 -30.66 64.95 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.158 -0.964 . . . . 1.95 110.079 -179.351 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 350' ' ' LEU . . . . . 0.731 ' O ' HD23 ' B' ' 350' ' ' LEU . 4.2 tt -63.95 -47.98 78.3 Favored 'General case' 0 C--N 1.302 -1.465 0 O-C-N 121.204 -0.935 . . . . 0.45 109.398 -179.909 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 351' ' ' LYS . . . . . . . . . . . . . 68.3 tttt -59.15 -48.35 81.92 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.331 -0.856 . . . . 1.38 109.566 -179.973 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 352' ' ' ASP . . . . . . . . . . . . . 3.2 m-20 -55.26 -29.68 58.58 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.243 -0.911 . . . . 1.16 109.371 179.988 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 353' ' ' ALA . . . . . . . . . . . . . . . -66.74 -38.3 86.38 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.329 -0.857 . . . . 0.61 109.487 -179.967 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 354' ' ' GLN . . . . . . . . . . . . . 25.6 mt-30 . . . . . 0 N--CA 1.489 1.515 0 O-C-N 121.236 -0.915 . . . . 1.45 109.467 179.863 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' C' C ' 326' ' ' GLU . . . . . . . . . . . . . 34.3 mt-10 . . . . . 0 N--CA 1.489 1.513 0 CA-C-O 121.348 0.594 . . . . 2.17 109.608 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' C' C ' 327' ' ' TYR . . . . . 0.52 ' CE1' ' HG2' ' A' ' 333' ' ' ARG . 39.1 m-85 -148.11 111.41 4.93 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.387 -0.82 . . . . 0.48 109.399 179.973 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' C' C ' 328' ' ' PHE . . . . . 0.4 ' O ' HG23 ' C' ' 329' ' ' THR . 97.8 m-85 -113.98 -168.16 1.31 Allowed 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.155 -0.966 . . . . 0.33 109.629 -179.978 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' C' C ' 329' ' ' THR . . . . . 0.4 HG23 ' O ' ' C' ' 328' ' ' PHE . 9.4 p -153.13 165.83 34.4 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.392 -0.818 . . . . 0.23 108.962 -179.99 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' C' C ' 330' ' ' LEU . . . . . 0.502 ' O ' ' HA ' ' A' ' 329' ' ' THR . 16.3 tp -151.94 126.31 9.36 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.202 -0.936 . . . . 0.28 109.858 -179.521 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' C' C ' 331' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -85.89 118.65 25.51 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.298 -0.876 . . . . 1.48 109.044 179.433 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' C' C ' 332' ' ' ILE . . . . . . . . . . . . . 83.1 mt -103.45 109.86 28.24 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.508 0 O-C-N 121.163 -0.961 . . . . 0.24 110.111 -179.452 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' C' C ' 333' ' ' ARG . . . . . 0.588 ' HG2' ' CE1' ' A' ' 327' ' ' TYR . 10.9 mtt180 -72.8 128.74 36.41 Favored 'General case' 0 N--CA 1.489 1.479 0 O-C-N 121.284 -0.885 . . . . 2.74 109.289 179.674 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' C' C ' 334' ' ' GLY . . . . . . . . . . . . . . . 101.46 131.56 7.43 Favored Glycine 0 N--CA 1.489 2.212 0 N-CA-C 109.426 -1.47 . . . . 0.35 109.426 -179.913 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' C' C ' 335' ' ' ARG . . . . . 0.484 ' O ' ' HB3' ' C' ' 338' ' ' PHE . 12.1 ttt180 -80.42 -37.28 32.4 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.239 -1.154 . . . . 2.53 109.991 -179.653 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' C' C ' 336' ' ' GLU . . . . . . . . . . . . . 6.2 mm-40 -58.51 -57.15 14.22 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.052 -1.03 . . . . 2.62 109.943 -179.586 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' C' C ' 337' ' ' ARG . . . . . . . . . . . . . 2.0 mtp180 -59.96 -24.61 64.55 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.235 -0.916 . . . . 2.81 109.629 -179.603 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' C' C ' 338' ' ' PHE . . . . . 0.484 ' HB3' ' O ' ' C' ' 335' ' ' ARG . 85.3 t80 -54.95 -63.08 1.27 Allowed 'General case' 0 N--CA 1.489 1.489 0 O-C-N 121.289 -0.882 . . . . 0.4 109.387 -179.973 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' C' C ' 339' ' ' GLU . . . . . . . . . . . . . 42.5 mt-10 -50.03 -30.17 10.18 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.287 -0.883 . . . . 2.05 109.917 -179.68 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' C' C ' 340' ' ' MET . . . . . . . . . . . . . 27.4 ttp -64.22 -55.95 18.04 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.169 -0.957 . . . . 0.32 110.051 -179.882 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' C' C ' 341' ' ' PHE . . . . . . . . . . . . . 52.9 m-85 -62.32 -51.4 67.8 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.157 -0.965 . . . . 0.18 109.76 -179.51 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' C' C ' 342' ' ' ARG . . . . . . . . . . . . . 2.7 ttp180 -45.49 -40.85 8.93 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.268 -0.895 . . . . 2.91 109.577 179.999 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' C' C ' 343' ' ' GLU . . . . . . . . . . . . . 16.9 tt0 -60.5 -48.62 80.95 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.208 -0.932 . . . . 2.14 110.297 -179.637 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' C' C ' 344' ' ' LEU . . . . . 0.48 HD22 ' CD2' ' D' ' 344' ' ' LEU . 37.5 mt -60.51 -42.43 96.4 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 120.937 -1.102 . . . . 0.22 109.852 -179.481 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' C' C ' 345' ' ' ASN . . . . . 0.416 ' HA ' ' CZ ' ' A' ' 341' ' ' PHE . 44.4 t-20 -56.03 -47.9 76.97 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.161 -0.962 . . . . 1.08 109.436 179.906 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' C' C ' 346' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -62.42 -37.31 85.36 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.173 -0.955 . . . . 2.21 109.785 -179.756 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' C' C ' 347' ' ' ALA . . . . . 0.775 ' HB1' ' HB1' ' D' ' 347' ' ' ALA . . . -59.04 -55.4 35.53 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.137 -0.977 . . . . 0.18 110.251 -179.664 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' C' C ' 348' ' ' LEU . . . . . 0.604 HD22 ' N ' ' C' ' 348' ' ' LEU . 4.1 mm? -60.13 -38.62 83.61 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.109 -0.994 . . . . 0.32 109.548 -179.578 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' C' C ' 349' ' ' GLU . . . . . . . . . . . . . 89.3 mt-10 -59.0 -41.68 88.25 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.352 -0.842 . . . . 2.19 110.206 -179.481 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' C' C ' 350' ' ' LEU . . . . . 0.687 HD22 HD13 ' D' ' 350' ' ' LEU . 6.6 tt -63.21 -40.77 98.43 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.216 -0.928 . . . . 0.46 110.022 -179.439 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' C' C ' 351' ' ' LYS . . . . . . . . . . . . . 2.8 tttm -59.38 -41.27 88.95 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.242 -0.911 . . . . 1.35 109.886 -179.602 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' C' C ' 352' ' ' ASP . . . . . . . . . . . . . 3.1 m-20 -56.08 -41.11 74.62 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.171 -0.955 . . . . 1.19 110.064 -179.774 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' C' C ' 353' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 1.585 0 O-C-N 121.219 -0.926 . . . . 0.57 109.578 -179.881 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' D' D ' 326' ' ' GLU . . . . . . . . . . . . . 19.7 mt-10 . . . . . 0 N--CA 1.489 1.482 0 CA-C-O 121.316 0.579 . . . . 2.13 109.566 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' D' D ' 327' ' ' TYR . . . . . 0.468 ' CE1' ' HG2' ' B' ' 333' ' ' ARG . 49.9 m-85 -148.84 111.7 4.84 Favored 'General case' 0 N--CA 1.488 1.455 0 O-C-N 121.167 -0.958 . . . . 0.47 109.285 179.935 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' D' D ' 328' ' ' PHE . . . . . . . . . . . . . 94.4 m-85 -113.45 -169.5 1.51 Allowed 'General case' 0 N--CA 1.487 1.405 0 O-C-N 121.337 -0.852 . . . . 0.3 109.459 -179.859 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' D' D ' 329' ' ' THR . . . . . 0.412 ' HA ' ' O ' ' B' ' 330' ' ' LEU . 25.7 p -152.69 166.95 30.54 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.285 -0.885 . . . . 0.22 108.937 179.953 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' D' D ' 330' ' ' LEU . . . . . 0.407 HD21 ' HB2' ' B' ' 345' ' ' ASN . 49.2 tp -150.1 128.51 12.17 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.151 -0.968 . . . . 0.28 109.737 -179.441 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' D' D ' 331' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -86.95 109.74 19.56 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.231 -0.918 . . . . 0.93 109.134 179.632 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' D' D ' 332' ' ' ILE . . . . . 0.608 HD12 ' HD1' ' D' ' 338' ' ' PHE . 10.7 mt -103.62 108.55 24.76 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.539 0 O-C-N 121.201 -0.937 . . . . 0.25 109.765 -179.647 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' D' D ' 333' ' ' ARG . . . . . 0.52 ' NH1' ' HG3' ' D' ' 333' ' ' ARG . 39.0 mtm-85 -72.0 152.51 42.41 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.267 -0.895 . . . . 2.93 109.375 179.736 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' D' D ' 334' ' ' GLY . . . . . . . . . . . . . . . 78.41 129.73 0.56 Allowed Glycine 0 N--CA 1.492 2.405 0 N-CA-C 109.635 -1.386 . . . . 0.41 109.635 179.889 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' D' D ' 335' ' ' ARG . . . . . 0.4 ' HB2' ' CE1' ' B' ' 328' ' ' PHE . 9.6 ttm180 -80.1 -37.04 34.52 Favored 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.343 -1.092 . . . . 3.03 109.421 -179.937 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' D' D ' 336' ' ' GLU . . . . . . . . . . . . . 4.7 mm-40 -56.76 -63.88 1.06 Allowed 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.254 -0.904 . . . . 2.26 109.726 -179.788 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' D' D ' 337' ' ' ARG . . . . . 0.443 HH11 ' HG2' ' D' ' 337' ' ' ARG . 5.5 mmt-85 -60.34 -29.93 69.2 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.201 -0.937 . . . . 2.92 109.803 -179.557 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' D' D ' 338' ' ' PHE . . . . . 0.608 ' HD1' HD12 ' D' ' 332' ' ' ILE . 25.7 t80 -55.82 -57.52 11.72 Favored 'General case' 0 N--CA 1.489 1.492 0 O-C-N 121.242 -0.911 . . . . 0.37 108.909 179.745 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' D' D ' 339' ' ' GLU . . . . . . . . . . . . . 31.0 mt-10 -50.48 -30.93 13.93 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.25 -0.906 . . . . 1.99 109.665 -179.961 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' D' D ' 340' ' ' MET . . . . . . . . . . . . . 41.8 ttp -63.26 -50.96 68.13 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.2 -0.937 . . . . 0.31 109.696 -179.811 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' D' D ' 341' ' ' PHE . . . . . 0.425 ' CZ ' ' HA ' ' B' ' 345' ' ' ASN . 76.8 m-85 -62.35 -46.67 87.63 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.258 -0.901 . . . . 0.18 109.661 -179.887 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' D' D ' 342' ' ' ARG . . . . . 0.446 ' HG3' HH11 ' D' ' 342' ' ' ARG . 0.2 OUTLIER -48.43 -43.63 34.52 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.348 -0.845 . . . . 2.41 109.871 -179.611 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' D' D ' 343' ' ' GLU . . . . . . . . . . . . . 26.2 tt0 -59.24 -44.56 92.34 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.223 -0.923 . . . . 2.35 109.976 -179.595 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' D' D ' 344' ' ' LEU . . . . . 0.48 ' CD2' HD22 ' C' ' 344' ' ' LEU . 42.2 mt -62.41 -36.38 82.16 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.239 -0.913 . . . . 0.19 109.879 -179.654 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' D' D ' 345' ' ' ASN . . . . . 0.547 HD22 HD11 ' B' ' 330' ' ' LEU . 62.3 t-20 -57.53 -54.71 43.78 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.221 -0.925 . . . . 1.09 109.923 -179.614 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' D' D ' 346' ' ' GLU . . . . . . . . . . . . . 84.3 tt0 -61.1 -30.33 70.29 Favored 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.127 -0.983 . . . . 1.69 109.815 -179.605 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' D' D ' 347' ' ' ALA . . . . . 0.775 ' HB1' ' HB1' ' C' ' 347' ' ' ALA . . . -60.6 -56.22 23.93 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.117 -0.989 . . . . 0.18 110.056 -179.652 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' D' D ' 348' ' ' LEU . . . . . 0.596 HD22 ' N ' ' D' ' 348' ' ' LEU . 3.9 mm? -61.54 -48.73 79.69 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.235 -0.915 . . . . 0.31 109.979 -179.491 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' D' D ' 349' ' ' GLU . . . . . . . . . . . . . 80.8 mm-40 -57.2 -30.21 64.36 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.114 -0.991 . . . . 1.95 110.068 -179.317 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' D' D ' 350' ' ' LEU . . . . . 0.722 ' O ' HD23 ' D' ' 350' ' ' LEU . 4.2 tt -64.09 -48.19 77.14 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.03 -1.044 . . . . 0.43 109.34 179.945 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' D' D ' 351' ' ' LYS . . . . . . . . . . . . . 68.5 tttt -58.95 -48.43 81.53 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.287 -0.883 . . . . 1.4 109.551 -179.899 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' D' D ' 352' ' ' ASP . . . . . . . . . . . . . 3.1 m-20 -55.15 -29.24 57.38 Favored 'General case' 0 N--CA 1.488 1.467 0 O-C-N 121.217 -0.927 . . . . 1.17 109.478 179.963 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' D' D ' 353' ' ' ALA . . . . . . . . . . . . . . . -67.33 -38.23 84.57 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.271 -0.893 . . . . 0.59 109.47 179.968 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' D' D ' 354' ' ' GLN . . . . . 0.554 ' NE2' HD11 ' C' ' 350' ' ' LEU . 25.5 mt-30 . . . . . 0 N--CA 1.49 1.533 0 O-C-N 121.222 -0.924 . . . . 1.44 109.453 179.995 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 326' ' ' GLU . . . . . . . . . . . . . 66.9 mm-40 . . . . . 0 N--CA 1.489 1.489 0 N-CA-C 109.312 -0.625 . . . . 2.13 109.312 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 327' ' ' TYR . . . . . 0.605 ' CE1' ' CG ' ' C' ' 333' ' ' ARG . 43.1 m-85 -148.75 95.27 2.39 Favored 'General case' 0 N--CA 1.488 1.446 0 O-C-N 121.249 -0.907 . . . . 0.48 109.557 -179.898 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 328' ' ' PHE . . . . . . . . . . . . . 84.7 m-85 -103.35 -162.48 0.91 Allowed 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.255 -0.903 . . . . 0.31 109.62 -179.991 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 329' ' ' THR . . . . . . . . . . . . . 40.8 p -154.12 166.91 31.6 Favored 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.365 -0.834 . . . . 0.22 109.11 179.855 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 330' ' ' LEU . . . . . . . . . . . . . 18.9 tp -149.96 126.61 10.96 Favored 'General case' 0 N--CA 1.488 1.46 0 O-C-N 121.097 -1.002 . . . . 0.28 110.064 -179.561 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 331' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -88.07 112.62 22.86 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.353 -0.842 . . . . 0.91 108.95 179.399 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 332' ' ' ILE . . . . . 0.578 HG21 ' HA ' ' A' ' 338' ' ' PHE . 50.5 mt -103.49 109.45 27.06 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.595 0 O-C-N 121.216 -0.928 . . . . 0.26 109.792 -179.716 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 333' ' ' ARG . . . . . 0.542 ' HG2' ' CE1' ' C' ' 327' ' ' TYR . 80.8 mtt180 -72.73 149.46 43.71 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.37 -0.831 . . . . 2.92 109.449 179.803 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 334' ' ' GLY . . . . . . . . . . . . . . . 82.03 124.69 0.78 Allowed Glycine 0 N--CA 1.491 2.307 0 N-CA-C 109.398 -1.481 . . . . 0.4 109.398 -179.894 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 335' ' ' ARG . . . . . . . . . . . . . 60.6 ttt180 -75.53 -33.42 60.71 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.318 -1.107 . . . . 3.01 109.542 -179.894 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 336' ' ' GLU . . . . . . . . . . . . . 62.8 tt0 -58.32 -61.84 2.27 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.267 -0.896 . . . . 2.29 109.768 -179.886 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 337' ' ' ARG . . . . . 0.654 ' NH2' HD12 ' C' ' 348' ' ' LEU . 8.2 mmt180 -62.1 -33.18 73.95 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.122 -0.987 . . . . 2.93 109.783 -179.739 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 338' ' ' PHE . . . . . 0.578 ' HA ' HG21 ' A' ' 332' ' ' ILE . 45.7 t80 -54.38 -57.02 12.87 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.123 -0.986 . . . . 0.38 109.753 -179.631 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 339' ' ' GLU . . . . . . . . . . . . . 41.6 mt-10 -51.09 -35.1 33.37 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.234 -0.916 . . . . 1.97 109.989 -179.699 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 340' ' ' MET . . . . . . . . . . . . . 48.5 ttp -63.61 -49.14 74.47 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.262 -0.899 . . . . 0.31 110.092 -179.56 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 341' ' ' PHE . . . . . . . . . . . . . 44.3 m-85 -61.83 -45.97 91.51 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.239 -0.913 . . . . 0.18 109.835 -179.456 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 342' ' ' ARG . . . . . . . . . . . . . 5.7 ttt180 -49.91 -42.26 47.73 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.167 -0.958 . . . . 2.42 110.06 -179.658 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 343' ' ' GLU . . . . . . . . . . . . . 1.2 tp10 -59.04 -49.85 76.33 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.144 -0.972 . . . . 2.35 109.886 -179.613 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 344' ' ' LEU . . . . . 0.439 HD22 HD22 ' B' ' 344' ' ' LEU . 61.5 mt -59.94 -30.95 69.42 Favored 'General case' 0 N--CA 1.489 1.495 0 O-C-N 121.222 -0.924 . . . . 0.18 109.403 -179.737 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 345' ' ' ASN . . . . . 0.706 HD22 HD11 ' C' ' 330' ' ' LEU . 64.4 t-20 -58.41 -59.3 5.56 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.271 -0.893 . . . . 1.09 109.74 -179.98 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 346' ' ' GLU . . . . . 0.465 ' OE1' ' NZ ' ' B' ' 351' ' ' LYS . 1.0 OUTLIER -61.48 -26.29 67.8 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.234 -0.917 . . . . 1.65 109.884 -179.577 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 347' ' ' ALA . . . . . 0.478 ' HB1' ' HB1' ' B' ' 347' ' ' ALA . . . -60.79 -57.93 10.59 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.173 -0.954 . . . . 0.18 110.018 -179.74 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 348' ' ' LEU . . . . . 0.592 HD22 ' N ' ' A' ' 348' ' ' LEU . 4.1 mm? -61.94 -44.5 96.63 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.211 -0.931 . . . . 0.3 110.122 -179.38 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 349' ' ' GLU . . . . . . . . . . . . . 12.0 mm-40 -58.34 -33.34 69.43 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.123 -0.985 . . . . 1.94 109.939 -179.462 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 350' ' ' LEU . . . . . 0.872 HD11 ' NE2' ' B' ' 354' ' ' GLN . 5.1 tt -64.47 -43.51 93.98 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.225 -0.922 . . . . 0.46 109.843 -179.761 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 351' ' ' LYS . . . . . 0.44 ' NZ ' ' OE1' ' B' ' 346' ' ' GLU . 19.8 tttp -59.15 -45.11 91.82 Favored 'General case' 0 N--CA 1.489 1.499 0 O-C-N 121.337 -0.852 . . . . 1.4 109.961 -179.643 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 352' ' ' ASP . . . . . . . . . . . . . 36.1 m-20 -58.66 -49.03 79.04 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.233 -0.917 . . . . 1.16 110.265 -179.584 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 353' ' ' ALA . . . . . . . . . . . . . . . -65.99 -11.05 45.11 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.087 -1.008 . . . . 0.63 109.893 -179.31 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 354' ' ' GLN . . . . . 0.825 ' NE2' HD11 ' B' ' 350' ' ' LEU . 1.7 mt-30 . . . . . 0 N--CA 1.49 1.538 0 O-C-N 121.228 -0.92 . . . . 1.47 109.55 179.765 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 326' ' ' GLU . . . . . . . . . . . . . 67.0 mm-40 . . . . . 0 N--CA 1.489 1.5 0 N-CA-C 109.261 -0.644 . . . . 2.13 109.261 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' B' B ' 327' ' ' TYR . . . . . 0.579 ' CE1' ' HG2' ' D' ' 333' ' ' ARG . 44.1 m-85 -148.63 94.97 2.36 Favored 'General case' 0 N--CA 1.488 1.425 0 O-C-N 121.011 -1.056 . . . . 0.48 109.582 -179.956 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 328' ' ' PHE . . . . . . . . . . . . . 85.5 m-85 -103.19 -162.83 0.94 Allowed 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.265 -0.897 . . . . 0.32 109.534 -179.91 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 329' ' ' THR . . . . . . . . . . . . . 41.1 p -153.96 166.92 31.46 Favored 'General case' 0 N--CA 1.488 1.471 0 O-C-N 121.33 -0.856 . . . . 0.23 109.082 179.943 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 330' ' ' LEU . . . . . 0.512 HD11 HD22 ' D' ' 345' ' ' ASN . 18.6 tp -149.97 126.03 10.6 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.011 -1.056 . . . . 0.28 109.954 -179.579 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 331' ' ' GLN . . . . . 0.453 ' OE1' ' O ' ' D' ' 328' ' ' PHE . 0.2 OUTLIER -87.38 112.66 22.35 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.273 -0.892 . . . . 0.91 108.895 179.432 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' B' B ' 332' ' ' ILE . . . . . 0.561 HG21 ' HA ' ' B' ' 338' ' ' PHE . 50.3 mt -103.46 109.6 27.47 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.561 0 O-C-N 121.113 -0.992 . . . . 0.24 109.746 -179.699 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 333' ' ' ARG . . . . . 0.541 ' HG2' ' CE1' ' D' ' 327' ' ' TYR . 81.6 mtt180 -72.84 149.96 43.1 Favored 'General case' 0 N--CA 1.489 1.486 0 O-C-N 121.329 -0.857 . . . . 2.93 109.414 179.748 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 334' ' ' GLY . . . . . . . . . . . . . . . 81.4 124.81 0.7 Allowed Glycine 0 N--CA 1.491 2.36 0 N-CA-C 109.444 -1.463 . . . . 0.4 109.444 -179.893 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 335' ' ' ARG . . . . . . . . . . . . . 58.7 ttt180 -75.42 -33.15 60.92 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.22 -1.165 . . . . 3.01 109.644 -179.874 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 336' ' ' GLU . . . . . . . . . . . . . 61.3 tt0 -58.78 -61.77 2.37 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.241 -0.912 . . . . 2.28 109.704 -179.793 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 337' ' ' ARG . . . . . . . . . . . . . 7.8 mmt180 -61.78 -33.1 73.48 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.161 -0.962 . . . . 2.93 109.743 -179.762 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 338' ' ' PHE . . . . . 0.561 ' HA ' HG21 ' B' ' 332' ' ' ILE . 46.4 t80 -54.26 -57.54 10.79 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.171 -0.956 . . . . 0.37 109.794 -179.805 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 339' ' ' GLU . . . . . . . . . . . . . 41.3 mt-10 -51.02 -34.82 31.02 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.177 -0.952 . . . . 1.98 110.071 -179.686 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 340' ' ' MET . . . . . . . . . . . . . 47.8 ttp -63.91 -48.99 74.4 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.146 -0.971 . . . . 0.32 110.094 -179.505 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 341' ' ' PHE . . . . . . . . . . . . . 44.5 m-85 -61.96 -46.17 90.47 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.151 -0.968 . . . . 0.18 109.885 -179.56 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 342' ' ' ARG . . . . . . . . . . . . . 6.0 ttt180 -49.69 -42.36 45.52 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.213 -0.929 . . . . 2.42 110.051 -179.631 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 343' ' ' GLU . . . . . . . . . . . . . 1.1 tp10 -58.92 -49.62 77.11 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.077 -1.014 . . . . 2.35 109.882 -179.604 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 344' ' ' LEU . . . . . 0.439 HD22 HD22 ' A' ' 344' ' ' LEU . 60.0 mt -60.29 -30.84 69.74 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.208 -0.932 . . . . 0.18 109.432 -179.677 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 345' ' ' ASN . . . . . 0.428 ' HA ' ' CZ ' ' D' ' 341' ' ' PHE . 64.4 t-20 -58.56 -59.05 5.99 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.354 -0.841 . . . . 1.09 109.735 179.978 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 346' ' ' GLU . . . . . 0.44 ' OE1' ' NZ ' ' A' ' 351' ' ' LYS . 1.1 tm-20 -61.64 -26.38 67.96 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.237 -0.914 . . . . 1.66 109.943 -179.642 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 347' ' ' ALA . . . . . 0.478 ' HB1' ' HB1' ' A' ' 347' ' ' ALA . . . -60.67 -57.7 11.6 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.187 -0.946 . . . . 0.17 110.116 -179.817 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 348' ' ' LEU . . . . . 0.695 HD12 ' CZ ' ' D' ' 337' ' ' ARG . 4.1 mm? -62.06 -44.7 96.12 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.188 -0.945 . . . . 0.29 110.192 -179.448 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 349' ' ' GLU . . . . . . . . . . . . . 11.3 mm-40 -58.35 -33.09 69.16 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.222 -0.924 . . . . 1.95 109.979 -179.422 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 350' ' ' LEU . . . . . 0.825 HD11 ' NE2' ' A' ' 354' ' ' GLN . 5.2 tt -64.59 -43.34 94.12 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.258 -0.901 . . . . 0.45 109.858 -179.797 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 351' ' ' LYS . . . . . 0.465 ' NZ ' ' OE1' ' A' ' 346' ' ' GLU . 19.1 tttp -59.5 -44.57 93.07 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.365 -0.834 . . . . 1.38 109.917 -179.588 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 352' ' ' ASP . . . . . . . . . . . . . 37.2 m-20 -58.68 -49.24 78.27 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.242 -0.911 . . . . 1.16 110.178 -179.676 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 353' ' ' ALA . . . . . . . . . . . . . . . -65.8 -11.22 44.37 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.044 -1.035 . . . . 0.61 109.839 -179.438 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 354' ' ' GLN . . . . . 0.872 ' NE2' HD11 ' A' ' 350' ' ' LEU . 1.6 mt-30 . . . . . 0 N--CA 1.49 1.54 0 O-C-N 121.189 -0.945 . . . . 1.45 109.464 179.962 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' C' C ' 326' ' ' GLU . . . . . . . . . . . . . 1.8 mm-40 . . . . . 0 N--CA 1.491 1.592 0 N-CA-C 109.527 -0.545 . . . . 2.17 109.527 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' C' C ' 327' ' ' TYR . . . . . 0.542 ' CE1' ' HG2' ' A' ' 333' ' ' ARG . 41.2 m-85 -149.94 105.79 3.44 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.245 -0.909 . . . . 0.48 109.76 179.847 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' C' C ' 328' ' ' PHE . . . . . 0.437 ' O ' HG23 ' C' ' 329' ' ' THR . 91.6 m-85 -111.7 -164.21 0.9 Allowed 'General case' 0 C--N 1.303 -1.436 0 O-C-N 121.42 -0.8 . . . . 0.33 109.185 179.757 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' C' C ' 329' ' ' THR . . . . . 0.437 HG23 ' O ' ' C' ' 328' ' ' PHE . 11.3 p -153.94 160.46 42.11 Favored 'General case' 0 C--N 1.302 -1.478 0 O-C-N 121.397 -0.815 . . . . 0.23 109.064 179.776 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' C' C ' 330' ' ' LEU . . . . . 0.706 HD11 HD22 ' A' ' 345' ' ' ASN . 16.7 tp -148.96 125.64 11.09 Favored 'General case' 0 N--CA 1.488 1.471 0 O-C-N 121.252 -0.905 . . . . 0.28 109.644 -179.788 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' C' C ' 331' ' ' GLN . . . . . . . . . . . . . 1.5 tp60 -86.93 116.65 25.14 Favored 'General case' 0 N--CA 1.489 1.5 0 O-C-N 121.282 -0.887 . . . . 1.48 109.021 179.61 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' C' C ' 332' ' ' ILE . . . . . 0.407 HD13 ' CD2' ' C' ' 341' ' ' PHE . 59.6 mt -103.3 110.02 28.62 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.452 0 O-C-N 121.128 -0.983 . . . . 0.24 109.654 -179.796 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' C' C ' 333' ' ' ARG . . . . . 0.605 ' CG ' ' CE1' ' A' ' 327' ' ' TYR . 2.1 mpt_? -71.61 149.75 45.32 Favored 'General case' 0 C--N 1.304 -1.381 0 O-C-N 121.334 -0.854 . . . . 2.74 109.07 179.634 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' C' C ' 334' ' ' GLY . . . . . . . . . . . . . . . 80.98 130.09 0.99 Allowed Glycine 0 N--CA 1.489 2.189 0 N-CA-C 109.567 -1.413 . . . . 0.35 109.567 -179.942 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' C' C ' 335' ' ' ARG . . . . . . . . . . . . . 57.1 ttt180 -77.92 -36.88 48.91 Favored 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.401 -1.058 . . . . 2.53 109.52 -179.89 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' C' C ' 336' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -57.5 -58.28 8.98 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.371 -0.831 . . . . 2.62 110.169 -179.471 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' C' C ' 337' ' ' ARG . . . . . 0.555 ' HG3' ' NH1' ' C' ' 337' ' ' ARG . 0.1 OUTLIER -59.87 -31.92 70.23 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.173 -0.954 . . . . 2.81 109.797 -179.638 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' C' C ' 338' ' ' PHE . . . . . . . . . . . . . 79.7 t80 -54.07 -55.21 29.69 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.294 -0.879 . . . . 0.4 109.745 -179.72 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' C' C ' 339' ' ' GLU . . . . . . . . . . . . . 34.0 mt-10 -52.01 -35.71 47.66 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.299 -0.876 . . . . 2.05 109.977 -179.795 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' C' C ' 340' ' ' MET . . . . . . . . . . . . . 31.5 ttp -64.38 -51.2 64.47 Favored 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.307 -0.87 . . . . 0.32 110.304 -179.454 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' C' C ' 341' ' ' PHE . . . . . 0.407 ' CD2' HD13 ' C' ' 332' ' ' ILE . 33.1 m-85 -62.06 -40.06 94.5 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.056 -1.028 . . . . 0.18 110.365 -179.338 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' C' C ' 342' ' ' ARG . . . . . 0.522 ' NH1' ' HG3' ' C' ' 342' ' ' ARG . 0.0 OUTLIER -51.7 -48.61 63.46 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.022 -1.049 . . . . 2.91 110.091 -179.516 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' C' C ' 343' ' ' GLU . . . . . . . . . . . . . 1.6 tp10 -59.74 -43.81 94.06 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.274 -0.891 . . . . 2.14 110.247 -179.419 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' C' C ' 344' ' ' LEU . . . . . . . . . . . . . 53.6 mt -61.5 -34.53 75.66 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.157 -0.964 . . . . 0.22 109.839 -179.529 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' C' C ' 345' ' ' ASN . . . . . 0.406 ' O ' ' HG2' ' C' ' 349' ' ' GLU . 39.0 t-20 -58.82 -57.77 11.57 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.242 -0.911 . . . . 1.08 109.71 -179.997 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' C' C ' 346' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -60.61 -24.87 65.84 Favored 'General case' 0 N--CA 1.489 1.486 0 O-C-N 121.205 -0.934 . . . . 2.21 109.926 -179.603 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' C' C ' 347' ' ' ALA . . . . . 0.562 ' HB1' ' HB1' ' D' ' 347' ' ' ALA . . . -62.07 -59.62 4.81 Favored 'General case' 0 N--CA 1.489 1.501 0 O-C-N 121.095 -1.003 . . . . 0.18 109.65 -179.979 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' C' C ' 348' ' ' LEU . . . . . 0.654 HD12 ' NH2' ' A' ' 337' ' ' ARG . 3.8 mm? -64.43 -48.35 75.66 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.271 -0.893 . . . . 0.32 110.328 -179.583 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' C' C ' 349' ' ' GLU . . . . . 0.406 ' HG2' ' O ' ' C' ' 345' ' ' ASN . 3.8 mm-40 -55.33 -34.11 63.92 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.119 -0.988 . . . . 2.19 109.482 -179.393 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' C' C ' 350' ' ' LEU . . . . . 0.811 ' CD2' HD13 ' D' ' 350' ' ' LEU . 5.0 tt -64.87 -36.98 86.11 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.301 -0.874 . . . . 0.46 109.073 179.695 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' C' C ' 351' ' ' LYS . . . . . . . . . . . . . 19.4 tttt -60.33 -47.57 85.47 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.494 -0.754 . . . . 1.35 109.306 179.913 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' C' C ' 352' ' ' ASP . . . . . . . . . . . . . 15.0 m-20 -55.88 -52.96 62.26 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.385 -0.822 . . . . 1.19 109.514 -179.988 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' C' C ' 353' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 1.624 0 O-C-N 121.188 -0.945 . . . . 0.57 109.59 -179.818 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' D' D ' 326' ' ' GLU . . . . . . . . . . . . . 66.1 mm-40 . . . . . 0 N--CA 1.488 1.436 0 N-CA-C 109.222 -0.659 . . . . 2.13 109.222 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' D' D ' 327' ' ' TYR . . . . . 0.541 ' CE1' ' HG2' ' B' ' 333' ' ' ARG . 43.8 m-85 -148.44 94.81 2.35 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.21 -0.931 . . . . 0.47 109.453 -179.875 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' D' D ' 328' ' ' PHE . . . . . 0.453 ' O ' ' OE1' ' B' ' 331' ' ' GLN . 85.6 m-85 -103.03 -162.54 0.92 Allowed 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.191 -0.943 . . . . 0.3 109.574 179.93 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' D' D ' 329' ' ' THR . . . . . 0.42 ' HA ' ' O ' ' B' ' 330' ' ' LEU . 40.3 p -154.24 166.79 32.05 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.316 -0.865 . . . . 0.22 108.951 179.895 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' D' D ' 330' ' ' LEU . . . . . . . . . . . . . 18.7 tp -149.78 125.96 10.69 Favored 'General case' 0 N--CA 1.488 1.443 0 O-C-N 121.029 -1.044 . . . . 0.28 109.824 -179.502 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' D' D ' 331' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -87.48 112.48 22.24 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.203 -0.936 . . . . 0.93 108.876 179.491 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' D' D ' 332' ' ' ILE . . . . . 0.542 HG21 ' HA ' ' D' ' 338' ' ' PHE . 47.2 mt -103.34 109.64 27.54 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.543 0 O-C-N 121.257 -0.902 . . . . 0.25 109.858 -179.68 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' D' D ' 333' ' ' ARG . . . . . 0.579 ' HG2' ' CE1' ' B' ' 327' ' ' TYR . 82.0 mtt180 -72.84 150.74 42.44 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.445 -0.784 . . . . 2.93 109.358 179.838 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' D' D ' 334' ' ' GLY . . . . . . . . . . . . . . . 80.75 125.18 0.63 Allowed Glycine 0 N--CA 1.491 2.308 0 N-CA-C 109.373 -1.491 . . . . 0.41 109.373 -179.833 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' D' D ' 335' ' ' ARG . . . . . . . . . . . . . 57.0 ttt180 -75.7 -33.65 60.35 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.366 -1.079 . . . . 3.03 109.535 -179.978 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' D' D ' 336' ' ' GLU . . . . . . . . . . . . . 60.8 tt0 -58.29 -62.2 2.01 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.255 -0.903 . . . . 2.26 109.77 -179.854 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' D' D ' 337' ' ' ARG . . . . . 0.695 ' CZ ' HD12 ' B' ' 348' ' ' LEU . 7.4 mmt180 -61.23 -32.85 72.64 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.247 -0.908 . . . . 2.92 109.74 -179.771 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' D' D ' 338' ' ' PHE . . . . . 0.542 ' HA ' HG21 ' D' ' 332' ' ' ILE . 46.5 t80 -54.44 -57.64 10.54 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.289 -0.882 . . . . 0.37 109.72 -179.732 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' D' D ' 339' ' ' GLU . . . . . . . . . . . . . 41.2 mt-10 -50.99 -34.88 30.97 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.166 -0.959 . . . . 1.99 109.978 -179.666 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' D' D ' 340' ' ' MET . . . . . . . . . . . . . 46.7 ttp -63.84 -49.74 71.61 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.086 -1.009 . . . . 0.31 110.019 -179.496 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' D' D ' 341' ' ' PHE . . . . . 0.428 ' CZ ' ' HA ' ' B' ' 345' ' ' ASN . 44.7 m-85 -61.31 -46.6 89.61 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.126 -0.984 . . . . 0.18 110.007 -179.674 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' D' D ' 342' ' ' ARG . . . . . . . . . . . . . 6.0 ttt180 -49.39 -42.58 42.76 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.168 -0.958 . . . . 2.41 110.02 -179.625 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' D' D ' 343' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -58.65 -49.93 75.72 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.133 -0.979 . . . . 2.35 109.844 -179.518 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' D' D ' 344' ' ' LEU . . . . . . . . . . . . . 60.2 mt -59.93 -30.89 69.36 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.175 -0.953 . . . . 0.19 109.504 -179.786 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' D' D ' 345' ' ' ASN . . . . . 0.512 HD22 HD11 ' B' ' 330' ' ' LEU . 64.3 t-20 -58.61 -59.29 5.63 Favored 'General case' 0 N--CA 1.488 1.455 0 O-C-N 121.204 -0.935 . . . . 1.09 109.82 179.955 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' D' D ' 346' ' ' GLU . . . . . . . . . . . . . 1.2 tm-20 -61.31 -26.71 67.98 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.29 -0.881 . . . . 1.69 109.981 -179.687 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' D' D ' 347' ' ' ALA . . . . . 0.562 ' HB1' ' HB1' ' C' ' 347' ' ' ALA . . . -60.29 -57.72 11.6 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.1 -1.0 . . . . 0.18 110.111 -179.723 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' D' D ' 348' ' ' LEU . . . . . 0.599 HD22 ' N ' ' D' ' 348' ' ' LEU . 4.1 mm? -62.12 -44.68 96.1 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.152 -0.968 . . . . 0.31 110.092 -179.348 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' D' D ' 349' ' ' GLU . . . . . . . . . . . . . 10.2 mm-40 -58.22 -33.31 69.17 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.209 -0.932 . . . . 1.95 110.018 -179.436 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' D' D ' 350' ' ' LEU . . . . . 0.811 HD13 ' CD2' ' C' ' 350' ' ' LEU . 5.3 tt -64.44 -43.89 92.86 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.147 -0.971 . . . . 0.43 109.716 -179.819 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' D' D ' 351' ' ' LYS . . . . . 0.433 ' O ' ' HB2' ' D' ' 354' ' ' GLN . 18.7 tttp -58.96 -44.72 91.54 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.371 -0.831 . . . . 1.4 110.015 -179.601 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' D' D ' 352' ' ' ASP . . . . . . . . . . . . . 35.2 m-20 -58.46 -48.9 79.24 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.297 -0.877 . . . . 1.17 110.307 -179.576 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' D' D ' 353' ' ' ALA . . . . . . . . . . . . . . . -66.43 -11.15 50.3 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.259 -0.901 . . . . 0.59 109.784 -179.351 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' D' D ' 354' ' ' GLN . . . . . 0.546 ' HG3' HD23 ' D' ' 350' ' ' LEU . 1.5 mt-30 . . . . . 0 N--CA 1.491 1.592 0 O-C-N 121.211 -0.93 . . . . 1.44 109.484 179.829 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 326' ' ' GLU . . . . . . . . . . . . . 2.9 mm-40 . . . . . 0 N--CA 1.489 1.489 0 N-CA-C 109.016 -0.735 . . . . 2.13 109.016 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 327' ' ' TYR . . . . . 0.577 ' CE1' ' HG2' ' C' ' 333' ' ' ARG . 48.1 m-85 -148.98 102.42 3.26 Favored 'General case' 0 N--CA 1.488 1.444 0 O-C-N 121.168 -0.958 . . . . 0.48 109.395 179.985 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 328' ' ' PHE . . . . . . . . . . . . . 37.8 m-85 -106.87 -168.24 1.38 Allowed 'General case' 0 N--CA 1.489 1.479 0 O-C-N 121.406 -0.809 . . . . 0.31 109.282 -179.962 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 329' ' ' THR . . . . . . . . . . . . . 6.3 p -152.41 166.92 30.4 Favored 'General case' 0 N--CA 1.488 1.428 0 O-C-N 121.284 -0.885 . . . . 0.22 109.007 179.96 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 330' ' ' LEU . . . . . 0.497 HD11 HD22 ' C' ' 345' ' ' ASN . 16.9 tp -148.97 130.37 14.74 Favored 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.173 -0.954 . . . . 0.28 109.767 -179.605 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 331' ' ' GLN . . . . . . . . . . . . . 19.1 tp60 -88.42 111.78 22.17 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.326 -0.859 . . . . 0.91 109.53 179.785 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 332' ' ' ILE . . . . . 0.505 HG21 ' HA ' ' A' ' 338' ' ' PHE . 75.7 mt -103.96 111.41 33.51 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.702 0 O-C-N 121.121 -0.987 . . . . 0.26 109.603 179.836 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 333' ' ' ARG . . . . . 0.534 ' HG2' ' CE1' ' C' ' 327' ' ' TYR . 67.5 mtt180 -73.94 151.27 40.41 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.289 -0.882 . . . . 2.92 109.714 -179.983 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 334' ' ' GLY . . . . . . . . . . . . . . . 75.79 130.36 0.31 Allowed Glycine 0 N--CA 1.49 2.299 0 N-CA-C 109.545 -1.422 . . . . 0.4 109.545 179.914 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 335' ' ' ARG . . . . . 0.446 ' HB2' ' CZ ' ' C' ' 328' ' ' PHE . 33.1 ttt180 -78.21 -31.65 49.51 Favored 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.216 -1.167 . . . . 3.01 109.675 -179.819 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 336' ' ' GLU . . . . . . . . . . . . . 2.2 mt-10 -57.78 -62.01 2.11 Favored 'General case' 0 N--CA 1.493 1.675 0 O-C-N 121.19 -0.944 . . . . 2.29 109.776 -179.816 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 337' ' ' ARG . . . . . 0.421 HH11 ' HG2' ' A' ' 337' ' ' ARG . 1.9 mmt-85 -59.92 -32.05 70.42 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.238 -0.914 . . . . 2.93 109.529 -179.922 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 338' ' ' PHE . . . . . 0.505 ' HA ' HG21 ' A' ' 332' ' ' ILE . 64.5 t80 -56.44 -57.65 11.4 Favored 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.262 -0.899 . . . . 0.38 109.818 -179.991 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 339' ' ' GLU . . . . . . . . . . . . . 48.2 mt-10 -51.77 -31.92 28.86 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.231 -0.918 . . . . 1.97 109.947 -179.841 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 340' ' ' MET . . . . . . . . . . . . . 37.9 ttp -63.9 -50.66 67.88 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.239 -0.913 . . . . 0.31 109.729 -179.601 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 341' ' ' PHE . . . . . . . . . . . . . 39.2 m-85 -62.66 -41.86 99.3 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.297 -0.877 . . . . 0.18 109.949 -179.62 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 342' ' ' ARG . . . . . 0.538 ' HG2' ' NH1' ' A' ' 342' ' ' ARG . 0.1 OUTLIER -50.4 -42.43 53.63 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.093 -1.004 . . . . 2.42 109.771 -179.818 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 343' ' ' GLU . . . . . . . . . . . . . 2.3 tp10 -57.65 -45.72 85.11 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.211 -0.931 . . . . 2.35 109.705 -179.708 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 344' ' ' LEU . . . . . . . . . . . . . 32.3 mt -62.36 -33.4 74.66 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.108 -0.995 . . . . 0.18 109.452 -179.973 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 345' ' ' ASN . . . . . . . . . . . . . 8.8 t-20 -56.72 -58.35 8.45 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.249 -0.907 . . . . 1.09 109.848 -179.797 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 346' ' ' GLU . . . . . . . . . . . . . 3.2 tt0 -60.42 -28.75 68.51 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.212 -0.93 . . . . 1.65 109.88 -179.539 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 347' ' ' ALA . . . . . 0.835 ' HB1' ' HB1' ' B' ' 347' ' ' ALA . . . -61.07 -59.84 4.72 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.122 -0.986 . . . . 0.18 110.132 -179.996 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 348' ' ' LEU . . . . . 0.591 HD22 ' N ' ' A' ' 348' ' ' LEU . 4.0 mm? -61.8 -43.74 98.26 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.27 -0.894 . . . . 0.3 110.058 -179.48 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 349' ' ' GLU . . . . . 0.42 ' OE2' ' NH1' ' C' ' 333' ' ' ARG . 1.8 mm-40 -56.7 -36.74 70.01 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.214 -0.929 . . . . 1.94 109.753 -179.393 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 350' ' ' LEU . . . . . 0.915 HD22 HD13 ' B' ' 350' ' ' LEU . 5.0 tt -63.2 -42.96 99.39 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.17 -0.956 . . . . 0.46 109.504 -179.738 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 351' ' ' LYS . . . . . . . . . . . . . 29.9 tttp -58.2 -35.55 71.8 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.142 -0.974 . . . . 1.4 109.132 179.89 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 352' ' ' ASP . . . . . . . . . . . . . 98.4 m-20 -57.07 -40.62 77.24 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.35 -0.844 . . . . 1.16 109.367 179.764 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 353' ' ' ALA . . . . . . . . . . . . . . . -67.74 -24.45 65.36 Favored 'General case' 0 N--CA 1.489 1.491 0 O-C-N 121.317 -0.865 . . . . 0.63 109.865 -179.838 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 354' ' ' GLN . . . . . . . . . . . . . 4.0 tt0 . . . . . 0 N--CA 1.493 1.685 0 O-C-N 121.085 -1.009 . . . . 1.47 109.671 179.945 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' B' B ' 326' ' ' GLU . . . . . . . . . . . . . 3.1 mm-40 . . . . . 0 N--CA 1.488 1.452 0 N-CA-C 109.125 -0.694 . . . . 2.13 109.125 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' B' B ' 327' ' ' TYR . . . . . 0.556 ' CE1' ' HG2' ' D' ' 333' ' ' ARG . 48.8 m-85 -148.84 103.51 3.37 Favored 'General case' 0 N--CA 1.488 1.463 0 O-C-N 121.28 -0.887 . . . . 0.48 109.247 179.782 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 328' ' ' PHE . . . . . . . . . . . . . 38.4 m-85 -108.27 -168.79 1.41 Allowed 'General case' 0 N--CA 1.488 1.473 0 O-C-N 121.249 -0.907 . . . . 0.32 109.149 -179.998 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 329' ' ' THR . . . . . . . . . . . . . 6.7 p -151.8 167.13 29.24 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.213 -0.929 . . . . 0.23 109.27 179.985 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 330' ' ' LEU . . . . . . . . . . . . . 16.9 tp -149.08 130.65 14.89 Favored 'General case' 0 N--CA 1.488 1.437 0 O-C-N 121.15 -0.969 . . . . 0.28 109.74 -179.648 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 331' ' ' GLN . . . . . . . . . . . . . 19.6 tp60 -88.88 111.71 22.39 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.45 -0.781 . . . . 0.91 109.409 179.951 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 332' ' ' ILE . . . . . 0.503 HG21 ' HA ' ' B' ' 338' ' ' PHE . 75.5 mt -103.93 111.19 32.61 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.603 0 O-C-N 121.151 -0.968 . . . . 0.24 109.637 179.91 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 333' ' ' ARG . . . . . 0.55 ' HG2' ' CE1' ' D' ' 327' ' ' TYR . 67.5 mtt180 -73.71 151.47 40.7 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.187 -0.946 . . . . 2.93 109.648 -179.984 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 334' ' ' GLY . . . . . . . . . . . . . . . 75.79 130.17 0.3 Allowed Glycine 0 N--CA 1.491 2.316 0 N-CA-C 109.772 -1.331 . . . . 0.4 109.772 179.827 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 335' ' ' ARG . . . . . . . . . . . . . 34.8 ttt180 -78.12 -31.32 49.85 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.291 -1.123 . . . . 3.01 109.808 -179.924 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 336' ' ' GLU . . . . . . . . . . . . . 2.1 mt-10 -58.28 -61.71 2.37 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.058 -1.026 . . . . 2.28 109.789 -179.736 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 337' ' ' ARG . . . . . 0.427 HH11 ' HG2' ' B' ' 337' ' ' ARG . 1.6 mmt-85 -60.2 -31.69 70.39 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.174 -0.953 . . . . 2.93 109.601 -179.864 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 338' ' ' PHE . . . . . 0.503 ' HA ' HG21 ' B' ' 332' ' ' ILE . 64.9 t80 -56.32 -58.5 7.74 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.147 -0.97 . . . . 0.37 109.712 179.837 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 339' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -51.04 -32.07 20.55 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.172 -0.955 . . . . 1.98 109.893 -179.867 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 340' ' ' MET . . . . . . . . . . . . . 39.4 ttp -63.41 -50.95 67.83 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.095 -1.003 . . . . 0.32 109.795 -179.743 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 341' ' ' PHE . . . . . . . . . . . . . 40.1 m-85 -62.5 -41.84 99.09 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.253 -0.904 . . . . 0.18 109.99 -179.589 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 342' ' ' ARG . . . . . 0.547 ' NH1' ' HG2' ' B' ' 342' ' ' ARG . 0.1 OUTLIER -50.63 -41.86 55.56 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.153 -0.967 . . . . 2.42 109.902 -179.662 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' B' B ' 343' ' ' GLU . . . . . . . . . . . . . 2.3 tp10 -58.38 -46.22 86.79 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.162 -0.961 . . . . 2.35 109.565 -179.707 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 344' ' ' LEU . . . . . . . . . . . . . 34.5 mt -61.51 -33.79 74.4 Favored 'General case' 0 N--CA 1.489 1.477 0 O-C-N 121.277 -0.889 . . . . 0.18 109.421 179.937 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 345' ' ' ASN . . . . . . . . . . . . . 9.0 t-20 -56.86 -57.5 12.23 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.235 -0.915 . . . . 1.09 110.066 -179.669 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 346' ' ' GLU . . . . . . . . . . . . . 3.2 tt0 -61.12 -28.41 69.08 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.263 -0.898 . . . . 1.66 109.697 -179.569 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 347' ' ' ALA . . . . . 0.835 ' HB1' ' HB1' ' A' ' 347' ' ' ALA . . . -61.28 -59.94 4.52 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.189 -0.945 . . . . 0.17 110.047 -179.785 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 348' ' ' LEU . . . . . 0.593 HD22 ' N ' ' B' ' 348' ' ' LEU . 4.0 mm? -61.71 -43.74 98.28 Favored 'General case' 0 N--CA 1.494 1.743 0 O-C-N 121.356 -0.84 . . . . 0.29 109.994 -179.49 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 349' ' ' GLU . . . . . . . . . . . . . 1.8 mm-40 -56.75 -36.61 69.96 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.24 -0.912 . . . . 1.95 109.958 -179.419 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 350' ' ' LEU . . . . . 0.915 HD13 HD22 ' A' ' 350' ' ' LEU . 5.0 tt -63.42 -42.88 98.72 Favored 'General case' 0 N--CA 1.489 1.484 0 O-C-N 121.108 -0.995 . . . . 0.45 109.428 -179.777 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 351' ' ' LYS . . . . . . . . . . . . . 30.4 tttp -57.96 -35.92 71.83 Favored 'General case' 0 N--CA 1.489 1.481 0 O-C-N 121.07 -1.019 . . . . 1.38 109.135 179.832 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 352' ' ' ASP . . . . . . . . . . . . . 98.4 m-20 -57.05 -40.49 76.89 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.351 -0.843 . . . . 1.16 109.403 179.8 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 353' ' ' ALA . . . . . . . . . . . . . . . -67.71 -24.54 65.4 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.308 -0.87 . . . . 0.61 109.71 -179.763 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 354' ' ' GLN . . . . . . . . . . . . . 3.8 tt0 . . . . . 0 N--CA 1.492 1.663 0 O-C-N 121.222 -0.924 . . . . 1.45 109.704 -179.875 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' C' C ' 326' ' ' GLU . . . . . 0.42 ' HB3' ' CE1' ' C' ' 328' ' ' PHE . 6.8 mm-40 . . . . . 0 N--CA 1.491 1.577 0 CA-C-O 121.347 0.594 . . . . 2.17 109.561 . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' C' C ' 327' ' ' TYR . . . . . 0.534 ' CE1' ' HG2' ' A' ' 333' ' ' ARG . 46.1 m-85 -148.61 107.79 3.91 Favored 'General case' 0 N--CA 1.488 1.443 0 O-C-N 121.327 -0.858 . . . . 0.48 109.267 -179.982 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' C' C ' 328' ' ' PHE . . . . . 0.446 ' CZ ' ' HB2' ' A' ' 335' ' ' ARG . 14.4 m-85 -113.66 -167.84 1.26 Allowed 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.345 -0.847 . . . . 0.33 109.433 179.914 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' C' C ' 329' ' ' THR . . . . . . . . . . . . . 29.5 p -151.46 169.54 21.78 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.341 -0.849 . . . . 0.23 109.282 -180.0 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' C' C ' 330' ' ' LEU . . . . . . . . . . . . . 28.3 tp -150.62 123.32 8.59 Favored 'General case' 0 C--N 1.304 -1.398 0 O-C-N 121.264 -0.898 . . . . 0.28 109.509 -179.787 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' C' C ' 331' ' ' GLN . . . . . . . . . . . . . 1.2 tt0 -86.71 115.56 24.23 Favored 'General case' 0 N--CA 1.489 1.48 0 O-C-N 121.317 -0.865 . . . . 1.48 108.974 179.599 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' C' C ' 332' ' ' ILE . . . . . 0.709 HG21 ' HA ' ' C' ' 338' ' ' PHE . 84.2 mt -103.2 111.78 34.24 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.511 0 O-C-N 121.178 -0.951 . . . . 0.24 109.62 -179.552 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' C' C ' 333' ' ' ARG . . . . . 0.577 ' HG2' ' CE1' ' A' ' 327' ' ' TYR . 5.6 mtp180 -73.35 144.38 46.51 Favored 'General case' 0 N--CA 1.487 1.422 0 O-C-N 121.274 -0.891 . . . . 2.74 109.443 179.8 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' C' C ' 334' ' ' GLY . . . . . . . . . . . . . . . 75.99 123.76 0.17 Allowed Glycine 0 N--CA 1.49 2.293 0 N-CA-C 109.572 -1.411 . . . . 0.35 109.572 179.864 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' C' C ' 335' ' ' ARG . . . . . 0.511 ' HG2' ' NH1' ' C' ' 335' ' ' ARG . 0.7 OUTLIER -70.59 -24.89 62.84 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.296 -1.12 . . . . 2.53 109.858 -179.728 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' C' C ' 336' ' ' GLU . . . . . . . . . . . . . 18.4 mt-10 -56.25 -67.8 0.27 Allowed 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.169 -0.957 . . . . 2.62 109.737 -179.553 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' C' C ' 337' ' ' ARG . . . . . 0.479 ' HD2' ' N ' ' C' ' 337' ' ' ARG . 11.4 mpt_? -60.11 -30.22 69.12 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.245 -0.91 . . . . 2.81 109.774 -179.823 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' C' C ' 338' ' ' PHE . . . . . 0.709 ' HA ' HG21 ' C' ' 332' ' ' ILE . 57.8 t80 -54.67 -59.75 4.29 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.325 -0.859 . . . . 0.4 109.984 -179.634 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' C' C ' 339' ' ' GLU . . . . . . . . . . . . . 14.8 mt-10 -51.14 -34.47 31.24 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.256 -0.903 . . . . 2.05 110.306 -179.567 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' C' C ' 340' ' ' MET . . . . . . . . . . . . . 53.8 ttp -63.62 -50.45 69.32 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.089 -1.007 . . . . 0.32 109.956 -179.611 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' C' C ' 341' ' ' PHE . . . . . . . . . . . . . 65.2 m-85 -61.56 -45.41 94.26 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.243 -0.911 . . . . 0.18 109.948 -179.593 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' C' C ' 342' ' ' ARG . . . . . . . . . . . . . 1.9 tmt_? -48.98 -42.69 38.61 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.282 -0.886 . . . . 2.91 110.025 -179.59 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' C' C ' 343' ' ' GLU . . . . . . . . . . . . . 28.8 tt0 -59.61 -47.04 87.13 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.153 -0.967 . . . . 2.14 110.24 -179.373 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' C' C ' 344' ' ' LEU . . . . . 0.401 HD22 HD22 ' D' ' 344' ' ' LEU . 73.4 mt -61.78 -34.58 76.14 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.142 -0.974 . . . . 0.22 110.218 -179.44 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' C' C ' 345' ' ' ASN . . . . . 0.497 HD22 HD11 ' A' ' 330' ' ' LEU . 39.1 t30 -57.64 -55.66 31.91 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.094 -1.004 . . . . 1.08 109.944 -179.526 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' C' C ' 346' ' ' GLU . . . . . 0.486 ' O ' ' HB2' ' C' ' 350' ' ' LEU . 3.5 tt0 -59.94 -27.34 66.69 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.164 -0.96 . . . . 2.21 109.638 -179.635 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' C' C ' 347' ' ' ALA . . . . . 0.979 ' HB1' ' HB1' ' D' ' 347' ' ' ALA . . . -62.76 -58.06 8.77 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.169 -0.957 . . . . 0.18 110.076 -179.917 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' C' C ' 348' ' ' LEU . . . . . 0.582 HD22 ' N ' ' C' ' 348' ' ' LEU . 4.2 mm? -62.52 -50.25 72.13 Favored 'General case' 0 N--CA 1.494 1.739 0 O-C-N 121.276 -0.89 . . . . 0.32 110.42 -179.289 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' C' C ' 349' ' ' GLU . . . . . . . . . . . . . 67.5 mm-40 -57.18 -33.42 67.44 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.124 -0.985 . . . . 2.19 109.831 -179.242 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' C' C ' 350' ' ' LEU . . . . . 0.795 HD22 HD13 ' D' ' 350' ' ' LEU . 5.4 tt -62.81 -40.22 96.71 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.236 -0.915 . . . . 0.46 109.383 -179.902 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' C' C ' 351' ' ' LYS . . . . . 0.4 ' HE3' ' OE1' ' D' ' 346' ' ' GLU . 1.5 tttm -62.13 -47.77 83.08 Favored 'General case' 0 N--CA 1.488 1.455 0 O-C-N 121.207 -0.933 . . . . 1.35 110.169 -179.801 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' C' C ' 352' ' ' ASP . . . . . . . . . . . . . 77.5 m-20 -51.35 -27.18 9.06 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.199 -0.938 . . . . 1.19 109.247 -179.6 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' C' C ' 353' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.488 1.469 0 O-C-N 121.323 -0.861 . . . . 0.57 109.312 179.742 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' D' D ' 326' ' ' GLU . . . . . . . . . . . . . 3.2 mm-40 . . . . . 0 N--CA 1.488 1.473 0 N-CA-C 109.028 -0.731 . . . . 2.13 109.028 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' D' D ' 327' ' ' TYR . . . . . 0.55 ' CE1' ' HG2' ' B' ' 333' ' ' ARG . 47.2 m-85 -149.03 103.05 3.31 Favored 'General case' 0 N--CA 1.488 1.442 0 O-C-N 121.219 -0.926 . . . . 0.47 109.357 179.815 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' D' D ' 328' ' ' PHE . . . . . . . . . . . . . 39.5 m-85 -107.61 -168.5 1.39 Allowed 'General case' 0 N--CA 1.489 1.477 0 O-C-N 121.286 -0.884 . . . . 0.3 109.248 -179.953 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' D' D ' 329' ' ' THR . . . . . . . . . . . . . 7.1 p -152.04 166.97 29.95 Favored 'General case' 0 N--CA 1.488 1.457 0 O-C-N 121.259 -0.9 . . . . 0.22 109.144 179.942 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' D' D ' 330' ' ' LEU . . . . . . . . . . . . . 18.0 tp -148.9 130.75 15.16 Favored 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.184 -0.948 . . . . 0.28 109.778 -179.605 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' D' D ' 331' ' ' GLN . . . . . . . . . . . . . 19.3 tp60 -89.06 111.18 21.86 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.509 -0.744 . . . . 0.93 109.545 179.814 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' D' D ' 332' ' ' ILE . . . . . 0.51 HG21 ' HA ' ' D' ' 338' ' ' PHE . 74.0 mt -103.49 111.77 34.45 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.568 0 O-C-N 121.073 -1.017 . . . . 0.25 109.579 179.921 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' D' D ' 333' ' ' ARG . . . . . 0.556 ' HG2' ' CE1' ' B' ' 327' ' ' TYR . 68.2 mtt180 -74.07 151.56 40.14 Favored 'General case' 0 N--CA 1.488 1.451 0 O-C-N 121.221 -0.924 . . . . 2.93 109.7 179.901 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' D' D ' 334' ' ' GLY . . . . . . . . . . . . . . . 76.03 130.8 0.35 Allowed Glycine 0 N--CA 1.491 2.338 0 N-CA-C 109.663 -1.375 . . . . 0.41 109.663 179.798 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' D' D ' 335' ' ' ARG . . . . . . . . . . . . . 35.9 ttt180 -78.61 -31.99 47.31 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.309 -1.113 . . . . 3.03 109.715 -179.934 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' D' D ' 336' ' ' GLU . . . . . . . . . . . . . 2.1 mt-10 -57.44 -61.86 2.19 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.173 -0.954 . . . . 2.26 109.832 -179.732 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' D' D ' 337' ' ' ARG . . . . . 0.408 HH11 ' HG2' ' D' ' 337' ' ' ARG . 1.5 mmt-85 -60.3 -31.74 70.55 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.172 -0.955 . . . . 2.92 109.593 -179.831 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' D' D ' 338' ' ' PHE . . . . . 0.51 ' HA ' HG21 ' D' ' 332' ' ' ILE . 63.6 t80 -56.24 -58.19 9.01 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.347 -0.845 . . . . 0.37 109.739 179.898 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' D' D ' 339' ' ' GLU . . . . . . . . . . . . . 43.1 mt-10 -51.59 -31.67 25.72 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.257 -0.902 . . . . 1.99 109.901 -179.767 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' D' D ' 340' ' ' MET . . . . . . . . . . . . . 39.8 ttp -63.8 -50.68 68.02 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.244 -0.91 . . . . 0.31 109.768 -179.695 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' D' D ' 341' ' ' PHE . . . . . . . . . . . . . 40.3 m-85 -62.55 -41.92 99.2 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.234 -0.916 . . . . 0.18 110.086 -179.725 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' D' D ' 342' ' ' ARG . . . . . 0.558 ' NH1' ' HG2' ' D' ' 342' ' ' ARG . 0.2 OUTLIER -50.33 -42.56 53.03 Favored 'General case' 0 N--CA 1.492 1.675 0 O-C-N 121.125 -0.984 . . . . 2.41 109.843 -179.598 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' D' D ' 343' ' ' GLU . . . . . . . . . . . . . 2.2 tp10 -57.92 -45.65 86.2 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.239 -0.913 . . . . 2.35 109.652 -179.686 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' D' D ' 344' ' ' LEU . . . . . 0.401 HD22 HD22 ' C' ' 344' ' ' LEU . 36.0 mt -62.04 -34.13 75.66 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.223 -0.923 . . . . 0.19 109.398 -179.956 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' D' D ' 345' ' ' ASN . . . . . . . . . . . . . 9.2 t-20 -56.54 -58.13 9.35 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.277 -0.889 . . . . 1.09 109.95 -179.876 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' D' D ' 346' ' ' GLU . . . . . 0.4 ' OE1' ' HE3' ' C' ' 351' ' ' LYS . 3.1 tt0 -60.19 -28.95 68.38 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.269 -0.894 . . . . 1.69 109.704 -179.484 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' D' D ' 347' ' ' ALA . . . . . 0.979 ' HB1' ' HB1' ' C' ' 347' ' ' ALA . . . -61.1 -59.77 4.82 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.228 -0.92 . . . . 0.18 110.108 -179.766 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' D' D ' 348' ' ' LEU . . . . . 0.595 HD22 ' N ' ' D' ' 348' ' ' LEU . 4.0 mm? -61.71 -44.28 97.24 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.138 -0.976 . . . . 0.31 109.959 -179.39 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' D' D ' 349' ' ' GLU . . . . . . . . . . . . . 1.8 mm-40 -56.14 -36.69 68.55 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.175 -0.953 . . . . 1.95 109.892 -179.381 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' D' D ' 350' ' ' LEU . . . . . 0.795 HD13 HD22 ' C' ' 350' ' ' LEU . 5.1 tt -63.34 -42.48 98.94 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.169 -0.957 . . . . 0.43 109.467 -179.716 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' D' D ' 351' ' ' LYS . . . . . . . . . . . . . 30.9 tttp -58.63 -35.79 73.05 Favored 'General case' 0 N--CA 1.489 1.486 0 O-C-N 121.135 -0.978 . . . . 1.4 109.076 179.884 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' D' D ' 352' ' ' ASP . . . . . . . . . . . . . 98.6 m-20 -56.82 -40.45 76.03 Favored 'General case' 0 N--CA 1.488 1.47 0 O-C-N 121.345 -0.847 . . . . 1.17 109.479 179.729 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' D' D ' 353' ' ' ALA . . . . . . . . . . . . . . . -68.03 -24.54 65.11 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.334 -0.854 . . . . 0.59 109.737 -179.756 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' D' D ' 354' ' ' GLN . . . . . 0.479 HE22 HD11 ' C' ' 350' ' ' LEU . 3.9 tt0 . . . . . 0 N--CA 1.492 1.673 0 O-C-N 121.205 -0.934 . . . . 1.44 109.544 -179.914 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 326' ' ' GLU . . . . . . . . . . . . . 1.8 mm-40 . . . . . 0 N--CA 1.49 1.549 0 N-CA-C 109.241 -0.651 . . . . 2.13 109.241 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 327' ' ' TYR . . . . . 0.589 ' CE1' ' HG2' ' C' ' 333' ' ' ARG . 46.6 m-85 -149.14 105.31 3.5 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.129 -0.982 . . . . 0.48 109.767 -179.769 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 328' ' ' PHE . . . . . 0.552 ' CZ ' ' HD3' ' C' ' 335' ' ' ARG . 97.3 m-85 -112.28 -163.71 0.87 Allowed 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.388 -0.82 . . . . 0.31 109.407 179.801 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 329' ' ' THR . . . . . 0.449 ' HA ' ' O ' ' C' ' 330' ' ' LEU . 74.4 p -154.58 166.34 33.65 Favored 'General case' 0 N--CA 1.489 1.487 0 O-C-N 121.278 -0.889 . . . . 0.22 109.032 179.812 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 330' ' ' LEU . . . . . 0.421 ' O ' ' HA ' ' C' ' 329' ' ' THR . 32.9 tp -151.06 131.96 14.18 Favored 'General case' 0 N--CA 1.488 1.449 0 O-C-N 121.119 -0.988 . . . . 0.28 109.886 -179.775 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 331' ' ' GLN . . . . . . . . . . . . . 19.4 tp60 -86.87 114.84 23.85 Favored 'General case' 0 N--CA 1.488 1.449 0 O-C-N 121.318 -0.864 . . . . 0.91 109.121 179.688 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 332' ' ' ILE . . . . . 0.554 HG21 ' HA ' ' A' ' 338' ' ' PHE . 52.1 mt -103.26 107.22 21.66 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.572 0 O-C-N 121.215 -0.928 . . . . 0.26 109.659 -179.797 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 333' ' ' ARG . . . . . 0.532 ' HG2' ' CE1' ' C' ' 327' ' ' TYR . 9.9 mtp180 -72.49 140.04 48.0 Favored 'General case' 0 N--CA 1.488 1.447 0 O-C-N 121.252 -0.905 . . . . 2.92 109.45 179.897 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 334' ' ' GLY . . . . . . . . . . . . . . . 88.88 127.53 2.98 Favored Glycine 0 N--CA 1.49 2.297 0 N-CA-C 109.723 -1.351 . . . . 0.4 109.723 -179.991 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 335' ' ' ARG . . . . . 0.484 ' HB2' ' OE1' ' C' ' 326' ' ' GLU . 8.0 ttt180 -78.33 -34.62 48.48 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.265 -1.138 . . . . 3.01 109.636 179.956 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 336' ' ' GLU . . . . . . . . . . . . . 9.3 tt0 -57.89 -62.33 1.89 Allowed 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.166 -0.959 . . . . 2.29 109.714 -179.862 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 337' ' ' ARG . . . . . 0.512 ' NH1' ' HG2' ' A' ' 337' ' ' ARG . 0.0 OUTLIER -60.97 -27.39 68.23 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.202 -0.936 . . . . 2.93 109.717 -179.746 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 338' ' ' PHE . . . . . 0.554 ' HA ' HG21 ' A' ' 332' ' ' ILE . 52.0 t80 -54.08 -64.73 0.73 Allowed 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.239 -0.913 . . . . 0.38 109.651 -179.727 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 339' ' ' GLU . . . . . . . . . . . . . 43.2 mt-10 -50.62 -29.04 9.99 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.245 -0.909 . . . . 1.97 109.681 -179.739 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 340' ' ' MET . . . . . 0.448 ' HB3' ' O ' ' A' ' 337' ' ' ARG . 6.9 ttp -64.43 -52.29 58.81 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.17 -0.956 . . . . 0.31 109.851 -179.853 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 341' ' ' PHE . . . . . . . . . . . . . 40.4 m-85 -62.54 -44.61 95.93 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.313 -0.867 . . . . 0.18 110.068 -179.687 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 342' ' ' ARG . . . . . . . . . . . . . 1.8 ttp180 -49.82 -41.87 45.85 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.102 -0.999 . . . . 2.42 109.867 -179.598 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 343' ' ' GLU . . . . . . . . . . . . . 38.4 tt0 -59.06 -47.19 86.15 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.194 -0.941 . . . . 2.35 109.882 -179.697 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 344' ' ' LEU . . . . . 0.411 HD22 HD22 ' B' ' 344' ' ' LEU . 78.6 mt -62.71 -32.56 73.68 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.213 -0.929 . . . . 0.18 109.925 -179.65 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 345' ' ' ASN . . . . . 0.514 ' HA ' ' CZ ' ' C' ' 341' ' ' PHE . 53.8 t-20 -57.03 -56.09 26.26 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.203 -0.936 . . . . 1.09 110.064 -179.641 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 346' ' ' GLU . . . . . . . . . . . . . 3.9 tp10 -61.48 -26.79 68.13 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.145 -0.972 . . . . 1.65 110.089 -179.397 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 347' ' ' ALA . . . . . 0.984 ' HB1' ' HB1' ' B' ' 347' ' ' ALA . . . -61.41 -58.31 8.72 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.081 -1.012 . . . . 0.18 110.182 -179.618 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 348' ' ' LEU . . . . . 0.58 HD22 ' N ' ' A' ' 348' ' ' LEU . 4.0 mm? -62.1 -50.72 70.8 Favored 'General case' 0 N--CA 1.494 1.773 0 O-C-N 121.183 -0.948 . . . . 0.3 110.323 -179.287 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 349' ' ' GLU . . . . . . . . . . . . . 66.6 mt-10 -57.15 -30.87 64.81 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.184 -0.948 . . . . 1.94 110.055 -179.149 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 350' ' ' LEU . . . . . 0.616 HD22 HD22 ' B' ' 350' ' ' LEU . 8.9 tt -65.06 -45.59 84.68 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.147 -0.971 . . . . 0.46 109.579 -179.876 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 351' ' ' LYS . . . . . . . . . . . . . 41.1 tttm -57.35 -43.19 83.23 Favored 'General case' 0 N--CA 1.488 1.45 0 O-C-N 121.337 -0.852 . . . . 1.4 109.541 -179.441 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 352' ' ' ASP . . . . . . . . . . . . . 14.3 m-20 -55.85 -54.86 39.43 Favored 'General case' 0 N--CA 1.488 1.46 0 O-C-N 121.214 -0.929 . . . . 1.16 109.583 179.976 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 353' ' ' ALA . . . . . . . . . . . . . . . -68.47 -11.48 59.84 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.227 -0.921 . . . . 0.63 109.8 -179.832 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 354' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.49 1.566 0 O-C-N 121.167 -0.958 . . . . 1.47 109.723 -179.771 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 326' ' ' GLU . . . . . . . . . . . . . 1.8 mm-40 . . . . . 0 N--CA 1.49 1.572 0 N-CA-C 109.204 -0.665 . . . . 2.13 109.204 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' B' B ' 327' ' ' TYR . . . . . 0.58 ' CE1' ' HG2' ' D' ' 333' ' ' ARG . 46.2 m-85 -149.18 105.26 3.49 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.096 -1.003 . . . . 0.48 109.812 -179.79 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 328' ' ' PHE . . . . . 0.417 ' C ' HG23 ' B' ' 329' ' ' THR . 97.2 m-85 -112.16 -163.69 0.87 Allowed 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.375 -0.828 . . . . 0.32 109.471 179.783 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 329' ' ' THR . . . . . 0.417 HG23 ' C ' ' B' ' 328' ' ' PHE . 73.8 p -154.59 166.33 33.7 Favored 'General case' 0 N--CA 1.489 1.488 0 O-C-N 121.283 -0.886 . . . . 0.23 108.986 179.788 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 330' ' ' LEU . . . . . . . . . . . . . 32.5 tp -151.07 131.93 14.15 Favored 'General case' 0 N--CA 1.489 1.481 0 O-C-N 121.102 -0.999 . . . . 0.28 109.857 -179.809 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 331' ' ' GLN . . . . . . . . . . . . . 19.5 tp60 -86.89 114.97 23.97 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.358 -0.839 . . . . 0.91 109.081 179.688 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 332' ' ' ILE . . . . . 0.552 HG21 ' HA ' ' B' ' 338' ' ' PHE . 52.2 mt -103.38 106.9 20.99 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.58 0 O-C-N 121.248 -0.908 . . . . 0.24 109.677 -179.769 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 333' ' ' ARG . . . . . 0.489 ' HG2' ' CE1' ' D' ' 327' ' ' TYR . 9.8 mtp180 -72.22 140.05 48.49 Favored 'General case' 0 N--CA 1.489 1.497 0 O-C-N 121.259 -0.901 . . . . 2.93 109.414 179.756 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 334' ' ' GLY . . . . . . . . . . . . . . . 88.95 127.45 2.98 Favored Glycine 0 N--CA 1.491 2.361 0 N-CA-C 109.72 -1.352 . . . . 0.4 109.72 179.851 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 335' ' ' ARG . . . . . 0.474 ' O ' ' HB3' ' B' ' 338' ' ' PHE . 8.2 ttt180 -78.14 -34.77 49.65 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.303 -1.116 . . . . 3.01 109.576 179.991 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 336' ' ' GLU . . . . . . . . . . . . . 9.2 tt0 -57.79 -62.36 1.86 Allowed 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.265 -0.897 . . . . 2.28 109.771 -179.787 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 337' ' ' ARG . . . . . 0.519 ' HG2' ' NH1' ' B' ' 337' ' ' ARG . 0.0 OUTLIER -60.85 -27.55 68.19 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.258 -0.901 . . . . 2.93 109.827 -179.801 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' B' B ' 338' ' ' PHE . . . . . 0.552 ' HA ' HG21 ' B' ' 332' ' ' ILE . 52.2 t80 -53.92 -64.87 0.69 Allowed 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.284 -0.885 . . . . 0.37 109.669 -179.772 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 339' ' ' GLU . . . . . . . . . . . . . 42.7 mt-10 -50.5 -28.94 9.36 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.256 -0.902 . . . . 1.98 109.77 -179.775 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 340' ' ' MET . . . . . 0.45 ' HB3' ' O ' ' B' ' 337' ' ' ARG . 6.9 ttp -64.54 -52.2 58.91 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.182 -0.949 . . . . 0.32 109.79 -179.8 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 341' ' ' PHE . . . . . 0.546 ' CZ ' ' HA ' ' D' ' 345' ' ' ASN . 39.9 m-85 -62.66 -44.53 96.03 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.243 -0.911 . . . . 0.18 110.019 -179.624 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 342' ' ' ARG . . . . . . . . . . . . . 1.8 ttp180 -49.93 -41.79 47.04 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.156 -0.965 . . . . 2.42 109.918 -179.618 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 343' ' ' GLU . . . . . . . . . . . . . 37.4 tt0 -59.24 -47.15 86.42 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.181 -0.949 . . . . 2.35 109.793 -179.645 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 344' ' ' LEU . . . . . 0.411 HD22 HD22 ' A' ' 344' ' ' LEU . 79.3 mt -62.71 -32.46 73.57 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.129 -0.982 . . . . 0.18 109.825 -179.645 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 345' ' ' ASN . . . . . 0.461 ' HA ' ' CZ ' ' D' ' 341' ' ' PHE . 54.1 t-20 -57.22 -56.04 27.0 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.22 -0.925 . . . . 1.09 110.014 -179.585 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 346' ' ' GLU . . . . . . . . . . . . . 3.9 tp10 -61.49 -26.66 68.06 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.259 -0.9 . . . . 1.66 110.011 -179.443 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 347' ' ' ALA . . . . . 0.984 ' HB1' ' HB1' ' A' ' 347' ' ' ALA . . . -61.53 -58.34 8.53 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.124 -0.985 . . . . 0.17 110.17 -179.623 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 348' ' ' LEU . . . . . 0.584 HD22 ' N ' ' B' ' 348' ' ' LEU . 4.0 mm? -62.11 -50.75 70.65 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.192 -0.943 . . . . 0.29 110.327 -179.267 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 349' ' ' GLU . . . . . . . . . . . . . 66.7 mt-10 -57.09 -30.93 64.75 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.185 -0.947 . . . . 1.95 110.084 -179.15 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 350' ' ' LEU . . . . . 0.616 HD22 HD22 ' A' ' 350' ' ' LEU . 8.9 tt -65.01 -45.54 85.1 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.151 -0.968 . . . . 0.45 109.601 -179.923 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 351' ' ' LYS . . . . . . . . . . . . . 40.8 tttm -57.33 -43.17 83.13 Favored 'General case' 0 N--CA 1.489 1.497 0 O-C-N 121.268 -0.895 . . . . 1.38 109.618 -179.45 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 352' ' ' ASP . . . . . . . . . . . . . 14.4 m-20 -55.91 -54.88 39.32 Favored 'General case' 0 N--CA 1.489 1.478 0 O-C-N 121.208 -0.932 . . . . 1.16 109.56 179.902 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 353' ' ' ALA . . . . . . . . . . . . . . . -68.44 -11.61 59.98 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.215 -0.928 . . . . 0.61 109.802 -179.78 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 354' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.492 1.64 0 O-C-N 121.167 -0.958 . . . . 1.45 109.727 -179.779 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' C' C ' 326' ' ' GLU . . . . . 0.484 ' OE1' ' HB2' ' A' ' 335' ' ' ARG . 2.3 mt-10 . . . . . 0 N--CA 1.488 1.463 0 CA-C-O 121.35 0.595 . . . . 2.17 109.415 . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' C' C ' 327' ' ' TYR . . . . . 0.532 ' CE1' ' HG2' ' A' ' 333' ' ' ARG . 42.6 m-85 -148.98 103.41 3.35 Favored 'General case' 0 N--CA 1.489 1.493 0 O-C-N 121.269 -0.894 . . . . 0.48 109.175 179.941 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' C' C ' 328' ' ' PHE . . . . . . . . . . . . . 52.9 m-85 -107.13 -167.41 1.27 Allowed 'General case' 0 N--CA 1.488 1.469 0 O-C-N 121.292 -0.88 . . . . 0.33 109.378 -179.944 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' C' C ' 329' ' ' THR . . . . . 0.421 ' HA ' ' O ' ' A' ' 330' ' ' LEU . 4.5 p -152.07 167.85 27.16 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.26 -0.9 . . . . 0.23 109.043 179.907 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' C' C ' 330' ' ' LEU . . . . . 0.449 ' O ' ' HA ' ' A' ' 329' ' ' THR . 27.0 tp -151.15 129.5 12.04 Favored 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.127 -0.983 . . . . 0.28 109.946 -179.525 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' C' C ' 331' ' ' GLN . . . . . 0.493 ' NE2' ' HB3' ' A' ' 327' ' ' TYR . 0.8 OUTLIER -89.41 114.91 26.43 Favored 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.3 -0.875 . . . . 1.48 109.438 179.724 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' C' C ' 332' ' ' ILE . . . . . 0.478 HD12 ' CD1' ' C' ' 338' ' ' PHE . 60.2 mt -103.76 113.29 40.23 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.622 0 O-C-N 121.11 -0.994 . . . . 0.24 109.648 179.964 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' C' C ' 333' ' ' ARG . . . . . 0.589 ' HG2' ' CE1' ' A' ' 327' ' ' TYR . 34.7 mtt180 -73.44 139.91 46.15 Favored 'General case' 0 N--CA 1.489 1.478 0 O-C-N 121.171 -0.956 . . . . 2.74 109.443 179.772 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' C' C ' 334' ' ' GLY . . . . . . . . . . . . . . . 81.43 125.64 0.75 Allowed Glycine 0 N--CA 1.491 2.325 0 N-CA-C 109.597 -1.401 . . . . 0.35 109.597 179.946 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' C' C ' 335' ' ' ARG . . . . . 0.552 ' HD3' ' CZ ' ' A' ' 328' ' ' PHE . 0.0 OUTLIER -76.57 -25.57 54.16 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.194 -1.18 . . . . 2.53 109.696 -179.986 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' C' C ' 336' ' ' GLU . . . . . . . . . . . . . 1.9 tt0 -55.85 -69.49 0.14 Allowed 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.135 -0.978 . . . . 2.62 109.72 -179.716 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' C' C ' 337' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -60.72 -23.83 65.21 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.164 -0.96 . . . . 2.81 109.566 -179.862 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' C' C ' 338' ' ' PHE . . . . . 0.478 ' CD1' HD12 ' C' ' 332' ' ' ILE . 61.2 t80 -54.67 -59.4 4.76 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.215 -0.928 . . . . 0.4 109.491 -179.971 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' C' C ' 339' ' ' GLU . . . . . . . . . . . . . 2.1 mt-10 -52.1 -33.37 39.22 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.231 -0.918 . . . . 2.05 109.945 -179.794 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' C' C ' 340' ' ' MET . . . . . . . . . . . . . 41.5 ttp -63.21 -50.73 69.12 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.067 -1.021 . . . . 0.32 109.896 -179.618 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' C' C ' 341' ' ' PHE . . . . . 0.514 ' CZ ' ' HA ' ' A' ' 345' ' ' ASN . 46.9 m-85 -62.16 -50.34 72.23 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.142 -0.974 . . . . 0.18 109.785 -179.796 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' C' C ' 342' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -48.19 -42.2 29.2 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.224 -0.923 . . . . 2.91 110.068 -179.61 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' C' C ' 343' ' ' GLU . . . . . . . . . . . . . 10.2 tp10 -57.9 -48.1 80.85 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.251 -0.905 . . . . 2.14 109.618 -179.673 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' C' C ' 344' ' ' LEU . . . . . . . . . . . . . 79.6 mt -62.33 -26.51 68.47 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.292 -0.88 . . . . 0.22 109.603 -179.95 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' C' C ' 345' ' ' ASN . . . . . 0.414 HD22 HD11 ' A' ' 330' ' ' LEU . 56.9 t-20 -58.5 -57.63 12.11 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.288 -0.883 . . . . 1.08 110.019 -179.786 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' C' C ' 346' ' ' GLU . . . . . 0.469 ' O ' ' HG2' ' C' ' 346' ' ' GLU . 25.4 tt0 -60.96 -27.81 68.53 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.185 -0.947 . . . . 2.21 110.043 -179.415 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' C' C ' 347' ' ' ALA . . . . . 0.896 ' HB1' ' HB1' ' D' ' 347' ' ' ALA . . . -61.93 -58.4 8.07 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.037 -1.039 . . . . 0.18 110.276 -179.498 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' C' C ' 348' ' ' LEU . . . . . 0.535 HD22 ' N ' ' C' ' 348' ' ' LEU . 3.7 mm? -62.09 -48.94 77.96 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.206 -0.934 . . . . 0.32 110.538 -179.065 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' C' C ' 349' ' ' GLU . . . . . . . . . . . . . 16.5 mm-40 -57.49 -34.99 69.64 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.091 -1.005 . . . . 2.19 110.267 -179.135 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' C' C ' 350' ' ' LEU . . . . . 0.64 HD22 HD22 ' D' ' 350' ' ' LEU . 8.5 tt -64.48 -40.46 95.73 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.056 -1.028 . . . . 0.46 109.563 -179.794 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' C' C ' 351' ' ' LYS . . . . . 0.408 ' NZ ' ' HG3' ' D' ' 343' ' ' GLU . 7.0 ttmt -59.33 -48.97 79.62 Favored 'General case' 0 N--CA 1.489 1.477 0 O-C-N 121.293 -0.879 . . . . 1.35 109.612 -179.837 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' C' C ' 352' ' ' ASP . . . . . . . . . . . . . 62.1 m-20 -56.94 -54.57 45.15 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.338 -0.851 . . . . 1.19 110.232 -179.732 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' C' C ' 353' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 1.56 0 O-C-N 121.141 -0.975 . . . . 0.57 110.063 -179.327 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' D' D ' 326' ' ' GLU . . . . . . . . . . . . . 1.8 mm-40 . . . . . 0 N--CA 1.49 1.533 0 N-CA-C 109.243 -0.651 . . . . 2.13 109.243 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' D' D ' 327' ' ' TYR . . . . . 0.489 ' CE1' ' HG2' ' B' ' 333' ' ' ARG . 46.7 m-85 -149.36 105.38 3.47 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.066 -1.021 . . . . 0.47 109.924 -179.834 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' D' D ' 328' ' ' PHE . . . . . 0.423 ' C ' HG23 ' D' ' 329' ' ' THR . 97.1 m-85 -112.29 -163.57 0.86 Allowed 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.307 -0.871 . . . . 0.3 109.451 179.838 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' D' D ' 329' ' ' THR . . . . . 0.423 HG23 ' C ' ' D' ' 328' ' ' PHE . 72.5 p -154.71 166.38 33.62 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.309 -0.869 . . . . 0.22 108.924 179.817 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' D' D ' 330' ' ' LEU . . . . . . . . . . . . . 32.5 tp -151.07 132.09 14.29 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.056 -1.028 . . . . 0.28 109.823 -179.782 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' D' D ' 331' ' ' GLN . . . . . . . . . . . . . 19.4 tp60 -86.96 114.98 24.04 Favored 'General case' 0 N--CA 1.489 1.488 0 O-C-N 121.37 -0.832 . . . . 0.93 109.021 179.672 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' D' D ' 332' ' ' ILE . . . . . 0.565 HG21 ' HA ' ' D' ' 338' ' ' PHE . 52.5 mt -103.43 106.87 20.96 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.542 0 O-C-N 121.209 -0.932 . . . . 0.25 109.662 -179.8 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' D' D ' 333' ' ' ARG . . . . . 0.58 ' HG2' ' CE1' ' B' ' 327' ' ' TYR . 9.9 mtp180 -72.19 140.14 48.58 Favored 'General case' 0 N--CA 1.488 1.441 0 O-C-N 121.273 -0.892 . . . . 2.93 109.393 179.824 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' D' D ' 334' ' ' GLY . . . . . . . . . . . . . . . 88.96 127.23 2.93 Favored Glycine 0 N--CA 1.492 2.414 0 N-CA-C 109.689 -1.365 . . . . 0.41 109.689 179.93 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' D' D ' 335' ' ' ARG . . . . . 0.476 ' O ' ' HB3' ' D' ' 338' ' ' PHE . 7.9 ttt180 -78.2 -34.52 49.39 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.258 -1.142 . . . . 3.03 109.63 179.947 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' D' D ' 336' ' ' GLU . . . . . . . . . . . . . 9.2 tt0 -58.05 -62.19 2.0 Allowed 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.276 -0.89 . . . . 2.26 109.659 -179.819 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' D' D ' 337' ' ' ARG . . . . . 0.516 ' NH1' ' HG2' ' D' ' 337' ' ' ARG . 0.0 OUTLIER -60.99 -27.58 68.4 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.317 -0.864 . . . . 2.92 109.706 -179.774 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' D' D ' 338' ' ' PHE . . . . . 0.565 ' HA ' HG21 ' D' ' 332' ' ' ILE . 52.9 t80 -53.84 -64.66 0.76 Allowed 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.248 -0.907 . . . . 0.37 109.777 -179.792 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' D' D ' 339' ' ' GLU . . . . . . . . . . . . . 42.8 mt-10 -50.6 -29.17 10.24 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.25 -0.906 . . . . 1.99 109.687 -179.765 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' D' D ' 340' ' ' MET . . . . . 0.441 ' HB3' ' O ' ' D' ' 337' ' ' ARG . 7.0 ttp -64.39 -52.26 59.12 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.236 -0.915 . . . . 0.31 109.793 -179.763 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' D' D ' 341' ' ' PHE . . . . . 0.461 ' CZ ' ' HA ' ' B' ' 345' ' ' ASN . 39.8 m-85 -62.71 -44.53 95.98 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.303 -0.873 . . . . 0.18 109.991 -179.594 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' D' D ' 342' ' ' ARG . . . . . . . . . . . . . 1.9 ttp180 -49.86 -41.93 46.42 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.158 -0.964 . . . . 2.41 109.921 -179.656 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' D' D ' 343' ' ' GLU . . . . . 0.408 ' HG3' ' NZ ' ' C' ' 351' ' ' LYS . 38.1 tt0 -59.08 -47.19 86.16 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.133 -0.98 . . . . 2.35 109.885 -179.701 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' D' D ' 344' ' ' LEU . . . . . . . . . . . . . 79.3 mt -62.66 -32.55 73.63 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.191 -0.943 . . . . 0.19 109.909 -179.717 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' D' D ' 345' ' ' ASN . . . . . 0.546 ' HA ' ' CZ ' ' B' ' 341' ' ' PHE . 53.7 t-20 -57.11 -56.12 25.94 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.283 -0.886 . . . . 1.09 110.04 -179.613 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' D' D ' 346' ' ' GLU . . . . . . . . . . . . . 4.0 tp10 -61.45 -26.51 67.93 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.152 -0.968 . . . . 1.69 110.144 -179.498 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' D' D ' 347' ' ' ALA . . . . . 0.896 ' HB1' ' HB1' ' C' ' 347' ' ' ALA . . . -61.57 -58.34 8.5 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.169 -0.957 . . . . 0.18 110.172 -179.566 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' D' D ' 348' ' ' LEU . . . . . 0.583 HD22 ' N ' ' D' ' 348' ' ' LEU . 4.0 mm? -62.05 -50.63 71.22 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.212 -0.93 . . . . 0.31 110.294 -179.29 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' D' D ' 349' ' ' GLU . . . . . . . . . . . . . 66.9 mt-10 -57.19 -30.99 64.98 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.135 -0.978 . . . . 1.95 110.134 -179.226 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' D' D ' 350' ' ' LEU . . . . . 0.64 HD22 HD22 ' C' ' 350' ' ' LEU . 8.9 tt -65.08 -45.13 86.51 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.09 -1.006 . . . . 0.43 109.675 -179.884 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' D' D ' 351' ' ' LYS . . . . . . . . . . . . . 40.9 tttm -57.74 -43.3 85.29 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.302 -0.874 . . . . 1.4 109.593 -179.643 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' D' D ' 352' ' ' ASP . . . . . . . . . . . . . 14.3 m-20 -55.81 -54.92 38.59 Favored 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.253 -0.905 . . . . 1.17 109.561 179.926 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' D' D ' 353' ' ' ALA . . . . . . . . . . . . . . . -68.45 -11.43 59.73 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.247 -0.908 . . . . 0.59 109.779 -179.872 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' D' D ' 354' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.489 1.517 0 O-C-N 121.149 -0.969 . . . . 1.44 109.798 -179.826 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 326' ' ' GLU . . . . . . . . . . . . . 3.6 mt-10 . . . . . 0 N--CA 1.488 1.47 0 CA-C-O 121.364 0.602 . . . . 2.13 109.545 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 327' ' ' TYR . . . . . 0.449 ' CE1' ' HG2' ' C' ' 333' ' ' ARG . 47.2 m-85 -149.85 112.76 4.83 Favored 'General case' 0 N--CA 1.489 1.491 0 O-C-N 121.377 -0.827 . . . . 0.48 109.43 -179.9 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 328' ' ' PHE . . . . . 0.481 ' O ' ' OE1' ' C' ' 331' ' ' GLN . 77.4 m-85 -113.46 -170.18 1.64 Allowed 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.257 -0.902 . . . . 0.31 109.385 -179.934 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 329' ' ' THR . . . . . 0.424 ' HA ' ' O ' ' C' ' 330' ' ' LEU . 52.4 p -154.58 169.26 24.25 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.082 -1.012 . . . . 0.22 109.438 -179.775 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 330' ' ' LEU . . . . . 0.497 HD11 HD22 ' C' ' 345' ' ' ASN . 33.6 tp -152.12 129.09 11.01 Favored 'General case' 0 N--CA 1.488 1.474 0 O-C-N 121.081 -1.012 . . . . 0.28 110.144 -179.927 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 331' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -87.83 109.62 19.89 Favored 'General case' 0 N--CA 1.487 1.404 0 O-C-N 121.302 -0.874 . . . . 0.91 108.841 179.271 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 332' ' ' ILE . . . . . . . . . . . . . 18.3 mt -103.03 104.91 17.32 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.523 0 O-C-N 121.14 -0.975 . . . . 0.26 109.682 -179.586 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 333' ' ' ARG . . . . . 0.629 ' CG ' ' CE1' ' C' ' 327' ' ' TYR . 0.0 OUTLIER -72.01 152.92 42.1 Favored 'General case' 0 C--N 1.303 -1.455 0 O-C-N 121.564 -0.71 . . . . 2.92 109.25 179.714 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 334' ' ' GLY . . . . . . . . . . . . . . . 76.45 129.69 0.34 Allowed Glycine 0 N--CA 1.489 2.202 0 N-CA-C 109.545 -1.422 . . . . 0.4 109.545 179.997 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 335' ' ' ARG . . . . . . . . . . . . . 9.2 ttm180 -79.15 -26.0 42.82 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.317 -1.107 . . . . 3.01 109.785 -179.939 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 336' ' ' GLU . . . . . . . . . . . . . 16.3 mt-10 -57.42 -68.89 0.19 Allowed 'General case' 0 N--CA 1.495 1.786 0 O-C-N 121.225 -0.922 . . . . 2.29 109.83 -179.728 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 337' ' ' ARG . . . . . . . . . . . . . 6.1 mpt_? -59.41 -29.39 67.71 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.226 -0.921 . . . . 2.93 109.586 -179.738 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 338' ' ' PHE . . . . . . . . . . . . . 72.4 t80 -53.99 -59.6 4.43 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.431 -0.793 . . . . 0.38 109.645 -179.829 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 339' ' ' GLU . . . . . . . . . . . . . 58.9 mt-10 -50.54 -34.89 27.15 Favored 'General case' 0 N--CA 1.488 1.473 0 O-C-N 121.197 -0.939 . . . . 1.97 110.181 -179.456 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 340' ' ' MET . . . . . . . . . . . . . 52.9 ttp -64.2 -50.08 69.5 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.193 -0.942 . . . . 0.31 110.408 -179.288 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 341' ' ' PHE . . . . . . . . . . . . . 55.6 m-85 -62.08 -39.95 94.17 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.238 -0.914 . . . . 0.18 109.996 -179.344 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 342' ' ' ARG . . . . . . . . . . . . . 31.8 ttt180 -51.41 -47.59 62.91 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.182 -0.949 . . . . 2.42 110.175 -179.5 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 343' ' ' GLU . . . . . . . . . . . . . 9.4 tp10 -60.13 -43.02 96.0 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 120.992 -1.067 . . . . 2.35 110.201 -179.379 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 344' ' ' LEU . . . . . . . . . . . . . 52.7 mt -61.28 -37.04 81.72 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.085 -1.01 . . . . 0.18 110.03 -179.416 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 345' ' ' ASN . . . . . 0.552 HD22 HD11 ' C' ' 330' ' ' LEU . 46.4 t-20 -58.24 -53.27 60.16 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.166 -0.959 . . . . 1.09 109.8 -179.786 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 346' ' ' GLU . . . . . . . . . . . . . 1.2 tt0 -61.29 -30.95 70.79 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.208 -0.932 . . . . 1.65 109.768 -179.674 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 347' ' ' ALA . . . . . 0.949 ' HB1' ' HB1' ' B' ' 347' ' ' ALA . . . -61.59 -57.59 11.47 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.236 -0.915 . . . . 0.18 110.245 -179.501 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 348' ' ' LEU . . . . . 0.546 HD22 ' N ' ' A' ' 348' ' ' LEU . 3.8 mm? -61.56 -44.78 96.4 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.147 -0.97 . . . . 0.3 110.04 -179.324 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 349' ' ' GLU . . . . . . . . . . . . . 76.0 mt-10 -57.99 -35.21 70.9 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.228 -0.92 . . . . 1.94 109.95 -179.496 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 350' ' ' LEU . . . . . 0.735 HD22 HD13 ' B' ' 350' ' ' LEU . 6.8 tt -63.89 -48.39 76.82 Favored 'General case' 0 C--N 1.302 -1.474 0 O-C-N 121.098 -1.001 . . . . 0.46 109.593 -179.623 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 351' ' ' LYS . . . . . . . . . . . . . 43.4 tttm -59.11 -42.03 89.59 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.307 -0.87 . . . . 1.4 109.664 -179.794 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 352' ' ' ASP . . . . . 0.515 ' OD2' ' CZ ' ' C' ' 337' ' ' ARG . 1.0 OUTLIER -58.51 -38.96 78.81 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.084 -1.01 . . . . 1.16 109.742 -179.896 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 353' ' ' ALA . . . . . . . . . . . . . . . -67.19 -21.72 65.76 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.289 -0.882 . . . . 0.63 109.94 -179.483 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 354' ' ' GLN . . . . . . . . . . . . . 9.3 mt-30 . . . . . 0 N--CA 1.489 1.489 0 O-C-N 121.174 -0.953 . . . . 1.47 109.361 179.903 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' B' B ' 326' ' ' GLU . . . . . . . . . . . . . 3.8 mt-10 . . . . . 0 N--CA 1.491 1.581 0 CA-C-O 121.342 0.591 . . . . 2.13 109.619 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' B' B ' 327' ' ' TYR . . . . . 0.583 ' CE1' ' CG ' ' D' ' 333' ' ' ARG . 44.7 m-85 -149.55 112.11 4.75 Favored 'General case' 0 N--CA 1.488 1.443 0 O-C-N 121.105 -0.997 . . . . 0.48 109.651 -179.907 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 328' ' ' PHE . . . . . . . . . . . . . 80.4 m-85 -113.02 -170.88 1.76 Allowed 'General case' 0 C--N 1.303 -1.444 0 O-C-N 121.27 -0.894 . . . . 0.32 109.462 -179.67 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 329' ' ' THR . . . . . 0.413 ' HA ' ' O ' ' D' ' 330' ' ' LEU . 43.6 p -153.61 169.83 22.3 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.25 -0.906 . . . . 0.23 109.381 -179.689 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 330' ' ' LEU . . . . . 0.542 HD11 HD22 ' D' ' 345' ' ' ASN . 32.8 tp -152.7 128.83 10.43 Favored 'General case' 0 N--CA 1.489 1.479 0 O-C-N 121.021 -1.049 . . . . 0.28 110.198 -179.991 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 331' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -87.58 109.89 19.97 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.404 -0.81 . . . . 0.91 108.863 179.131 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 332' ' ' ILE . . . . . . . . . . . . . 20.4 mt -103.24 105.23 17.9 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.488 0 O-C-N 121.157 -0.964 . . . . 0.24 109.876 -179.63 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 333' ' ' ARG . . . . . 0.577 ' CG ' ' CE1' ' D' ' 327' ' ' TYR . 0.0 OUTLIER -72.46 151.86 42.29 Favored 'General case' 0 N--CA 1.489 1.486 0 O-C-N 121.324 -0.86 . . . . 2.93 109.241 179.735 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' B' B ' 334' ' ' GLY . . . . . . . . . . . . . . . 77.57 128.86 0.42 Allowed Glycine 0 N--CA 1.489 2.175 0 N-CA-C 109.837 -1.305 . . . . 0.4 109.837 179.935 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 335' ' ' ARG . . . . . . . . . . . . . 9.3 ttm180 -78.89 -27.05 43.91 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.473 -1.016 . . . . 3.01 109.739 -179.917 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 336' ' ' GLU . . . . . . . . . . . . . 18.1 mt-10 -57.48 -68.21 0.26 Allowed 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.205 -0.935 . . . . 2.28 109.805 -179.632 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 337' ' ' ARG . . . . . . . . . . . . . 5.7 mpt_? -60.13 -29.42 68.62 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.251 -0.906 . . . . 2.93 109.584 -179.844 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 338' ' ' PHE . . . . . . . . . . . . . 69.1 t80 -54.03 -58.25 8.02 Favored 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.317 -0.864 . . . . 0.37 109.608 -179.774 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 339' ' ' GLU . . . . . . . . . . . . . 58.0 mt-10 -51.44 -34.43 35.12 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.381 -0.824 . . . . 1.98 110.2 -179.594 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 340' ' ' MET . . . . . . . . . . . . . 52.0 ttp -65.05 -49.74 68.9 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.204 -0.935 . . . . 0.32 110.485 -179.258 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 341' ' ' PHE . . . . . . . . . . . . . 56.4 m-85 -62.1 -40.43 95.85 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.144 -0.972 . . . . 0.18 109.942 -179.343 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 342' ' ' ARG . . . . . . . . . . . . . 23.8 ttt180 -50.66 -47.51 58.62 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.217 -0.927 . . . . 2.42 110.18 -179.596 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 343' ' ' GLU . . . . . . . . . . . . . 11.8 tp10 -59.96 -42.42 94.07 Favored 'General case' 0 N--CA 1.494 1.759 0 O-C-N 121.218 -0.927 . . . . 2.35 110.142 -179.304 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 344' ' ' LEU . . . . . . . . . . . . . 45.2 mt -62.21 -37.1 84.06 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.106 -0.996 . . . . 0.18 110.039 -179.5 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 345' ' ' ASN . . . . . 0.54 HD22 HD11 ' D' ' 330' ' ' LEU . 50.8 t-20 -58.17 -53.58 56.61 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.155 -0.965 . . . . 1.09 110.008 -179.618 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 346' ' ' GLU . . . . . . . . . . . . . 1.2 tt0 -61.27 -31.2 71.02 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.249 -0.907 . . . . 1.66 109.789 -179.611 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 347' ' ' ALA . . . . . 0.949 ' HB1' ' HB1' ' A' ' 347' ' ' ALA . . . -61.14 -57.67 11.54 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.216 -0.928 . . . . 0.17 110.308 -179.525 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 348' ' ' LEU . . . . . 0.53 HD22 ' N ' ' B' ' 348' ' ' LEU . 3.8 mm? -60.96 -45.16 95.84 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.257 -0.902 . . . . 0.29 110.127 -179.412 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 349' ' ' GLU . . . . . . . . . . . . . 77.9 mt-10 -57.99 -35.36 71.1 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.11 -0.994 . . . . 1.95 110.056 -179.482 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 350' ' ' LEU . . . . . 0.735 HD13 HD22 ' A' ' 350' ' ' LEU . 6.9 tt -63.28 -48.29 78.74 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.145 -0.972 . . . . 0.45 109.451 -179.828 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 351' ' ' LYS . . . . . . . . . . . . . 45.9 tttm -59.24 -42.34 90.87 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.275 -0.89 . . . . 1.38 109.835 -179.734 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 352' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -58.63 -37.88 76.87 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.167 -0.958 . . . . 1.16 109.668 -179.982 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 353' ' ' ALA . . . . . . . . . . . . . . . -67.84 -22.17 65.15 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.362 -0.836 . . . . 0.61 109.728 -179.386 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 354' ' ' GLN . . . . . . . . . . . . . 8.5 mt-30 . . . . . 0 N--CA 1.49 1.571 0 O-C-N 121.148 -0.97 . . . . 1.45 109.471 -179.844 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' C' C ' 326' ' ' GLU . . . . . . . . . . . . . 16.7 mt-10 . . . . . 0 N--CA 1.489 1.475 0 N-CA-C 108.884 -0.784 . . . . 2.17 108.884 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' C' C ' 327' ' ' TYR . . . . . 0.629 ' CE1' ' CG ' ' A' ' 333' ' ' ARG . 43.8 m-85 -149.72 113.63 5.1 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.025 -1.047 . . . . 0.48 109.827 -179.824 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' C' C ' 328' ' ' PHE . . . . . . . . . . . . . 97.6 m-85 -113.03 -166.53 1.09 Allowed 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.162 -0.961 . . . . 0.33 109.726 179.718 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' C' C ' 329' ' ' THR . . . . . 0.405 ' HA ' ' O ' ' A' ' 330' ' ' LEU . 27.2 p -153.32 167.14 30.37 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.212 -0.93 . . . . 0.23 109.564 -179.721 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' C' C ' 330' ' ' LEU . . . . . 0.552 HD11 HD22 ' A' ' 345' ' ' ASN . 18.4 tp -150.26 124.93 9.72 Favored 'General case' 0 N--CA 1.488 1.43 0 O-C-N 121.194 -0.941 . . . . 0.28 109.707 -179.727 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' C' C ' 331' ' ' GLN . . . . . 0.481 ' OE1' ' O ' ' A' ' 328' ' ' PHE . 7.2 tp-100 -89.23 109.01 19.94 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.245 -0.91 . . . . 1.48 109.14 179.794 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' C' C ' 332' ' ' ILE . . . . . 0.433 HD13 ' CD2' ' C' ' 341' ' ' PHE . 93.9 mt -102.78 113.75 40.35 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.647 0 O-C-N 121.081 -1.012 . . . . 0.24 109.737 -179.722 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' C' C ' 333' ' ' ARG . . . . . 0.449 ' HG2' ' CE1' ' A' ' 327' ' ' TYR . 0.6 OUTLIER -73.53 148.75 42.77 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.295 -0.878 . . . . 2.74 109.6 179.81 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' C' C ' 334' ' ' GLY . . . . . . . . . . . . . . . 70.89 134.57 0.11 Allowed Glycine 0 N--CA 1.492 2.385 0 N-CA-C 109.677 -1.369 . . . . 0.35 109.677 179.958 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' C' C ' 335' ' ' ARG . . . . . 0.55 ' HG2' ' NH1' ' C' ' 335' ' ' ARG . 0.0 OUTLIER -75.34 -26.33 58.51 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.329 -1.1 . . . . 2.53 109.622 -179.985 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' C' C ' 336' ' ' GLU . . . . . . . . . . . . . 9.2 tt0 -54.2 -65.06 0.64 Allowed 'General case' 0 C--N 1.301 -1.535 0 O-C-N 121.192 -0.943 . . . . 2.62 109.561 -179.509 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' C' C ' 337' ' ' ARG . . . . . 0.515 ' CZ ' ' OD2' ' A' ' 352' ' ' ASP . 2.0 mpt_? -59.58 -28.45 67.16 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.259 -0.9 . . . . 2.81 109.206 179.874 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' C' C ' 338' ' ' PHE . . . . . 0.474 ' HB3' ' O ' ' C' ' 335' ' ' ARG . 84.5 t80 -56.53 -64.54 0.83 Allowed 'General case' 0 N--CA 1.489 1.5 0 O-C-N 121.451 -0.781 . . . . 0.4 110.026 -179.813 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' C' C ' 339' ' ' GLU . . . . . 0.458 ' OE2' ' HG2' ' C' ' 335' ' ' ARG . 10.6 mt-10 -48.66 -37.0 17.24 Favored 'General case' 0 N--CA 1.495 1.802 0 O-C-N 121.132 -0.98 . . . . 2.05 110.398 -179.45 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' C' C ' 340' ' ' MET . . . . . . . . . . . . . 30.9 ttp -61.46 -49.63 76.04 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.054 -1.029 . . . . 0.32 109.727 -179.542 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' C' C ' 341' ' ' PHE . . . . . 0.433 ' CD2' HD13 ' C' ' 332' ' ' ILE . 44.2 m-85 -64.16 -41.1 97.29 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.207 -0.933 . . . . 0.18 110.161 -179.79 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' C' C ' 342' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -52.47 -48.02 66.15 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.258 -0.901 . . . . 2.91 110.032 -179.63 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' C' C ' 343' ' ' GLU . . . . . . . . . . . . . 14.4 tt0 -57.76 -45.93 85.23 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.345 -0.847 . . . . 2.14 110.063 -179.593 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' C' C ' 344' ' ' LEU . . . . . 0.432 ' O ' HD23 ' C' ' 348' ' ' LEU . 94.6 mt -63.06 -33.69 75.98 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.09 -1.006 . . . . 0.22 109.693 -179.729 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' C' C ' 345' ' ' ASN . . . . . 0.497 HD22 HD11 ' A' ' 330' ' ' LEU . 50.5 t-20 -59.48 -56.82 17.11 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.126 -0.984 . . . . 1.08 109.498 -179.995 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' C' C ' 346' ' ' GLU . . . . . . . . . . . . . 5.9 tp10 -61.97 -26.71 68.37 Favored 'General case' 0 C--N 1.302 -1.475 0 O-C-N 121.202 -0.936 . . . . 2.21 109.515 179.942 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' C' C ' 347' ' ' ALA . . . . . 0.96 ' HB1' ' HB1' ' D' ' 347' ' ' ALA . . . -64.07 -61.27 2.37 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.214 -0.929 . . . . 0.18 110.041 -179.799 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' C' C ' 348' ' ' LEU . . . . . 0.585 HD22 ' N ' ' C' ' 348' ' ' LEU . 3.9 mm? -60.5 -50.53 73.18 Favored 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.319 -0.863 . . . . 0.32 110.241 -179.051 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' C' C ' 349' ' ' GLU . . . . . . . . . . . . . 16.0 mm-40 -58.87 -34.52 71.71 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.233 -0.917 . . . . 2.19 109.998 -179.406 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' C' C ' 350' ' ' LEU . . . . . 0.74 HD21 HD22 ' D' ' 350' ' ' LEU . 3.5 tt -64.66 -37.97 89.39 Favored 'General case' 0 C--N 1.302 -1.493 0 O-C-N 121.049 -1.032 . . . . 0.46 109.378 -179.942 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' C' C ' 351' ' ' LYS . . . . . 0.446 ' HE2' ' OE2' ' D' ' 343' ' ' GLU . 11.3 tttp -58.55 -40.2 82.37 Favored 'General case' 0 N--CA 1.488 1.455 0 O-C-N 121.254 -0.904 . . . . 1.35 108.884 179.752 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' C' C ' 352' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 -56.63 -43.75 80.57 Favored 'General case' 0 C--N 1.304 -1.403 0 O-C-N 121.432 -0.792 . . . . 1.19 109.423 179.612 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' C' C ' 353' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 1.652 0 O-C-N 121.379 -0.825 . . . . 0.57 110.047 -179.764 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' D' D ' 326' ' ' GLU . . . . . . . . . . . . . 3.4 mt-10 . . . . . 0 N--CA 1.489 1.513 0 CA-C-O 121.356 0.598 . . . . 2.13 109.765 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' D' D ' 327' ' ' TYR . . . . . 0.577 ' CE1' ' CG ' ' B' ' 333' ' ' ARG . 44.6 m-85 -149.03 112.26 4.94 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.446 -0.784 . . . . 0.47 109.476 -179.937 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' D' D ' 328' ' ' PHE . . . . . . . . . . . . . 83.0 m-85 -113.49 -170.85 1.77 Allowed 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.317 -0.864 . . . . 0.3 109.426 -179.841 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' D' D ' 329' ' ' THR . . . . . . . . . . . . . 38.6 p -153.4 169.37 23.3 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.241 -0.912 . . . . 0.22 109.598 -179.864 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' D' D ' 330' ' ' LEU . . . . . 0.54 HD11 HD22 ' B' ' 345' ' ' ASN . 33.5 tp -152.56 128.89 10.56 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.228 -0.92 . . . . 0.28 110.267 179.968 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' D' D ' 331' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -88.27 109.21 19.77 Favored 'General case' 0 N--CA 1.491 1.602 0 N-CA-C 108.806 -0.813 . . . . 0.93 108.806 179.125 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' D' D ' 332' ' ' ILE . . . . . . . . . . . . . 20.2 mt -102.18 104.98 17.24 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.495 0 O-C-N 121.146 -0.971 . . . . 0.25 109.817 -179.646 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' D' D ' 333' ' ' ARG . . . . . 0.583 ' CG ' ' CE1' ' B' ' 327' ' ' TYR . 0.0 OUTLIER -72.23 151.87 42.58 Favored 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.323 -0.861 . . . . 2.93 109.141 179.553 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' D' D ' 334' ' ' GLY . . . . . . . . . . . . . . . 78.23 128.57 0.48 Allowed Glycine 0 N--CA 1.49 2.258 0 N-CA-C 109.689 -1.365 . . . . 0.41 109.689 179.963 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' D' D ' 335' ' ' ARG . . . . . . . . . . . . . 8.8 ttm180 -78.99 -28.25 43.45 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.414 -1.05 . . . . 3.03 109.858 -179.903 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' D' D ' 336' ' ' GLU . . . . . . . . . . . . . 12.8 mt-10 -57.08 -68.05 0.26 Allowed 'General case' 0 N--CA 1.495 1.786 0 O-C-N 121.301 -0.874 . . . . 2.26 109.772 -179.551 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' D' D ' 337' ' ' ARG . . . . . . . . . . . . . 5.8 mpt_? -59.87 -29.98 68.69 Favored 'General case' 0 N--CA 1.488 1.446 0 O-C-N 121.271 -0.893 . . . . 2.92 109.665 -179.81 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' D' D ' 338' ' ' PHE . . . . . . . . . . . . . 70.5 t80 -54.09 -58.59 6.76 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.256 -0.902 . . . . 0.37 109.566 -179.88 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' D' D ' 339' ' ' GLU . . . . . . . . . . . . . 55.3 mt-10 -51.05 -34.81 31.39 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.333 -0.854 . . . . 1.99 110.059 -179.721 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' D' D ' 340' ' ' MET . . . . . . . . . . . . . 51.9 ttp -64.64 -49.42 71.11 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.156 -0.965 . . . . 0.31 110.26 -179.116 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' D' D ' 341' ' ' PHE . . . . . 0.426 ' HA ' HD12 ' D' ' 344' ' ' LEU . 55.8 m-85 -62.25 -42.82 99.66 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.073 -1.017 . . . . 0.18 110.125 -179.403 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' D' D ' 342' ' ' ARG . . . . . . . . . . . . . 23.2 ttt180 -48.8 -47.03 42.43 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.183 -0.948 . . . . 2.41 110.166 -179.705 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' D' D ' 343' ' ' GLU . . . . . 0.446 ' OE2' ' HE2' ' C' ' 351' ' ' LYS . 13.9 tp10 -60.05 -42.8 95.26 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.04 -1.038 . . . . 2.35 110.012 -179.447 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' D' D ' 344' ' ' LEU . . . . . 0.426 HD12 ' HA ' ' D' ' 341' ' ' PHE . 38.0 mt -61.68 -37.38 83.9 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.128 -0.982 . . . . 0.19 109.956 -179.476 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' D' D ' 345' ' ' ASN . . . . . 0.542 HD22 HD11 ' B' ' 330' ' ' LEU . 51.5 t-20 -58.17 -52.6 64.89 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.071 -1.018 . . . . 1.09 109.935 -179.539 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' D' D ' 346' ' ' GLU . . . . . . . . . . . . . 1.3 tt0 -61.44 -32.11 72.07 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.21 -0.931 . . . . 1.69 109.862 -179.65 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' D' D ' 347' ' ' ALA . . . . . 0.96 ' HB1' ' HB1' ' C' ' 347' ' ' ALA . . . -60.87 -57.73 11.43 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.219 -0.926 . . . . 0.18 110.249 -179.7 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' D' D ' 348' ' ' LEU . . . . . 0.544 HD22 ' N ' ' D' ' 348' ' ' LEU . 3.7 mm? -60.99 -44.24 97.69 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.077 -1.014 . . . . 0.31 110.038 -179.301 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' D' D ' 349' ' ' GLU . . . . . . . . . . . . . 71.8 mt-10 -58.51 -35.01 71.59 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.043 -1.036 . . . . 1.95 110.075 -179.32 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' D' D ' 350' ' ' LEU . . . . . 0.74 HD22 HD21 ' C' ' 350' ' ' LEU . 6.6 tt -63.75 -48.01 78.71 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.011 -1.056 . . . . 0.43 109.594 -179.796 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' D' D ' 351' ' ' LYS . . . . . . . . . . . . . 48.4 tttm -58.55 -42.91 88.94 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.32 -0.862 . . . . 1.4 109.715 -179.835 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' D' D ' 352' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -58.58 -37.03 74.91 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.093 -1.004 . . . . 1.17 109.698 -179.977 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' D' D ' 353' ' ' ALA . . . . . . . . . . . . . . . -68.1 -22.65 64.89 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.204 -0.935 . . . . 0.59 110.003 -179.5 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' D' D ' 354' ' ' GLN . . . . . . . . . . . . . 9.5 mt-30 . . . . . 0 N--CA 1.49 1.562 0 O-C-N 121.107 -0.996 . . . . 1.44 109.677 -179.707 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 326' ' ' GLU . . . . . . . . . . . . . 2.1 mm-40 . . . . . 0 N--CA 1.489 1.511 0 N-CA-C 109.14 -0.689 . . . . 2.13 109.14 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 327' ' ' TYR . . . . . 0.607 ' CE1' ' HG3' ' C' ' 333' ' ' ARG . 51.0 m-85 -148.5 108.9 4.14 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.408 -0.808 . . . . 0.48 109.411 -179.829 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 328' ' ' PHE . . . . . 0.443 ' O ' HG23 ' A' ' 329' ' ' THR . 83.4 m-85 -113.42 -165.97 1.05 Allowed 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.414 -0.804 . . . . 0.31 109.592 179.98 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 329' ' ' THR . . . . . 0.443 HG23 ' O ' ' A' ' 328' ' ' PHE . 22.2 p -154.75 167.68 29.38 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.295 -0.878 . . . . 0.22 109.432 -179.839 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 330' ' ' LEU . . . . . . . . . . . . . 25.0 tp -150.49 127.05 10.83 Favored 'General case' 0 C--N 1.302 -1.5 0 O-C-N 121.248 -0.907 . . . . 0.28 109.917 -179.787 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 331' ' ' GLN . . . . . . . . . . . . . 1.2 tp60 -86.32 108.4 18.41 Favored 'General case' 0 C--N 1.303 -1.451 0 O-C-N 121.257 -0.902 . . . . 0.91 108.854 179.144 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 332' ' ' ILE . . . . . 0.423 HG21 ' CD2' ' A' ' 341' ' ' PHE . 21.1 mt -102.83 112.94 38.04 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.516 0 O-C-N 121.311 -0.868 . . . . 0.26 109.509 -179.802 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 333' ' ' ARG . . . . . 0.406 ' HG2' ' CE2' ' C' ' 327' ' ' TYR . 54.9 mtm180 -72.84 154.91 40.41 Favored 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.491 -0.756 . . . . 2.92 109.535 179.845 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 334' ' ' GLY . . . . . . . . . . . . . . . 75.98 129.28 0.29 Allowed Glycine 0 N--CA 1.49 2.254 0 N-CA-C 109.728 -1.349 . . . . 0.4 109.728 179.868 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 335' ' ' ARG . . . . . 0.568 ' HB2' ' CZ ' ' C' ' 328' ' ' PHE . 31.3 ttp180 -78.91 -32.45 45.69 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.107 -1.231 . . . . 3.01 109.305 179.705 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 336' ' ' GLU . . . . . . . . . . . . . 1.9 tt0 -57.48 -62.99 1.39 Allowed 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.34 -0.85 . . . . 2.29 109.634 -179.799 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 337' ' ' ARG . . . . . 0.461 ' NH1' ' CG ' ' A' ' 337' ' ' ARG . 0.0 OUTLIER -59.2 -29.05 67.2 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.257 -0.902 . . . . 2.93 109.446 -179.651 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 338' ' ' PHE . . . . . 0.444 ' HB3' ' O ' ' A' ' 335' ' ' ARG . 75.5 t80 -54.76 -57.19 12.51 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.37 -0.831 . . . . 0.38 109.833 -179.872 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 339' ' ' GLU . . . . . . . . . . . . . 3.2 mt-10 -52.27 -33.47 42.08 Favored 'General case' 0 N--CA 1.493 1.692 0 O-C-N 121.205 -0.934 . . . . 1.97 109.678 -179.757 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 340' ' ' MET . . . . . . . . . . . . . 31.0 ttp -63.27 -50.2 71.08 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.482 -0.761 . . . . 0.31 109.947 -179.753 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 341' ' ' PHE . . . . . 0.423 ' CD2' HG21 ' A' ' 332' ' ' ILE . 52.4 m-85 -62.46 -44.24 96.88 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.147 -0.97 . . . . 0.18 109.792 -179.733 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 342' ' ' ARG . . . . . 0.446 ' CG ' HH11 ' A' ' 342' ' ' ARG . 0.1 OUTLIER -51.82 -43.16 63.01 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.319 -0.863 . . . . 2.42 109.866 -179.885 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 343' ' ' GLU . . . . . . . . . . . . . 1.8 tt0 -59.14 -48.37 81.86 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.254 -0.904 . . . . 2.35 110.281 -179.597 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 344' ' ' LEU . . . . . 0.403 HD23 ' HA ' ' A' ' 344' ' ' LEU . 74.4 mt -62.07 -32.85 73.43 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.121 -0.987 . . . . 0.18 109.244 -179.75 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 345' ' ' ASN . . . . . 0.615 HD22 HD11 ' C' ' 330' ' ' LEU . 46.4 t-20 -59.68 -52.35 65.87 Favored 'General case' 0 C--N 1.301 -1.523 0 O-C-N 121.364 -0.835 . . . . 1.09 109.823 -179.908 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 346' ' ' GLU . . . . . . . . . . . . . 41.9 tt0 -62.44 -27.04 68.83 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.138 -0.976 . . . . 1.65 109.568 -179.736 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 347' ' ' ALA . . . . . 0.852 ' HB1' ' HB1' ' B' ' 347' ' ' ALA . . . -62.44 -59.7 4.6 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.441 -0.787 . . . . 0.18 109.941 -179.808 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 348' ' ' LEU . . . . . 0.589 HD22 ' N ' ' A' ' 348' ' ' LEU . 3.5 mm? -61.13 -44.03 97.96 Favored 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.144 -0.973 . . . . 0.3 109.849 -179.753 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 349' ' ' GLU . . . . . . . . . . . . . 3.5 mm-40 -56.75 -36.32 69.64 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.056 -1.028 . . . . 1.94 109.683 -179.753 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 350' ' ' LEU . . . . . 0.579 HD13 HD22 ' B' ' 350' ' ' LEU . 5.9 tt -62.9 -45.05 94.33 Favored 'General case' 0 N--CA 1.489 1.488 0 O-C-N 120.942 -1.099 . . . . 0.46 109.354 -179.904 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 351' ' ' LYS . . . . . . . . . . . . . 30.0 tttt -57.88 -48.22 80.48 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.223 -0.923 . . . . 1.4 109.584 -179.843 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 352' ' ' ASP . . . . . . . . . . . . . 62.4 m-20 -59.88 -39.03 83.91 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.254 -0.904 . . . . 1.16 109.818 -179.809 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 353' ' ' ALA . . . . . . . . . . . . . . . -67.48 -18.16 64.96 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.296 -0.878 . . . . 0.63 110.038 -179.372 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 354' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.49 1.565 0 O-C-N 121.268 -0.895 . . . . 1.47 109.531 -179.985 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 326' ' ' GLU . . . . . . . . . . . . . 2.2 mm-40 . . . . . 0 N--CA 1.49 1.553 0 CA-C-O 121.439 0.637 . . . . 2.13 109.659 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' B' B ' 327' ' ' TYR . . . . . . . . . . . . . 51.3 m-85 -148.84 109.27 4.17 Favored 'General case' 0 C--N 1.301 -1.531 0 O-C-N 120.998 -1.064 . . . . 0.48 109.388 -179.997 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 328' ' ' PHE . . . . . 0.439 ' CE2' ' HB2' ' D' ' 335' ' ' ARG . 79.3 m-85 -113.62 -167.89 1.27 Allowed 'General case' 0 N--CA 1.488 1.443 0 O-C-N 121.217 -0.927 . . . . 0.32 109.451 179.898 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 329' ' ' THR . . . . . 0.409 ' HA ' ' O ' ' D' ' 330' ' ' LEU . 27.4 p -152.57 167.25 29.48 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.505 -0.747 . . . . 0.23 109.41 179.808 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 330' ' ' LEU . . . . . 0.742 HD11 HD22 ' D' ' 345' ' ' ASN . 30.7 tp -149.26 126.22 11.25 Favored 'General case' 0 N--CA 1.488 1.434 0 O-C-N 121.202 -0.936 . . . . 0.28 109.817 -179.785 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 331' ' ' GLN . . . . . . . . . . . . . 1.4 tp60 -85.75 107.93 17.83 Favored 'General case' 0 C--N 1.304 -1.41 0 O-C-N 121.211 -0.931 . . . . 0.91 108.773 179.325 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 332' ' ' ILE . . . . . . . . . . . . . 24.7 mt -103.17 113.96 41.43 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.493 0 O-C-N 121.094 -1.004 . . . . 0.24 109.585 -179.417 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 333' ' ' ARG . . . . . . . . . . . . . 54.7 mtm180 -73.62 153.99 39.94 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.388 -0.82 . . . . 2.93 109.648 179.85 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 334' ' ' GLY . . . . . . . . . . . . . . . 77.5 129.47 0.44 Allowed Glycine 0 N--CA 1.488 2.109 0 N-CA-C 109.834 -1.306 . . . . 0.4 109.834 179.577 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 335' ' ' ARG . . . . . 0.413 ' O ' ' HB3' ' B' ' 338' ' ' PHE . 32.3 ttp180 -79.82 -32.78 40.67 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.431 -1.04 . . . . 3.01 109.303 -179.977 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 336' ' ' GLU . . . . . . . . . . . . . 2.4 tt0 -57.92 -62.2 1.98 Allowed 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.518 -0.739 . . . . 2.28 109.795 179.884 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 337' ' ' ARG . . . . . 0.468 ' NH1' ' CG ' ' B' ' 337' ' ' ARG . 0.0 OUTLIER -59.25 -29.0 67.23 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.372 -0.83 . . . . 2.93 109.588 179.953 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' B' B ' 338' ' ' PHE . . . . . 0.413 ' HB3' ' O ' ' B' ' 335' ' ' ARG . 73.5 t80 -55.36 -57.21 12.76 Favored 'General case' 0 N--CA 1.487 1.405 0 O-C-N 121.289 -0.882 . . . . 0.37 109.502 -179.941 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 339' ' ' GLU . . . . . . . . . . . . . 3.1 mt-10 -51.95 -33.7 38.8 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.259 -0.901 . . . . 1.98 109.777 -179.719 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 340' ' ' MET . . . . . . . . . . . . . 31.3 ttp -63.18 -50.79 68.95 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.298 -0.876 . . . . 0.32 110.23 -179.458 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 341' ' ' PHE . . . . . . . . . . . . . 51.8 m-85 -62.49 -43.35 99.02 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.02 -1.05 . . . . 0.18 109.551 -179.484 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 342' ' ' ARG . . . . . 0.45 ' CG ' HH11 ' B' ' 342' ' ' ARG . 0.0 OUTLIER -51.63 -43.82 62.72 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.452 -0.78 . . . . 2.42 109.813 -179.887 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' B' B ' 343' ' ' GLU . . . . . . . . . . . . . 2.1 tt0 -59.05 -47.39 85.39 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.43 -0.794 . . . . 2.35 110.154 -179.426 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 344' ' ' LEU . . . . . 0.418 ' HA ' HD23 ' B' ' 344' ' ' LEU . 76.3 mt -62.37 -33.38 74.63 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.094 -1.004 . . . . 0.18 109.51 -179.913 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 345' ' ' ASN . . . . . 0.758 HD22 HD11 ' D' ' 330' ' ' LEU . 45.2 t-20 -59.32 -52.89 63.68 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.253 -0.905 . . . . 1.09 109.87 -179.98 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 346' ' ' GLU . . . . . . . . . . . . . 45.3 tt0 -61.53 -28.3 69.22 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.101 -1.0 . . . . 1.66 109.642 -179.769 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 347' ' ' ALA . . . . . 0.852 ' HB1' ' HB1' ' A' ' 347' ' ' ALA . . . -61.89 -58.59 7.34 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.354 -0.841 . . . . 0.17 109.973 -179.829 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 348' ' ' LEU . . . . . 0.56 HD22 ' N ' ' B' ' 348' ' ' LEU . 3.5 mm? -62.38 -43.41 98.89 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.092 -1.005 . . . . 0.29 109.715 -179.65 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 349' ' ' GLU . . . . . . . . . . . . . 3.7 mm-40 -56.78 -35.4 68.63 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.182 -0.949 . . . . 1.95 110.125 -179.424 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 350' ' ' LEU . . . . . 0.579 HD22 HD13 ' A' ' 350' ' ' LEU . 6.2 tt -64.04 -46.15 85.68 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.056 -1.028 . . . . 0.45 109.704 -179.769 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 351' ' ' LYS . . . . . . . . . . . . . 33.6 tttt -56.77 -49.7 74.52 Favored 'General case' 0 N--CA 1.488 1.45 0 O-C-N 121.429 -0.794 . . . . 1.38 109.388 -179.894 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 352' ' ' ASP . . . . . . . . . . . . . 60.6 m-20 -58.45 -39.67 80.52 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.278 -0.889 . . . . 1.16 109.888 -179.895 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 353' ' ' ALA . . . . . . . . . . . . . . . -66.48 -20.48 66.05 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.341 -0.849 . . . . 0.61 109.814 -179.545 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 354' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.49 1.527 0 O-C-N 120.893 -1.129 . . . . 1.45 109.424 -179.925 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' C' C ' 326' ' ' GLU . . . . . . . . . . . . . 3.0 mm-40 . . . . . 0 N--CA 1.488 1.467 0 N-CA-C 109.099 -0.704 . . . . 2.17 109.099 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' C' C ' 327' ' ' TYR . . . . . 0.406 ' CE2' ' HG2' ' A' ' 333' ' ' ARG . 47.4 m-85 -147.27 113.43 5.86 Favored 'General case' 0 C--N 1.3 -1.556 0 O-C-N 121.465 -0.772 . . . . 0.48 109.003 179.822 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' C' C ' 328' ' ' PHE . . . . . 0.568 ' CZ ' ' HB2' ' A' ' 335' ' ' ARG . 86.3 m-85 -111.61 -167.95 1.25 Allowed 'General case' 0 C--N 1.303 -1.435 0 O-C-N 121.068 -1.02 . . . . 0.33 109.578 -179.618 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' C' C ' 329' ' ' THR . . . . . . . . . . . . . 76.4 p -150.37 163.79 37.47 Favored 'General case' 0 N--CA 1.487 1.407 0 O-C-N 121.248 -0.908 . . . . 0.23 109.387 -179.831 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' C' C ' 330' ' ' LEU . . . . . 0.615 HD11 HD22 ' A' ' 345' ' ' ASN . 29.6 tp -150.07 130.04 13.44 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.434 -0.791 . . . . 0.28 109.609 -179.623 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' C' C ' 331' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -85.37 115.14 22.94 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.258 -0.901 . . . . 1.48 109.234 179.847 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' C' C ' 332' ' ' ILE . . . . . 0.911 HG21 ' HA ' ' C' ' 338' ' ' PHE . 50.8 mt -103.88 99.88 9.31 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.482 0 O-C-N 121.165 -0.959 . . . . 0.24 109.916 -179.768 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' C' C ' 333' ' ' ARG . . . . . 0.607 ' HG3' ' CE1' ' A' ' 327' ' ' TYR . 0.0 OUTLIER -71.48 144.69 49.59 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.132 -0.98 . . . . 2.74 109.527 179.892 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' C' C ' 334' ' ' GLY . . . . . . . . . . . . . . . 86.99 126.75 2.18 Favored Glycine 0 N--CA 1.492 2.394 0 N-CA-C 109.379 -1.488 . . . . 0.35 109.379 -179.991 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' C' C ' 335' ' ' ARG . . . . . 0.417 ' CG ' HH11 ' C' ' 335' ' ' ARG . 0.0 OUTLIER -77.86 -32.34 51.98 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.332 -1.099 . . . . 2.53 109.848 -179.865 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' C' C ' 336' ' ' GLU . . . . . . . . . . . . . 1.6 mt-10 -59.84 -62.58 1.77 Allowed 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.02 -1.05 . . . . 2.62 110.062 -179.672 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' C' C ' 337' ' ' ARG . . . . . . . . . . . . . 10.5 mpt_? -62.08 -29.35 70.25 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.269 -0.895 . . . . 2.81 110.263 -179.621 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' C' C ' 338' ' ' PHE . . . . . 0.911 ' HA ' HG21 ' C' ' 332' ' ' ILE . 68.1 t80 -52.4 -60.21 3.49 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.137 -0.977 . . . . 0.4 109.621 -179.752 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' C' C ' 339' ' ' GLU . . . . . . . . . . . . . 3.6 mt-10 -51.89 -31.11 26.86 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.382 -0.824 . . . . 2.05 109.882 -179.836 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' C' C ' 340' ' ' MET . . . . . . . . . . . . . 38.5 ttp -63.28 -52.72 60.83 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.232 -0.917 . . . . 0.32 109.471 -179.847 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' C' C ' 341' ' ' PHE . . . . . . . . . . . . . 40.2 m-85 -60.69 -42.21 96.7 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.148 -0.97 . . . . 0.18 109.735 -179.745 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' C' C ' 342' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -52.29 -43.08 64.27 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.215 -0.928 . . . . 2.91 109.683 179.928 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' C' C ' 343' ' ' GLU . . . . . . . . . . . . . 7.5 tp10 -59.77 -45.51 92.03 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 120.912 -1.118 . . . . 2.14 110.32 -179.49 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' C' C ' 344' ' ' LEU . . . . . . . . . . . . . 48.9 mt -62.5 -42.81 99.75 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.324 -0.86 . . . . 0.22 110.081 -179.387 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' C' C ' 345' ' ' ASN . . . . . . . . . . . . . 22.5 t-20 -54.12 -50.93 65.76 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.211 -0.931 . . . . 1.08 109.627 -179.379 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' C' C ' 346' ' ' GLU . . . . . . . . . . . . . 1.2 tt0 -61.03 -36.36 79.35 Favored 'General case' 0 C--N 1.301 -1.514 0 O-C-N 121.521 -0.737 . . . . 2.21 109.919 -179.773 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' C' C ' 347' ' ' ALA . . . . . 0.876 ' HB1' ' HB1' ' D' ' 347' ' ' ALA . . . -58.88 -52.76 64.35 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.075 -1.016 . . . . 0.18 110.1 -179.529 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' C' C ' 348' ' ' LEU . . . . . 0.529 HD22 ' N ' ' C' ' 348' ' ' LEU . 2.7 mm? -62.22 -40.6 96.65 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.327 -0.858 . . . . 0.32 109.721 -179.768 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' C' C ' 349' ' ' GLU . . . . . . . . . . . . . 4.1 mt-10 -59.73 -36.77 77.26 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.138 -0.976 . . . . 2.19 110.653 -179.247 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' C' C ' 350' ' ' LEU . . . . . 0.646 HD13 HD22 ' D' ' 350' ' ' LEU . 5.3 tt -62.61 -45.96 90.49 Favored 'General case' 0 N--CA 1.494 1.74 0 O-C-N 121.126 -0.984 . . . . 0.46 109.726 -178.953 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' C' C ' 351' ' ' LYS . . . . . . . . . . . . . 24.2 tttm -59.65 -43.73 93.81 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.111 -0.993 . . . . 1.35 109.903 -179.497 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' C' C ' 352' ' ' ASP . . . . . . . . . . . . . 13.2 m-20 -58.58 -32.16 68.69 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.06 -1.025 . . . . 1.19 109.417 -179.616 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' C' C ' 353' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.301 -1.504 0 O-C-N 121.234 -0.916 . . . . 0.57 110.378 -179.37 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' D' D ' 326' ' ' GLU . . . . . . . . . . . . . 1.6 mm-40 . . . . . 0 N--CA 1.486 1.37 0 N-CA-C 109.162 -0.681 . . . . 2.13 109.162 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' D' D ' 327' ' ' TYR . . . . . . . . . . . . . 54.7 m-85 -148.26 109.42 4.32 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.183 -0.948 . . . . 0.47 109.659 -179.854 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' D' D ' 328' ' ' PHE . . . . . . . . . . . . . 68.8 m-85 -114.37 -168.18 1.33 Allowed 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.504 -0.747 . . . . 0.3 109.732 -179.878 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' D' D ' 329' ' ' THR . . . . . 0.416 ' HA ' ' O ' ' B' ' 330' ' ' LEU . 32.9 p -152.87 166.25 32.9 Favored 'General case' 0 N--CA 1.489 1.49 0 O-C-N 121.179 -0.95 . . . . 0.22 109.298 -179.829 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' D' D ' 330' ' ' LEU . . . . . 0.758 HD11 HD22 ' B' ' 345' ' ' ASN . 24.1 tp -148.32 125.99 11.8 Favored 'General case' 0 N--CA 1.488 1.461 0 O-C-N 121.297 -0.877 . . . . 0.28 109.723 -179.734 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' D' D ' 331' ' ' GLN . . . . . . . . . . . . . 1.4 tp60 -85.36 108.69 17.95 Favored 'General case' 0 C--N 1.302 -1.473 0 O-C-N 121.314 -0.866 . . . . 0.93 108.75 179.591 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' D' D ' 332' ' ' ILE . . . . . . . . . . . . . 31.9 mt -103.33 114.52 43.16 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.641 0 O-C-N 121.146 -0.971 . . . . 0.25 110.003 -179.498 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' D' D ' 333' ' ' ARG . . . . . . . . . . . . . 53.4 mtm180 -73.83 151.78 40.43 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.2 -0.938 . . . . 2.93 109.839 179.932 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' D' D ' 334' ' ' GLY . . . . . . . . . . . . . . . 79.3 128.32 0.6 Allowed Glycine 0 N--CA 1.49 2.273 0 N-CA-C 109.894 -1.282 . . . . 0.41 109.894 179.237 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' D' D ' 335' ' ' ARG . . . . . 0.439 ' HB2' ' CE2' ' B' ' 328' ' ' PHE . 33.2 ttp180 -78.75 -32.09 46.51 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.224 -1.162 . . . . 3.03 109.356 179.904 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' D' D ' 336' ' ' GLU . . . . . . . . . . . . . 2.1 tt0 -58.02 -62.26 1.95 Allowed 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.344 -0.847 . . . . 2.26 109.515 -179.993 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' D' D ' 337' ' ' ARG . . . . . 0.452 ' NH1' ' CG ' ' D' ' 337' ' ' ARG . 0.0 OUTLIER -59.38 -29.62 67.83 Favored 'General case' 0 C--N 1.301 -1.502 0 O-C-N 121.229 -0.919 . . . . 2.92 109.719 -179.608 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' D' D ' 338' ' ' PHE . . . . . 0.42 ' HB3' ' O ' ' D' ' 335' ' ' ARG . 68.0 t80 -54.22 -56.44 18.24 Favored 'General case' 0 C--N 1.3 -1.574 0 O-C-N 121.491 -0.756 . . . . 0.37 109.429 179.953 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' D' D ' 339' ' ' GLU . . . . . . . . . . . . . 3.3 mt-10 -52.49 -34.65 50.36 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.022 -1.049 . . . . 1.99 109.924 -179.893 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' D' D ' 340' ' ' MET . . . . . . . . . . . . . 32.4 ttp -62.83 -50.24 71.75 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.137 -0.977 . . . . 0.31 110.143 -179.308 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' D' D ' 341' ' ' PHE . . . . . . . . . . . . . 46.8 m-85 -62.77 -44.24 96.7 Favored 'General case' 0 C--N 1.301 -1.511 0 O-C-N 120.944 -1.097 . . . . 0.18 109.669 -179.484 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' D' D ' 342' ' ' ARG . . . . . 0.453 ' NH1' ' CG ' ' D' ' 342' ' ' ARG . 0.0 OUTLIER -51.9 -41.65 62.11 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.236 -0.915 . . . . 2.41 109.821 -179.478 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' D' D ' 343' ' ' GLU . . . . . . . . . . . . . 3.6 tt0 -60.4 -46.62 89.32 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.183 -0.948 . . . . 2.35 109.84 -179.346 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' D' D ' 344' ' ' LEU . . . . . 0.451 ' HA ' HD23 ' D' ' 344' ' ' LEU . 71.6 mt -62.44 -34.68 77.28 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.283 -0.886 . . . . 0.19 109.469 -179.844 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' D' D ' 345' ' ' ASN . . . . . 0.742 HD22 HD11 ' B' ' 330' ' ' LEU . 43.2 t-20 -58.49 -52.19 66.68 Favored 'General case' 0 C--N 1.302 -1.492 0 O-C-N 121.319 -0.863 . . . . 1.09 109.723 -179.741 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' D' D ' 346' ' ' GLU . . . . . . . . . . . . . 42.7 tt0 -62.27 -29.25 70.29 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.39 -0.819 . . . . 1.69 109.678 -179.68 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' D' D ' 347' ' ' ALA . . . . . 0.876 ' HB1' ' HB1' ' C' ' 347' ' ' ALA . . . -61.88 -57.23 12.6 Favored 'General case' 0 N--CA 1.493 1.713 0 O-C-N 121.421 -0.799 . . . . 0.18 109.966 -179.614 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' D' D ' 348' ' ' LEU . . . . . 0.552 HD22 ' N ' ' D' ' 348' ' ' LEU . 3.4 mm? -63.16 -44.06 96.55 Favored 'General case' 0 N--CA 1.488 1.472 0 O-C-N 121.186 -0.946 . . . . 0.31 109.762 -179.804 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' D' D ' 349' ' ' GLU . . . . . . . . . . . . . 3.5 mm-40 -57.22 -34.13 68.24 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.109 -0.995 . . . . 1.95 110.066 -179.232 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' D' D ' 350' ' ' LEU . . . . . 0.646 HD22 HD13 ' C' ' 350' ' ' LEU . 6.2 tt -64.08 -46.13 85.64 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.181 -0.95 . . . . 0.43 109.413 179.885 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' D' D ' 351' ' ' LYS . . . . . . . . . . . . . 42.0 tttt -57.6 -48.43 79.42 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.252 -0.905 . . . . 1.4 109.59 -179.939 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' D' D ' 352' ' ' ASP . . . . . . . . . . . . . 72.4 m-20 -58.66 -38.89 79.13 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.401 -0.812 . . . . 1.17 109.462 179.458 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' D' D ' 353' ' ' ALA . . . . . . . . . . . . . . . -67.65 -20.71 65.35 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.485 -0.759 . . . . 0.59 109.958 -179.514 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' D' D ' 354' ' ' GLN . . . . . 0.44 ' NE2' HD11 ' C' ' 350' ' ' LEU . 1.1 mt-30 . . . . . 0 N--CA 1.491 1.611 0 O-C-N 121.365 -0.834 . . . . 1.44 109.675 -179.887 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 326' ' ' GLU . . . . . . . . . . . . . 7.1 mt-10 . . . . . 0 N--CA 1.49 1.535 0 CA-C-O 121.331 0.586 . . . . 2.13 109.634 . . . . . . . . . 0 0 . 1 . 021 nuclear nobuild core ' A' A ' 327' ' ' TYR . . . . . 0.575 ' CE1' ' HG2' ' C' ' 333' ' ' ARG . 41.4 m-85 -149.79 115.52 5.59 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.394 -0.816 . . . . 0.48 109.628 179.975 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 328' ' ' PHE . . . . . 0.482 ' CE1' ' HA ' ' C' ' 335' ' ' ARG . 76.6 m-85 -113.51 -170.52 1.71 Allowed 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.36 -0.837 . . . . 0.31 109.385 179.928 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 329' ' ' THR . . . . . 0.405 HG23 ' O ' ' A' ' 328' ' ' PHE . 27.3 p -154.08 167.47 29.69 Favored 'General case' 0 N--CA 1.489 1.483 0 O-C-N 121.302 -0.874 . . . . 0.22 109.39 -179.849 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 330' ' ' LEU . . . . . . . . . . . . . 14.7 tp -148.51 126.9 12.27 Favored 'General case' 0 N--CA 1.489 1.487 0 O-C-N 121.251 -0.906 . . . . 0.28 109.359 -179.944 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 331' ' ' GLN . . . . . . . . . . . . . 1.1 tp60 -86.95 111.38 20.78 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.236 -0.915 . . . . 0.91 109.473 -179.996 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 332' ' ' ILE . . . . . . . . . . . . . 32.2 mt -103.61 110.26 29.47 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.501 0 O-C-N 121.245 -0.909 . . . . 0.26 109.486 -179.946 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 333' ' ' ARG . . . . . 0.406 ' CG ' ' CE2' ' C' ' 327' ' ' TYR . 2.4 mpt_? -72.36 143.44 48.61 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.287 -0.883 . . . . 2.92 109.241 179.793 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 334' ' ' GLY . . . . . . . . . . . . . . . 83.74 130.24 1.76 Allowed Glycine 0 N--CA 1.491 2.327 0 N-CA-C 109.525 -1.43 . . . . 0.4 109.525 -179.869 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 335' ' ' ARG . . . . . 0.497 ' HB2' ' CZ ' ' C' ' 328' ' ' PHE . 6.1 ttm180 -79.07 -28.48 43.11 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.344 -1.092 . . . . 3.01 109.622 -179.834 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 336' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -56.79 -67.16 0.34 Allowed 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.208 -0.933 . . . . 2.29 109.799 -179.701 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 337' ' ' ARG . . . . . 0.45 HH11 ' HG2' ' A' ' 337' ' ' ARG . 0.8 OUTLIER -60.38 -25.79 66.16 Favored 'General case' 0 N--CA 1.488 1.47 0 O-C-N 121.251 -0.905 . . . . 2.93 109.68 -179.766 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild core ' A' A ' 338' ' ' PHE . . . . . 0.441 ' HB3' ' O ' ' A' ' 335' ' ' ARG . 67.6 t80 -55.39 -60.59 3.2 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.3 -0.875 . . . . 0.38 109.677 179.982 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 339' ' ' GLU . . . . . . . . . . . . . 79.0 mt-10 -51.36 -31.71 23.16 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.281 -0.887 . . . . 1.97 109.998 -179.738 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 340' ' ' MET . . . . . . . . . . . . . 9.5 ttp -63.27 -52.58 61.49 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.159 -0.963 . . . . 0.31 109.954 -179.575 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 341' ' ' PHE . . . . . . . . . . . . . 48.3 m-85 -61.85 -41.68 98.12 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.226 -0.921 . . . . 0.18 109.74 -179.587 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 342' ' ' ARG . . . . . 0.488 ' HG2' ' NH1' ' A' ' 342' ' ' ARG . 0.0 OUTLIER -50.9 -41.73 58.74 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.17 -0.956 . . . . 2.42 109.888 -179.867 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild core ' A' A ' 343' ' ' GLU . . . . . . . . . . . . . 28.3 tt0 -59.67 -50.71 72.78 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.235 -0.916 . . . . 2.35 110.195 -179.544 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 344' ' ' LEU . . . . . 0.763 HD22 HD22 ' B' ' 344' ' ' LEU . 41.0 mt -61.29 -30.04 70.23 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.121 -0.987 . . . . 0.18 109.92 -179.477 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 345' ' ' ASN . . . . . 0.462 ' HB2' HD21 ' C' ' 330' ' ' LEU . 29.3 t-20 -57.52 -56.96 15.18 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.235 -0.916 . . . . 1.09 109.993 -179.659 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 346' ' ' GLU . . . . . . . . . . . . . 70.9 tt0 -61.47 -29.47 69.99 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.219 -0.926 . . . . 1.65 110.183 -179.452 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 347' ' ' ALA . . . . . 0.896 ' HB1' ' HB1' ' B' ' 347' ' ' ALA . . . -60.07 -55.89 28.37 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.115 -0.991 . . . . 0.18 110.066 -179.522 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 348' ' ' LEU . . . . . 0.582 HD22 ' N ' ' A' ' 348' ' ' LEU . 4.2 mm? -61.84 -44.62 96.47 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.257 -0.902 . . . . 0.3 110.07 -179.434 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 349' ' ' GLU . . . . . 0.413 ' HG3' ' O ' ' A' ' 345' ' ' ASN . 55.8 mt-10 -57.4 -35.7 70.36 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.077 -1.015 . . . . 1.94 109.945 -179.438 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 350' ' ' LEU . . . . . 0.706 HD11 ' NE2' ' B' ' 354' ' ' GLN . 6.1 tt -64.45 -40.41 95.68 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.208 -0.933 . . . . 0.46 109.63 -179.765 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 351' ' ' LYS . . . . . . . . . . . . . 2.3 ttmt -57.67 -56.63 19.43 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.285 -0.884 . . . . 1.4 109.895 -179.577 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 352' ' ' ASP . . . . . . . . . . . . . 11.8 m-20 -56.55 -37.54 70.66 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.155 -0.966 . . . . 1.16 109.815 -179.842 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 353' ' ' ALA . . . . . . . . . . . . . . . -67.34 -26.35 66.45 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.228 -0.92 . . . . 0.63 110.183 -179.439 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 354' ' ' GLN . . . . . 0.644 ' NE2' HD11 ' B' ' 350' ' ' LEU . 0.1 OUTLIER . . . . . 0 N--CA 1.49 1.555 0 O-C-N 121.023 -1.048 . . . . 1.47 109.797 -179.751 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' B' B ' 326' ' ' GLU . . . . . . . . . . . . . 7.1 mt-10 . . . . . 0 N--CA 1.491 1.576 0 CA-C-O 121.338 0.59 . . . . 2.13 109.625 . . . . . . . . . 0 0 . 1 . 021 nuclear nobuild core ' B' B ' 327' ' ' TYR . . . . . 0.534 ' CE1' ' CG ' ' D' ' 333' ' ' ARG . 41.7 m-85 -149.84 115.42 5.55 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.339 -0.851 . . . . 0.48 109.607 179.96 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' B' B ' 328' ' ' PHE . . . . . 0.482 ' CZ ' ' HB2' ' D' ' 335' ' ' ARG . 75.9 m-85 -113.54 -170.72 1.75 Allowed 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.352 -0.843 . . . . 0.32 109.321 179.885 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' B' B ' 329' ' ' THR . . . . . 0.482 ' HA ' ' O ' ' D' ' 330' ' ' LEU . 27.7 p -153.89 167.64 29.02 Favored 'General case' 0 N--CA 1.488 1.471 0 O-C-N 121.311 -0.868 . . . . 0.23 109.383 -179.978 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' B' B ' 330' ' ' LEU . . . . . 0.49 ' O ' ' HA ' ' D' ' 329' ' ' THR . 14.5 tp -148.74 126.06 11.54 Favored 'General case' 0 N--CA 1.488 1.45 0 O-C-N 121.207 -0.933 . . . . 0.28 109.491 -179.859 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' B' B ' 331' ' ' GLN . . . . . . . . . . . . . 1.1 tt0 -86.24 111.32 20.31 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.243 -0.911 . . . . 0.91 109.624 -179.905 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' B' B ' 332' ' ' ILE . . . . . . . . . . . . . 31.9 mt -103.36 110.63 30.39 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.538 0 O-C-N 121.23 -0.919 . . . . 0.24 109.564 179.922 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' B' B ' 333' ' ' ARG . . . . . 0.595 ' CG ' ' CE1' ' D' ' 327' ' ' TYR . 2.4 mpt_? -72.57 143.53 48.23 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.19 -0.944 . . . . 2.93 109.261 179.822 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' B' B ' 334' ' ' GLY . . . . . . . . . . . . . . . 83.55 130.04 1.67 Allowed Glycine 0 N--CA 1.49 2.254 0 N-CA-C 109.521 -1.431 . . . . 0.4 109.521 -179.981 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' B' B ' 335' ' ' ARG . . . . . 0.504 ' HB2' ' CZ ' ' D' ' 328' ' ' PHE . 6.2 ttm180 -78.68 -28.41 45.29 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.289 -1.124 . . . . 3.01 109.737 -179.947 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' B' B ' 336' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -56.7 -67.42 0.31 Allowed 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.236 -0.915 . . . . 2.28 109.796 -179.714 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' B' B ' 337' ' ' ARG . . . . . 0.438 HH11 ' HG2' ' B' ' 337' ' ' ARG . 0.8 OUTLIER -60.3 -25.52 65.81 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.271 -0.893 . . . . 2.93 109.676 -179.798 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild core ' B' B ' 338' ' ' PHE . . . . . 0.437 ' HB3' ' O ' ' B' ' 335' ' ' ARG . 66.8 t80 -55.67 -60.7 3.07 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.221 -0.924 . . . . 0.37 109.517 -179.96 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' B' B ' 339' ' ' GLU . . . . . . . . . . . . . 79.1 mt-10 -51.32 -31.77 22.89 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.365 -0.834 . . . . 1.98 109.965 -179.673 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' B' B ' 340' ' ' MET . . . . . . . . . . . . . 9.4 ttp -63.32 -52.52 61.54 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.149 -0.969 . . . . 0.32 110.041 -179.597 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' B' B ' 341' ' ' PHE . . . . . . . . . . . . . 48.3 m-85 -61.64 -42.14 98.48 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.167 -0.958 . . . . 0.18 109.761 -179.695 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' B' B ' 342' ' ' ARG . . . . . 0.494 ' NH1' ' HG2' ' B' ' 342' ' ' ARG . 0.0 OUTLIER -50.32 -42.03 52.13 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.334 -0.854 . . . . 2.42 109.857 -179.894 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild core ' B' B ' 343' ' ' GLU . . . . . . . . . . . . . 27.3 tt0 -59.55 -50.7 72.88 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.255 -0.903 . . . . 2.35 110.258 -179.411 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' B' B ' 344' ' ' LEU . . . . . 0.763 HD22 HD22 ' A' ' 344' ' ' LEU . 40.0 mt -61.38 -29.82 70.15 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.127 -0.983 . . . . 0.18 109.929 -179.537 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' B' B ' 345' ' ' ASN . . . . . 0.412 ' O ' ' HG3' ' B' ' 349' ' ' GLU . 29.2 t-20 -57.58 -57.0 14.67 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.245 -0.909 . . . . 1.09 110.017 -179.688 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' B' B ' 346' ' ' GLU . . . . . . . . . . . . . 71.0 tt0 -61.5 -29.4 69.96 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.214 -0.928 . . . . 1.66 110.246 -179.395 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' B' B ' 347' ' ' ALA . . . . . 0.896 ' HB1' ' HB1' ' A' ' 347' ' ' ALA . . . -60.28 -55.78 29.56 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.136 -0.978 . . . . 0.17 110.061 -179.516 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' B' B ' 348' ' ' LEU . . . . . 0.575 HD22 ' N ' ' B' ' 348' ' ' LEU . 4.2 mm? -61.82 -44.59 96.56 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.203 -0.936 . . . . 0.29 110.005 -179.468 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' B' B ' 349' ' ' GLU . . . . . 0.412 ' HG3' ' O ' ' B' ' 345' ' ' ASN . 56.4 mt-10 -57.38 -35.78 70.42 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.172 -0.955 . . . . 1.95 109.946 -179.471 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' B' B ' 350' ' ' LEU . . . . . 0.644 HD11 ' NE2' ' A' ' 354' ' ' GLN . 6.1 tt -64.4 -40.28 95.48 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.269 -0.894 . . . . 0.45 109.791 -179.826 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' B' B ' 351' ' ' LYS . . . . . . . . . . . . . 2.3 ttmt -57.87 -56.55 20.48 Favored 'General case' 0 N--CA 1.489 1.525 0 O-C-N 121.192 -0.943 . . . . 1.38 109.915 -179.595 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' B' B ' 352' ' ' ASP . . . . . . . . . . . . . 11.5 m-20 -56.69 -37.35 70.75 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.178 -0.951 . . . . 1.16 109.791 -179.882 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' B' B ' 353' ' ' ALA . . . . . . . . . . . . . . . -67.33 -26.28 66.42 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.208 -0.933 . . . . 0.61 110.049 -179.513 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' B' B ' 354' ' ' GLN . . . . . 0.706 ' NE2' HD11 ' A' ' 350' ' ' LEU . 0.1 OUTLIER . . . . . 0 N--CA 1.491 1.594 0 O-C-N 121.05 -1.031 . . . . 1.45 109.936 -179.59 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' C' C ' 326' ' ' GLU . . . . . . . . . . . . . 2.3 mt-10 . . . . . 0 N--CA 1.489 1.51 0 CA-C-O 121.412 0.625 . . . . 2.17 109.555 . . . . . . . . . 0 0 . 1 . 021 nuclear nobuild core ' C' C ' 327' ' ' TYR . . . . . 0.406 ' CE2' ' CG ' ' A' ' 333' ' ' ARG . 37.2 m-85 -149.11 114.21 5.47 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.446 -0.784 . . . . 0.48 109.463 179.809 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' C' C ' 328' ' ' PHE . . . . . 0.497 ' CZ ' ' HB2' ' A' ' 335' ' ' ARG . 77.0 m-85 -112.56 -170.54 1.68 Allowed 'General case' 0 N--CA 1.487 1.42 0 O-C-N 121.269 -0.895 . . . . 0.33 108.951 179.677 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' C' C ' 329' ' ' THR . . . . . 0.423 HG23 ' O ' ' C' ' 328' ' ' PHE . 5.0 p -153.42 170.25 21.17 Favored 'General case' 0 C--N 1.301 -1.512 0 O-C-N 121.27 -0.894 . . . . 0.23 109.226 179.957 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' C' C ' 330' ' ' LEU . . . . . 0.462 HD21 ' HB2' ' A' ' 345' ' ' ASN . 49.5 tp -149.12 134.49 18.44 Favored 'General case' 0 C--N 1.303 -1.454 0 O-C-N 121.213 -0.929 . . . . 0.28 109.325 -179.77 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' C' C ' 331' ' ' GLN . . . . . 0.472 ' NE2' ' O ' ' A' ' 328' ' ' PHE . 57.8 tp60 -84.95 107.17 16.96 Favored 'General case' 0 N--CA 1.489 1.475 0 O-C-N 121.337 -0.852 . . . . 1.48 109.187 -179.994 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' C' C ' 332' ' ' ILE . . . . . 0.771 HG21 ' HA ' ' C' ' 338' ' ' PHE . 64.2 mt -103.05 100.39 10.31 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.505 0 O-C-N 121.162 -0.961 . . . . 0.24 109.424 -179.897 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' C' C ' 333' ' ' ARG . . . . . 0.575 ' HG2' ' CE1' ' A' ' 327' ' ' TYR . 89.2 mtt180 -72.57 159.09 34.46 Favored 'General case' 0 N--CA 1.488 1.456 0 O-C-N 121.311 -0.868 . . . . 2.74 109.289 179.725 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' C' C ' 334' ' ' GLY . . . . . . . . . . . . . . . 72.58 129.13 0.11 Allowed Glycine 0 N--CA 1.491 2.36 0 N-CA-C 109.39 -1.484 . . . . 0.35 109.39 -179.788 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' C' C ' 335' ' ' ARG . . . . . 0.482 ' HA ' ' CE1' ' A' ' 328' ' ' PHE . 10.1 ttm180 -78.08 -30.89 49.86 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.245 -1.15 . . . . 2.53 109.889 -179.769 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' C' C ' 336' ' ' GLU . . . . . . . . . . . . . 1.5 tt0 -58.95 -63.82 1.16 Allowed 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.227 -0.921 . . . . 2.62 110.087 -179.591 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' C' C ' 337' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -59.09 -26.11 64.37 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.155 -0.965 . . . . 2.81 109.802 -179.43 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' C' C ' 338' ' ' PHE . . . . . 0.771 ' HA ' HG21 ' C' ' 332' ' ' ILE . 81.3 t80 -54.78 -61.12 2.52 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.152 -0.968 . . . . 0.4 109.662 -179.944 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' C' C ' 339' ' ' GLU . . . . . . . . . . . . . 22.9 mt-10 -50.97 -31.59 18.38 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.301 -0.874 . . . . 2.05 109.995 -179.669 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' C' C ' 340' ' ' MET . . . . . . . . . . . . . 34.6 ttp -63.47 -52.85 59.6 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.173 -0.954 . . . . 0.32 109.916 -179.564 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' C' C ' 341' ' ' PHE . . . . . . . . . . . . . 48.9 m-85 -62.08 -42.26 99.02 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.153 -0.967 . . . . 0.18 109.848 -179.58 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' C' C ' 342' ' ' ARG . . . . . 0.451 HH11 ' CG ' ' C' ' 342' ' ' ARG . 0.2 OUTLIER -49.94 -45.39 51.19 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.358 -0.839 . . . . 2.91 110.177 -179.574 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild core ' C' C ' 343' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -57.82 -48.71 78.97 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.137 -0.977 . . . . 2.14 110.025 -179.332 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' C' C ' 344' ' ' LEU . . . . . 0.637 HD22 HD22 ' D' ' 344' ' ' LEU . 32.3 mt -62.69 -31.94 72.93 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.2 -0.938 . . . . 0.22 110.132 -179.549 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' C' C ' 345' ' ' ASN . . . . . . . . . . . . . 20.4 t-20 -57.63 -58.62 7.5 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.213 -0.929 . . . . 1.08 109.57 -179.665 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' C' C ' 346' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -61.36 -26.08 67.59 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.317 -0.865 . . . . 2.21 109.669 -179.875 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' C' C ' 347' ' ' ALA . . . . . 0.772 ' HB1' ' HB1' ' D' ' 347' ' ' ALA . . . -60.42 -58.63 7.7 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.173 -0.954 . . . . 0.18 109.772 -179.984 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' C' C ' 348' ' ' LEU . . . . . 0.579 HD22 ' N ' ' C' ' 348' ' ' LEU . 4.3 mm? -62.23 -40.54 96.47 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.237 -0.915 . . . . 0.32 109.86 -179.658 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' C' C ' 349' ' ' GLU . . . . . . . . . . . . . 68.0 mm-40 -57.46 -37.09 72.31 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.186 -0.946 . . . . 2.19 109.726 -179.63 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' C' C ' 350' ' ' LEU . . . . . 0.675 HD13 HD22 ' D' ' 350' ' ' LEU . 5.3 tt -63.02 -38.79 92.62 Favored 'General case' 0 N--CA 1.489 1.481 0 O-C-N 121.109 -0.994 . . . . 0.46 109.065 179.929 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' C' C ' 351' ' ' LYS . . . . . . . . . . . . . 20.3 tttt -60.15 -37.12 79.15 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.351 -0.843 . . . . 1.35 109.164 179.765 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' C' C ' 352' ' ' ASP . . . . . . . . . . . . . 8.5 m-20 -56.93 -41.91 79.07 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.31 -0.869 . . . . 1.19 109.539 179.926 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' C' C ' 353' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 1.54 0 O-C-N 121.272 -0.892 . . . . 0.57 109.575 -179.897 . . . . . . . . 0 0 . 1 . 021 nuclear nobuild core ' D' D ' 326' ' ' GLU . . . . . . . . . . . . . 7.3 mt-10 . . . . . 0 N--CA 1.488 1.47 0 CA-C-O 121.324 0.583 . . . . 2.13 109.655 . . . . . . . . . 0 0 . 1 . 021 nuclear nobuild core ' D' D ' 327' ' ' TYR . . . . . 0.595 ' CE1' ' CG ' ' B' ' 333' ' ' ARG . 41.2 m-85 -149.96 115.52 5.53 Favored 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.354 -0.841 . . . . 0.47 109.422 -179.973 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' D' D ' 328' ' ' PHE . . . . . 0.504 ' CZ ' ' HB2' ' B' ' 335' ' ' ARG . 76.4 m-85 -113.49 -170.71 1.74 Allowed 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.317 -0.864 . . . . 0.3 109.313 179.934 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' D' D ' 329' ' ' THR . . . . . 0.49 ' HA ' ' O ' ' B' ' 330' ' ' LEU . 26.9 p -153.74 167.79 28.44 Favored 'General case' 0 N--CA 1.489 1.499 0 O-C-N 121.221 -0.924 . . . . 0.22 109.428 179.986 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' D' D ' 330' ' ' LEU . . . . . 0.482 ' O ' ' HA ' ' B' ' 329' ' ' THR . 14.7 tp -148.95 126.12 11.41 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.193 -0.942 . . . . 0.28 109.478 -179.946 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' D' D ' 331' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -86.28 111.52 20.52 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.218 -0.926 . . . . 0.93 109.55 -179.976 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' D' D ' 332' ' ' ILE . . . . . . . . . . . . . 31.8 mt -103.6 110.54 30.29 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.532 0 O-C-N 121.176 -0.953 . . . . 0.25 109.573 179.827 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' D' D ' 333' ' ' ARG . . . . . 0.534 ' CG ' ' CE1' ' B' ' 327' ' ' TYR . 2.4 mpt_? -72.69 143.22 48.16 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.313 -0.867 . . . . 2.93 109.239 179.847 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' D' D ' 334' ' ' GLY . . . . . . . . . . . . . . . 84.21 129.91 1.86 Allowed Glycine 0 N--CA 1.49 2.274 0 N-CA-C 109.539 -1.425 . . . . 0.41 109.539 -179.856 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' D' D ' 335' ' ' ARG . . . . . 0.482 ' HB2' ' CZ ' ' B' ' 328' ' ' PHE . 6.1 ttm180 -78.79 -28.65 44.63 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.193 -1.18 . . . . 3.03 109.6 -179.949 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' D' D ' 336' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -56.53 -67.17 0.33 Allowed 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.201 -0.937 . . . . 2.26 109.881 -179.779 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' D' D ' 337' ' ' ARG . . . . . 0.442 HH11 ' HG2' ' D' ' 337' ' ' ARG . 0.8 OUTLIER -60.53 -25.79 66.39 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.216 -0.927 . . . . 2.92 109.651 -179.669 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild core ' D' D ' 338' ' ' PHE . . . . . 0.433 ' HB3' ' O ' ' D' ' 335' ' ' ARG . 67.8 t80 -55.47 -60.53 3.29 Favored 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.124 -0.985 . . . . 0.37 109.628 -179.968 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' D' D ' 339' ' ' GLU . . . . . . . . . . . . . 77.2 mt-10 -51.35 -31.84 23.51 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.305 -0.872 . . . . 1.99 109.998 -179.725 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' D' D ' 340' ' ' MET . . . . . . . . . . . . . 9.4 ttp -63.25 -52.65 61.24 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.132 -0.98 . . . . 0.31 109.959 -179.604 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' D' D ' 341' ' ' PHE . . . . . . . . . . . . . 48.6 m-85 -61.57 -41.86 98.01 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.183 -0.948 . . . . 0.18 109.786 -179.633 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' D' D ' 342' ' ' ARG . . . . . 0.48 ' NH1' ' HG2' ' D' ' 342' ' ' ARG . 0.0 OUTLIER -50.72 -41.96 56.76 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.241 -0.912 . . . . 2.41 109.845 -179.809 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild core ' D' D ' 343' ' ' GLU . . . . . . . . . . . . . 28.3 tt0 -59.54 -50.56 73.44 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.258 -0.901 . . . . 2.35 110.251 -179.478 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' D' D ' 344' ' ' LEU . . . . . 0.637 HD22 HD22 ' C' ' 344' ' ' LEU . 40.3 mt -61.47 -29.85 70.22 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.143 -0.973 . . . . 0.19 109.834 -179.463 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' D' D ' 345' ' ' ASN . . . . . 0.417 ' O ' ' HG3' ' D' ' 349' ' ' GLU . 29.3 t-20 -57.59 -57.02 14.53 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.173 -0.954 . . . . 1.09 110.002 -179.659 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' D' D ' 346' ' ' GLU . . . . . . . . . . . . . 70.6 tt0 -61.47 -29.56 70.04 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.182 -0.949 . . . . 1.69 110.203 -179.427 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' D' D ' 347' ' ' ALA . . . . . 0.772 ' HB1' ' HB1' ' C' ' 347' ' ' ALA . . . -60.07 -55.69 30.89 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.059 -1.026 . . . . 0.18 110.096 -179.562 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' D' D ' 348' ' ' LEU . . . . . 0.578 HD22 ' N ' ' D' ' 348' ' ' LEU . 4.2 mm? -62.07 -44.43 96.69 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.234 -0.916 . . . . 0.31 110.074 -179.409 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' D' D ' 349' ' ' GLU . . . . . 0.417 ' HG3' ' O ' ' D' ' 345' ' ' ASN . 56.9 mt-10 -57.64 -35.65 70.79 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.209 -0.932 . . . . 1.95 109.953 -179.479 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' D' D ' 350' ' ' LEU . . . . . 0.675 HD22 HD13 ' C' ' 350' ' ' LEU . 6.1 tt -64.49 -40.07 94.98 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.211 -0.93 . . . . 0.43 109.736 -179.847 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' D' D ' 351' ' ' LYS . . . . . . . . . . . . . 2.3 ttmt -58.02 -56.35 23.2 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.282 -0.886 . . . . 1.4 109.829 -179.633 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' D' D ' 352' ' ' ASP . . . . . . . . . . . . . 11.9 m-20 -56.97 -37.33 71.42 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.145 -0.972 . . . . 1.17 109.773 -179.769 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' D' D ' 353' ' ' ALA . . . . . . . . . . . . . . . -67.4 -26.26 66.35 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.226 -0.921 . . . . 0.59 110.065 -179.493 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' D' D ' 354' ' ' GLN . . . . . 0.591 ' NE2' HD11 ' C' ' 350' ' ' LEU . 0.1 OUTLIER . . . . . 0 N--CA 1.491 1.619 0 O-C-N 121.042 -1.036 . . . . 1.44 109.915 -179.723 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 326' ' ' GLU . . . . . . . . . . . . . 7.1 mt-10 . . . . . 0 N--CA 1.49 1.537 0 N-CA-C 109.404 -0.591 . . . . 2.13 109.404 . . . . . . . . . 0 0 . 1 . 022 nuclear nobuild core ' A' A ' 327' ' ' TYR . . . . . 0.611 ' CE1' ' HG2' ' C' ' 333' ' ' ARG . 45.4 m-85 -149.85 112.28 4.71 Favored 'General case' 0 N--CA 1.489 1.491 0 O-C-N 121.249 -0.907 . . . . 0.48 109.838 -179.997 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 328' ' ' PHE . . . . . 0.409 ' C ' HG23 ' A' ' 329' ' ' THR . 75.5 m-85 -113.71 -173.85 2.35 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.341 -0.85 . . . . 0.31 109.171 179.709 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 329' ' ' THR . . . . . 0.409 HG23 ' C ' ' A' ' 328' ' ' PHE . 73.2 p -153.38 164.21 38.56 Favored 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.184 -0.948 . . . . 0.22 109.268 -179.891 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 330' ' ' LEU . . . . . . . . . . . . . 15.4 tp -149.74 125.93 10.7 Favored 'General case' 0 N--CA 1.488 1.46 0 O-C-N 121.207 -0.933 . . . . 0.28 109.666 -179.853 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 331' ' ' GLN . . . . . . . . . . . . . 1.6 tt0 -87.4 114.44 24.01 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.302 -0.874 . . . . 0.91 109.321 179.817 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 332' ' ' ILE . . . . . 0.484 HG21 ' HA ' ' A' ' 338' ' ' PHE . 57.9 mt -103.37 104.42 16.62 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.592 0 O-C-N 121.261 -0.9 . . . . 0.26 109.739 -179.867 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 333' ' ' ARG . . . . . . . . . . . . . 9.9 mtm180 -72.05 139.17 48.36 Favored 'General case' 0 N--CA 1.488 1.456 0 O-C-N 121.322 -0.861 . . . . 2.92 109.246 179.64 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 334' ' ' GLY . . . . . . . . . . . . . . . 92.89 131.53 5.77 Favored Glycine 0 N--CA 1.49 2.298 0 N-CA-C 109.407 -1.477 . . . . 0.4 109.407 -179.789 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 335' ' ' ARG . . . . . . . . . . . . . 2.0 ttt180 -78.21 -32.92 50.19 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.303 -1.116 . . . . 3.01 109.488 -179.855 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 336' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -58.17 -61.5 2.52 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.133 -0.979 . . . . 2.29 109.696 -179.895 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 337' ' ' ARG . . . . . . . . . . . . . 5.3 mtt180 -60.45 -34.56 74.18 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.173 -0.955 . . . . 2.93 109.705 -179.889 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 338' ' ' PHE . . . . . 0.484 ' HA ' HG21 ' A' ' 332' ' ' ILE . 78.8 t80 -54.05 -60.45 3.32 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.222 -0.924 . . . . 0.38 109.631 -179.704 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 339' ' ' GLU . . . . . . . . . . . . . 95.7 mt-10 -50.89 -33.88 25.94 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.216 -0.928 . . . . 1.97 109.999 -179.615 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 340' ' ' MET . . . . . . . . . . . . . 32.2 ttp -64.01 -50.98 66.36 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.068 -1.02 . . . . 0.31 110.063 -179.635 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 341' ' ' PHE . . . . . . . . . . . . . 37.1 m-85 -61.57 -47.56 84.94 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.128 -0.983 . . . . 0.18 109.78 -179.497 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 342' ' ' ARG . . . . . . . . . . . . . 1.4 ttt180 -49.46 -39.4 33.3 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.173 -0.954 . . . . 2.42 109.598 -179.913 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 343' ' ' GLU . . . . . . . . . . . . . 2.7 tt0 -58.51 -49.47 77.28 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.14 -0.975 . . . . 2.35 109.437 -179.95 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 344' ' ' LEU . . . . . 0.722 HD22 ' CD2' ' B' ' 344' ' ' LEU . 73.9 mt -62.3 -29.7 70.62 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.278 -0.889 . . . . 0.18 109.334 179.824 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 345' ' ' ASN . . . . . . . . . . . . . 11.2 t-20 -57.77 -54.17 49.92 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.323 -0.861 . . . . 1.09 109.581 179.907 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 346' ' ' GLU . . . . . . . . . . . . . 1.2 tp10 -62.13 -28.68 69.81 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.279 -0.888 . . . . 1.65 109.785 -179.768 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 347' ' ' ALA . . . . . 1.08 ' HB1' ' HB1' ' B' ' 347' ' ' ALA . . . -61.76 -62.2 1.97 Allowed 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.116 -0.99 . . . . 0.18 110.032 -179.632 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 348' ' ' LEU . . . . . 0.546 HD22 ' N ' ' A' ' 348' ' ' LEU . 3.9 mm? -61.36 -44.61 96.87 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.259 -0.901 . . . . 0.3 110.112 -179.369 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 349' ' ' GLU . . . . . . . . . . . . . 3.1 mt-10 -56.9 -35.77 69.36 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.188 -0.945 . . . . 1.94 109.83 -179.388 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 350' ' ' LEU . . . . . 0.698 HD13 HD22 ' B' ' 350' ' ' LEU . 5.9 tt -64.93 -45.67 84.84 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.243 -0.91 . . . . 0.46 109.669 -179.962 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 351' ' ' LYS . . . . . . . . . . . . . 22.0 tttt -59.06 -41.21 87.39 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.246 -0.909 . . . . 1.4 109.303 -179.983 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 352' ' ' ASP . . . . . . . . . . . . . 11.9 m-20 -56.39 -50.22 72.22 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.33 -0.856 . . . . 1.16 109.494 179.855 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 353' ' ' ALA . . . . . . . . . . . . . . . -68.63 -15.8 63.64 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.375 -0.828 . . . . 0.63 109.566 179.987 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 354' ' ' GLN . . . . . 0.479 ' NE2' HD11 ' B' ' 350' ' ' LEU . 0.0 OUTLIER . . . . . 0 N--CA 1.491 1.6 0 O-C-N 121.21 -0.931 . . . . 1.47 109.58 -179.968 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' B' B ' 326' ' ' GLU . . . . . . . . . . . . . 7.2 mt-10 . . . . . 0 N--CA 1.49 1.55 0 CA-C-O 121.317 0.58 . . . . 2.13 109.536 . . . . . . . . . 0 0 . 1 . 022 nuclear nobuild core ' B' B ' 327' ' ' TYR . . . . . . . . . . . . . 44.2 m-85 -149.76 112.26 4.73 Favored 'General case' 0 N--CA 1.489 1.493 0 O-C-N 121.272 -0.893 . . . . 0.48 109.732 -179.97 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' B' B ' 328' ' ' PHE . . . . . 0.481 ' HB2' ' CD1' ' D' ' 338' ' ' PHE . 75.8 m-85 -113.74 -173.72 2.33 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.323 -0.861 . . . . 0.32 109.146 179.676 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' B' B ' 329' ' ' THR . . . . . 0.42 HG23 ' C ' ' B' ' 328' ' ' PHE . 71.6 p -153.47 164.51 38.07 Favored 'General case' 0 N--CA 1.488 1.429 0 O-C-N 121.272 -0.892 . . . . 0.23 109.363 179.921 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' B' B ' 330' ' ' LEU . . . . . . . . . . . . . 15.8 tp -149.89 126.47 10.93 Favored 'General case' 0 C--N 1.302 -1.457 0 O-C-N 121.215 -0.928 . . . . 0.28 109.556 -179.842 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' B' B ' 331' ' ' GLN . . . . . . . . . . . . . 1.6 tt0 -87.85 114.6 24.62 Favored 'General case' 0 N--CA 1.489 1.493 0 O-C-N 121.258 -0.901 . . . . 0.91 109.276 179.829 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' B' B ' 332' ' ' ILE . . . . . 0.498 HG21 ' HA ' ' B' ' 338' ' ' PHE . 57.8 mt -103.41 104.59 16.9 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.493 0 O-C-N 121.217 -0.927 . . . . 0.24 109.709 -179.878 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' B' B ' 333' ' ' ARG . . . . . . . . . . . . . 10.3 mtm180 -72.25 139.06 47.9 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.237 -0.914 . . . . 2.93 109.12 179.717 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' B' B ' 334' ' ' GLY . . . . . . . . . . . . . . . 92.94 131.94 5.93 Favored Glycine 0 N--CA 1.491 2.326 0 N-CA-C 109.392 -1.483 . . . . 0.4 109.392 -179.776 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' B' B ' 335' ' ' ARG . . . . . 0.454 ' HA ' ' CE1' ' D' ' 328' ' ' PHE . 2.0 ttt180 -78.53 -32.93 48.21 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.209 -1.171 . . . . 3.01 109.587 -179.855 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' B' B ' 336' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -58.08 -61.75 2.32 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.235 -0.916 . . . . 2.28 109.633 -179.983 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' B' B ' 337' ' ' ARG . . . . . . . . . . . . . 5.0 mtt180 -60.2 -34.79 74.11 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.242 -0.911 . . . . 2.93 109.695 -179.756 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' B' B ' 338' ' ' PHE . . . . . 0.524 ' CD1' ' HB2' ' D' ' 328' ' ' PHE . 79.9 t80 -53.87 -60.55 3.18 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.319 -0.863 . . . . 0.37 109.763 -179.833 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' B' B ' 339' ' ' GLU . . . . . . . . . . . . . 95.0 mt-10 -50.94 -33.76 25.8 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.233 -0.917 . . . . 1.98 110.114 -179.632 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' B' B ' 340' ' ' MET . . . . . . . . . . . . . 32.7 ttp -64.34 -50.44 67.77 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.101 -0.999 . . . . 0.32 109.975 -179.607 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' B' B ' 341' ' ' PHE . . . . . . . . . . . . . 37.4 m-85 -61.87 -47.2 86.06 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.174 -0.954 . . . . 0.18 110.0 -179.69 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' B' B ' 342' ' ' ARG . . . . . . . . . . . . . 1.5 ttt180 -49.84 -39.3 38.53 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.155 -0.966 . . . . 2.42 109.605 179.947 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' B' B ' 343' ' ' GLU . . . . . . . . . . . . . 2.7 tt0 -58.52 -49.68 76.49 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.292 -0.88 . . . . 2.35 109.352 -179.991 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' B' B ' 344' ' ' LEU . . . . . 0.722 ' CD2' HD22 ' A' ' 344' ' ' LEU . 74.6 mt -62.25 -29.59 70.51 Favored 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.298 -0.876 . . . . 0.18 109.295 179.884 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' B' B ' 345' ' ' ASN . . . . . . . . . . . . . 11.4 t-20 -57.96 -54.07 51.04 Favored 'General case' 0 N--CA 1.488 1.472 0 O-C-N 121.283 -0.886 . . . . 1.09 109.462 -179.946 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' B' B ' 346' ' ' GLU . . . . . . . . . . . . . 1.2 tp10 -62.15 -28.93 69.99 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.287 -0.883 . . . . 1.66 109.765 -179.75 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' B' B ' 347' ' ' ALA . . . . . 1.08 ' HB1' ' HB1' ' A' ' 347' ' ' ALA . . . -61.76 -61.85 2.21 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.191 -0.943 . . . . 0.17 110.209 -179.625 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' B' B ' 348' ' ' LEU . . . . . 0.555 HD22 ' N ' ' B' ' 348' ' ' LEU . 3.9 mm? -61.66 -44.56 96.73 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.151 -0.968 . . . . 0.29 110.074 -179.445 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' B' B ' 349' ' ' GLU . . . . . . . . . . . . . 3.1 mt-10 -56.7 -35.98 69.13 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.167 -0.958 . . . . 1.95 109.848 -179.444 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' B' B ' 350' ' ' LEU . . . . . 0.698 HD22 HD13 ' A' ' 350' ' ' LEU . 6.0 tt -64.72 -45.78 85.08 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.177 -0.952 . . . . 0.45 109.596 -179.946 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' B' B ' 351' ' ' LYS . . . . . . . . . . . . . 22.1 tttt -58.93 -41.21 86.81 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.365 -0.834 . . . . 1.38 109.283 -179.922 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' B' B ' 352' ' ' ASP . . . . . . . . . . . . . 12.1 m-20 -56.28 -50.45 71.34 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.31 -0.869 . . . . 1.16 109.422 179.862 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' B' B ' 353' ' ' ALA . . . . . . . . . . . . . . . -68.68 -15.63 63.58 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.287 -0.883 . . . . 0.61 109.501 -179.909 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' B' B ' 354' ' ' GLN . . . . . 0.43 ' NE2' HD11 ' A' ' 350' ' ' LEU . 0.0 OUTLIER . . . . . 0 N--CA 1.49 1.571 0 O-C-N 121.193 -0.942 . . . . 1.45 109.561 -179.957 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' C' C ' 326' ' ' GLU . . . . . . . . . . . . . 3.6 mp0 . . . . . 0 N--CA 1.489 1.505 0 N-CA-C 109.355 -0.609 . . . . 2.17 109.355 . . . . . . . . . 0 0 . 1 . 022 nuclear nobuild core ' C' C ' 327' ' ' TYR . . . . . . . . . . . . . 38.4 m-85 -150.18 105.56 3.38 Favored 'General case' 0 N--CA 1.488 1.451 0 O-C-N 121.234 -0.916 . . . . 0.48 110.085 179.922 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' C' C ' 328' ' ' PHE . . . . . 0.42 ' HB3' ' CE1' ' A' ' 338' ' ' PHE . 87.8 m-85 -113.97 -174.42 2.47 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.455 -0.778 . . . . 0.33 108.94 179.531 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' C' C ' 329' ' ' THR . . . . . . . . . . . . . 19.8 p -151.55 164.41 36.89 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.108 -0.995 . . . . 0.23 109.466 -179.942 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' C' C ' 330' ' ' LEU . . . . . . . . . . . . . 15.1 tp -150.86 130.52 13.12 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.151 -0.968 . . . . 0.28 109.824 -179.742 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' C' C ' 331' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -88.51 112.48 23.05 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.342 -0.849 . . . . 1.48 109.394 179.691 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' C' C ' 332' ' ' ILE . . . . . 0.415 HD13 ' CD2' ' C' ' 341' ' ' PHE . 64.5 mt -103.68 102.81 14.22 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.653 0 O-C-N 121.138 -0.976 . . . . 0.24 109.994 -179.83 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' C' C ' 333' ' ' ARG . . . . . 0.611 ' HG2' ' CE1' ' A' ' 327' ' ' TYR . 2.4 mtp180 -72.69 156.32 39.07 Favored 'General case' 0 N--CA 1.488 1.47 0 O-C-N 121.262 -0.899 . . . . 2.74 109.201 179.518 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' C' C ' 334' ' ' GLY . . . . . . . . . . . . . . . 80.06 128.92 0.75 Allowed Glycine 0 N--CA 1.491 2.329 0 N-CA-C 109.66 -1.376 . . . . 0.35 109.66 179.856 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' C' C ' 335' ' ' ARG . . . . . . . . . . . . . 20.8 ttt180 -79.28 -33.03 43.76 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.401 -1.058 . . . . 2.53 109.508 -179.999 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' C' C ' 336' ' ' GLU . . . . . 0.469 ' HA ' ' OE1' ' C' ' 339' ' ' GLU . 0.0 OUTLIER -58.08 -62.05 2.1 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.189 -0.944 . . . . 2.62 109.773 -179.781 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild core ' C' C ' 337' ' ' ARG . . . . . 0.551 ' HG2' ' NH1' ' C' ' 337' ' ' ARG . 0.1 OUTLIER -59.85 -30.88 69.26 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.235 -0.916 . . . . 2.81 109.843 -179.672 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild core ' C' C ' 338' ' ' PHE . . . . . . . . . . . . . 72.4 t80 -55.53 -54.87 38.59 Favored 'General case' 0 N--CA 1.488 1.457 0 O-C-N 121.158 -0.963 . . . . 0.4 109.681 -179.911 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' C' C ' 339' ' ' GLU . . . . . 0.469 ' OE1' ' HA ' ' C' ' 336' ' ' GLU . 3.0 mt-10 -52.58 -39.24 61.37 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.204 -0.935 . . . . 2.05 110.325 -179.582 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' C' C ' 340' ' ' MET . . . . . . . . . . . . . 36.3 ttp -62.35 -46.25 89.53 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.157 -0.965 . . . . 0.32 110.0 -179.334 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' C' C ' 341' ' ' PHE . . . . . 0.415 ' CD2' HD13 ' C' ' 332' ' ' ILE . 32.7 m-85 -63.14 -43.22 98.95 Favored 'General case' 0 N--CA 1.489 1.5 0 O-C-N 121.174 -0.954 . . . . 0.18 110.021 -179.609 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' C' C ' 342' ' ' ARG . . . . . . . . . . . . . 39.7 ttt180 -51.96 -42.92 63.26 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.216 -0.927 . . . . 2.91 110.028 -179.773 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' C' C ' 343' ' ' GLU . . . . . . . . . . . . . 2.5 tt0 -57.32 -48.27 79.4 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.145 -0.972 . . . . 2.14 109.461 -179.649 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' C' C ' 344' ' ' LEU . . . . . 0.471 ' CD2' HD22 ' D' ' 344' ' ' LEU . 37.0 mt -62.96 -30.55 71.66 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.205 -0.935 . . . . 0.22 109.357 179.866 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' C' C ' 345' ' ' ASN . . . . . 0.444 ' O ' ' HG3' ' C' ' 349' ' ' GLU . 18.1 t-20 -59.07 -61.35 2.7 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.311 -0.868 . . . . 1.08 109.687 -179.829 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' C' C ' 346' ' ' GLU . . . . . . . . . . . . . 17.0 tp10 -61.22 -25.69 67.23 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.317 -0.864 . . . . 2.21 109.866 -179.608 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' C' C ' 347' ' ' ALA . . . . . 0.982 ' HB1' ' HB1' ' D' ' 347' ' ' ALA . . . -61.39 -58.34 8.6 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.215 -0.928 . . . . 0.18 109.987 -179.697 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' C' C ' 348' ' ' LEU . . . . . 0.535 HD22 ' N ' ' C' ' 348' ' ' LEU . 3.8 mm? -62.4 -44.39 96.56 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.208 -0.932 . . . . 0.32 110.147 -179.288 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' C' C ' 349' ' ' GLU . . . . . 0.444 ' HG3' ' O ' ' C' ' 345' ' ' ASN . 22.0 mt-10 -56.08 -38.6 70.91 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.141 -0.974 . . . . 2.19 109.887 -179.32 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' C' C ' 350' ' ' LEU . . . . . 0.689 HD22 HD13 ' D' ' 350' ' ' LEU . 6.1 tt -62.78 -40.37 97.11 Favored 'General case' 0 N--CA 1.489 1.493 0 O-C-N 121.156 -0.965 . . . . 0.46 109.537 -179.739 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' C' C ' 351' ' ' LYS . . . . . . . . . . . . . 11.3 tttt -60.19 -39.98 88.4 Favored 'General case' 0 N--CA 1.489 1.482 0 O-C-N 121.235 -0.915 . . . . 1.35 109.585 179.999 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' C' C ' 352' ' ' ASP . . . . . 0.456 ' OD1' ' N ' ' C' ' 352' ' ' ASP . 4.6 m-20 -59.25 -42.36 90.95 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.249 -0.907 . . . . 1.19 109.763 -179.99 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' C' C ' 353' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 1.651 0 O-C-N 121.251 -0.906 . . . . 0.57 110.081 -179.358 . . . . . . . . 0 0 . 1 . 022 nuclear nobuild core ' D' D ' 326' ' ' GLU . . . . . . . . . . . . . 6.9 mt-10 . . . . . 0 N--CA 1.491 1.578 0 N-CA-C 109.485 -0.561 . . . . 2.13 109.485 . . . . . . . . . 0 0 . 1 . 022 nuclear nobuild core ' D' D ' 327' ' ' TYR . . . . . . . . . . . . . 44.5 m-85 -150.0 112.45 4.71 Favored 'General case' 0 N--CA 1.489 1.485 0 O-C-N 121.23 -0.919 . . . . 0.47 109.737 -179.935 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' D' D ' 328' ' ' PHE . . . . . 0.524 ' HB2' ' CD1' ' B' ' 338' ' ' PHE . 75.3 m-85 -113.78 -173.55 2.3 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.377 -0.827 . . . . 0.3 109.173 179.673 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' D' D ' 329' ' ' THR . . . . . 0.41 HG23 ' C ' ' D' ' 328' ' ' PHE . 67.3 p -153.41 164.4 38.23 Favored 'General case' 0 N--CA 1.488 1.445 0 O-C-N 121.249 -0.907 . . . . 0.22 109.28 179.987 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' D' D ' 330' ' ' LEU . . . . . . . . . . . . . 15.4 tp -150.04 125.96 10.5 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.218 -0.926 . . . . 0.28 109.551 -179.837 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' D' D ' 331' ' ' GLN . . . . . . . . . . . . . 1.5 tt0 -87.24 114.7 24.08 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.367 -0.833 . . . . 0.93 109.327 179.799 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' D' D ' 332' ' ' ILE . . . . . 0.506 HG21 ' HA ' ' D' ' 338' ' ' PHE . 58.2 mt -103.3 104.55 16.82 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.514 0 O-C-N 121.089 -1.007 . . . . 0.25 109.741 -179.912 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' D' D ' 333' ' ' ARG . . . . . . . . . . . . . 10.4 mtm180 -72.34 138.67 47.46 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.176 -0.953 . . . . 2.93 109.243 179.728 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' D' D ' 334' ' ' GLY . . . . . . . . . . . . . . . 92.93 131.1 5.63 Favored Glycine 0 N--CA 1.49 2.3 0 N-CA-C 109.482 -1.447 . . . . 0.41 109.482 -179.78 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' D' D ' 335' ' ' ARG . . . . . 0.441 ' HA ' ' CE1' ' B' ' 328' ' ' PHE . 2.0 ttt180 -77.33 -33.15 55.55 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.225 -1.162 . . . . 3.03 109.675 -179.858 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' D' D ' 336' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -58.13 -61.13 2.78 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.129 -0.982 . . . . 2.26 109.722 -179.79 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' D' D ' 337' ' ' ARG . . . . . . . . . . . . . 5.4 mtt180 -60.97 -34.11 74.25 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.296 -0.878 . . . . 2.92 109.61 -179.812 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' D' D ' 338' ' ' PHE . . . . . 0.506 ' HA ' HG21 ' D' ' 332' ' ' ILE . 80.3 t80 -54.3 -60.41 3.37 Favored 'General case' 0 N--CA 1.488 1.453 0 O-C-N 121.221 -0.925 . . . . 0.37 109.725 -179.777 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' D' D ' 339' ' ' GLU . . . . . . . . . . . . . 94.2 mt-10 -51.15 -33.47 27.06 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.3 -0.875 . . . . 1.99 110.039 -179.673 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' D' D ' 340' ' ' MET . . . . . . . . . . . . . 33.1 ttp -64.45 -50.76 66.26 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.082 -1.011 . . . . 0.31 109.931 -179.587 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' D' D ' 341' ' ' PHE . . . . . . . . . . . . . 36.9 m-85 -61.56 -47.23 86.47 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.168 -0.957 . . . . 0.18 109.868 -179.525 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' D' D ' 342' ' ' ARG . . . . . . . . . . . . . 1.5 ttt180 -49.92 -39.49 40.33 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.157 -0.964 . . . . 2.41 109.558 -179.902 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' D' D ' 343' ' ' GLU . . . . . . . . . . . . . 2.8 tt0 -58.28 -49.8 75.87 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.294 -0.879 . . . . 2.35 109.398 -179.998 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' D' D ' 344' ' ' LEU . . . . . 0.471 HD22 ' CD2' ' C' ' 344' ' ' LEU . 75.9 mt -62.25 -29.5 70.44 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.184 -0.948 . . . . 0.19 109.293 179.761 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' D' D ' 345' ' ' ASN . . . . . . . . . . . . . 11.3 t-20 -58.0 -54.37 47.72 Favored 'General case' 0 C--N 1.303 -1.414 0 O-C-N 121.398 -0.813 . . . . 1.09 109.45 179.968 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' D' D ' 346' ' ' GLU . . . . . . . . . . . . . 1.2 tt0 -61.81 -29.06 69.9 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.308 -0.87 . . . . 1.69 109.827 -179.857 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' D' D ' 347' ' ' ALA . . . . . 0.982 ' HB1' ' HB1' ' C' ' 347' ' ' ALA . . . -61.73 -62.01 2.11 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.201 -0.937 . . . . 0.18 110.122 -179.66 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' D' D ' 348' ' ' LEU . . . . . 0.547 HD22 ' N ' ' D' ' 348' ' ' LEU . 3.9 mm? -61.52 -44.71 96.57 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.159 -0.963 . . . . 0.31 110.119 -179.394 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' D' D ' 349' ' ' GLU . . . . . . . . . . . . . 3.1 mt-10 -56.64 -35.54 68.46 Favored 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.13 -0.982 . . . . 1.95 109.859 -179.507 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' D' D ' 350' ' ' LEU . . . . . 0.689 HD13 HD22 ' C' ' 350' ' ' LEU . 6.0 tt -65.02 -45.75 84.17 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.154 -0.966 . . . . 0.43 109.576 -179.865 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' D' D ' 351' ' ' LYS . . . . . . . . . . . . . 21.8 tttt -59.03 -41.09 86.96 Favored 'General case' 0 C--N 1.304 -1.404 0 O-C-N 121.258 -0.901 . . . . 1.4 109.381 -179.877 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' D' D ' 352' ' ' ASP . . . . . . . . . . . . . 11.7 m-20 -56.38 -50.47 71.46 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.328 -0.858 . . . . 1.17 109.484 179.886 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' D' D ' 353' ' ' ALA . . . . . . . . . . . . . . . -68.68 -15.4 63.51 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.232 -0.918 . . . . 0.59 109.543 -179.953 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' D' D ' 354' ' ' GLN . . . . . 0.453 ' NE2' HD11 ' C' ' 350' ' ' LEU . 0.0 OUTLIER . . . . . 0 N--CA 1.49 1.564 0 O-C-N 121.154 -0.966 . . . . 1.44 109.52 -179.991 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 326' ' ' GLU . . . . . . . . . . . . . 59.2 mm-40 . . . . . 0 N--CA 1.488 1.475 0 N-CA-C 108.945 -0.761 . . . . 2.13 108.945 . . . . . . . . . 0 0 . 1 . 023 nuclear nobuild core ' A' A ' 327' ' ' TYR . . . . . 0.507 ' CE2' ' HG2' ' C' ' 333' ' ' ARG . 38.4 m-85 -148.64 105.36 3.57 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.169 -0.957 . . . . 0.48 109.634 179.697 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 328' ' ' PHE . . . . . . . . . . . . . 98.2 m-85 -107.33 -166.92 1.2 Allowed 'General case' 0 C--N 1.303 -1.445 0 N-CA-C 108.851 -0.796 . . . . 0.31 108.851 179.68 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 329' ' ' THR . . . . . . . . . . . . . 68.1 p -151.07 164.71 35.82 Favored 'General case' 0 C--N 1.301 -1.517 0 O-C-N 121.139 -0.976 . . . . 0.22 109.27 -179.984 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 330' ' ' LEU . . . . . . . . . . . . . 16.1 tp -148.76 131.77 16.25 Favored 'General case' 0 C--N 1.302 -1.474 0 O-C-N 121.236 -0.915 . . . . 0.28 109.377 -179.635 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 331' ' ' GLN . . . . . . . . . . . . . 1.6 tp60 -85.87 113.97 22.43 Favored 'General case' 0 N--CA 1.488 1.464 0 O-C-N 121.388 -0.82 . . . . 0.91 109.151 179.955 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 332' ' ' ILE . . . . . 0.651 HG21 ' HA ' ' A' ' 338' ' ' PHE . 53.9 mt -102.83 102.23 13.31 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.497 0 O-C-N 121.295 -0.878 . . . . 0.26 109.38 -179.827 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 333' ' ' ARG . . . . . . . . . . . . . 79.9 mtt180 -72.18 154.64 40.93 Favored 'General case' 0 N--CA 1.489 1.479 0 O-C-N 121.343 -0.848 . . . . 2.92 109.37 179.992 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 334' ' ' GLY . . . . . . . . . . . . . . . 80.07 134.24 1.23 Allowed Glycine 0 N--CA 1.491 2.339 0 N-CA-C 109.598 -1.401 . . . . 0.4 109.598 -179.86 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 335' ' ' ARG . . . . . 0.51 ' NH1' ' HG2' ' A' ' 335' ' ' ARG . 1.3 ttt-85 -79.93 -50.58 10.24 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.271 -1.135 . . . . 3.01 109.83 -179.782 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 336' ' ' GLU . . . . . . . . . . . . . 1.4 pt-20 -55.61 -48.29 75.13 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.179 -0.95 . . . . 2.29 109.611 -179.689 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 337' ' ' ARG . . . . . 0.442 ' NH1' ' CG ' ' A' ' 337' ' ' ARG . 0.0 OUTLIER -60.1 -35.08 74.44 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.209 -0.932 . . . . 2.93 109.474 179.97 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild core ' A' A ' 338' ' ' PHE . . . . . 0.651 ' HA ' HG21 ' A' ' 332' ' ' ILE . 61.9 t80 -55.64 -55.69 29.19 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.321 -0.862 . . . . 0.38 109.531 179.998 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 339' ' ' GLU . . . . . . . . . . . . . 3.6 mm-40 -51.03 -32.68 22.34 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.339 -0.851 . . . . 1.97 110.118 -179.547 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 340' ' ' MET . . . . . . . . . . . . . 19.5 ttp -64.36 -52.92 55.95 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.151 -0.968 . . . . 0.31 110.198 -179.425 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 341' ' ' PHE . . . . . . . . . . . . . 39.8 m-85 -62.46 -46.08 90.14 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.195 -0.941 . . . . 0.18 110.208 -179.274 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 342' ' ' ARG . . . . . . . . . . . . . 10.0 ttp180 -48.51 -41.19 29.24 Favored 'General case' 0 N--CA 1.491 1.625 0 O-C-N 121.061 -1.025 . . . . 2.42 109.813 -179.827 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 343' ' ' GLU . . . . . . . . . . . . . 9.1 tp10 -59.31 -45.46 91.23 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.259 -0.901 . . . . 2.35 109.967 -179.709 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 344' ' ' LEU . . . . . 0.404 ' O ' HD23 ' A' ' 348' ' ' LEU . 53.1 mt -62.77 -44.64 95.66 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.256 -0.903 . . . . 0.18 110.024 -179.704 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 345' ' ' ASN . . . . . 0.425 HD22 HD11 ' C' ' 330' ' ' LEU . 54.7 t-20 -55.38 -49.52 72.12 Favored 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.172 -0.955 . . . . 1.09 109.872 -179.823 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 346' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -61.06 -36.16 78.86 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.243 -0.91 . . . . 1.65 109.585 -179.812 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 347' ' ' ALA . . . . . 0.872 ' HB1' ' HB1' ' B' ' 347' ' ' ALA . . . -60.14 -50.06 75.19 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.235 -0.915 . . . . 0.18 109.962 -179.806 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 348' ' ' LEU . . . . . 0.55 HD12 ' NH2' ' C' ' 337' ' ' ARG . 3.6 mm? -62.24 -48.95 77.67 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.124 -0.985 . . . . 0.3 109.87 -179.63 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 349' ' ' GLU . . . . . . . . . . . . . 76.3 mt-10 -55.53 -35.41 65.63 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.162 -0.961 . . . . 1.94 109.7 -179.479 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 350' ' ' LEU . . . . . 0.783 HD13 HD22 ' B' ' 350' ' ' LEU . 5.6 tt -62.91 -45.3 93.17 Favored 'General case' 0 N--CA 1.488 1.472 0 O-C-N 121.266 -0.896 . . . . 0.46 109.216 179.843 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 351' ' ' LYS . . . . . . . . . . . . . 19.1 tttm -56.37 -38.66 71.74 Favored 'General case' 0 N--CA 1.488 1.469 0 O-C-N 121.365 -0.834 . . . . 1.4 109.481 179.982 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 352' ' ' ASP . . . . . . . . . . . . . 4.7 m-20 -55.61 -45.97 77.39 Favored 'General case' 0 N--CA 1.489 1.495 0 O-C-N 121.223 -0.923 . . . . 1.16 109.429 179.784 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 353' ' ' ALA . . . . . . . . . . . . . . . -67.98 -28.26 67.28 Favored 'General case' 0 N--CA 1.489 1.494 0 O-C-N 121.309 -0.869 . . . . 0.63 109.172 179.734 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 354' ' ' GLN . . . . . . . . . . . . . 3.2 tt0 . . . . . 0 N--CA 1.49 1.541 0 O-C-N 121.321 -0.862 . . . . 1.47 109.471 179.756 . . . . . . . . 0 0 . 1 . 023 nuclear nobuild core ' B' B ' 326' ' ' GLU . . . . . . . . . . . . . 60.4 mm-40 . . . . . 0 N--CA 1.487 1.38 0 N-CA-C 108.96 -0.756 . . . . 2.13 108.96 . . . . . . . . . 0 0 . 1 . 023 nuclear nobuild core ' B' B ' 327' ' ' TYR . . . . . 0.442 ' CE2' ' HG2' ' D' ' 333' ' ' ARG . 39.2 m-85 -148.35 105.4 3.61 Favored 'General case' 0 C--N 1.301 -1.517 0 O-C-N 121.156 -0.965 . . . . 0.48 109.614 179.846 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' B' B ' 328' ' ' PHE . . . . . . . . . . . . . 98.2 m-85 -107.54 -166.91 1.19 Allowed 'General case' 0 N--CA 1.488 1.455 0 N-CA-C 108.772 -0.825 . . . . 0.32 108.772 179.752 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' B' B ' 329' ' ' THR . . . . . . . . . . . . . 69.7 p -151.04 164.89 35.39 Favored 'General case' 0 C--N 1.301 -1.52 0 O-C-N 121.151 -0.968 . . . . 0.23 109.235 -179.988 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' B' B ' 330' ' ' LEU . . . . . 0.573 HD11 HD22 ' D' ' 345' ' ' ASN . 15.7 tp -148.95 131.6 15.9 Favored 'General case' 0 C--N 1.303 -1.445 0 O-C-N 121.189 -0.945 . . . . 0.28 109.386 -179.689 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' B' B ' 331' ' ' GLN . . . . . . . . . . . . . 1.6 tp60 -85.62 113.87 22.17 Favored 'General case' 0 C--N 1.303 -1.432 0 O-C-N 121.347 -0.845 . . . . 0.91 109.203 179.943 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' B' B ' 332' ' ' ILE . . . . . 0.661 HG21 ' HA ' ' B' ' 338' ' ' PHE . 52.4 mt -102.68 102.57 13.78 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.484 0 O-C-N 121.172 -0.955 . . . . 0.24 109.44 -179.967 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' B' B ' 333' ' ' ARG . . . . . . . . . . . . . 80.2 mtt180 -72.39 154.71 40.76 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.458 -0.776 . . . . 2.93 109.434 -179.911 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' B' B ' 334' ' ' GLY . . . . . . . . . . . . . . . 79.85 134.54 1.21 Allowed Glycine 0 N--CA 1.491 2.316 0 N-CA-C 109.437 -1.465 . . . . 0.4 109.437 -179.899 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' B' B ' 335' ' ' ARG . . . . . 0.511 ' HG2' ' NH1' ' B' ' 335' ' ' ARG . 1.4 ttt-85 -80.15 -50.37 10.38 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.287 -1.125 . . . . 3.01 109.868 -179.866 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' B' B ' 336' ' ' GLU . . . . . . . . . . . . . 1.3 pt-20 -55.54 -48.12 75.23 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.218 -0.926 . . . . 2.28 109.644 -179.715 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' B' B ' 337' ' ' ARG . . . . . 0.441 ' CG ' ' NH1' ' B' ' 337' ' ' ARG . 0.0 OUTLIER -60.27 -35.22 75.03 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.199 -0.938 . . . . 2.93 109.453 179.966 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild core ' B' B ' 338' ' ' PHE . . . . . 0.661 ' HA ' HG21 ' B' ' 332' ' ' ILE . 62.3 t80 -55.55 -55.95 25.96 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.246 -0.909 . . . . 0.37 109.563 -179.998 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' B' B ' 339' ' ' GLU . . . . . . . . . . . . . 3.5 mm-40 -50.92 -32.37 20.49 Favored 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.233 -0.917 . . . . 1.98 110.113 -179.6 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' B' B ' 340' ' ' MET . . . . . . . . . . . . . 19.4 ttp -64.56 -52.97 54.88 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.146 -0.972 . . . . 0.32 110.155 -179.457 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' B' B ' 341' ' ' PHE . . . . . . . . . . . . . 40.1 m-85 -62.56 -46.07 90.01 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.166 -0.959 . . . . 0.18 110.254 -179.246 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' B' B ' 342' ' ' ARG . . . . . . . . . . . . . 10.1 ttp180 -48.46 -41.13 28.64 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.046 -1.034 . . . . 2.42 109.771 -179.752 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' B' B ' 343' ' ' GLU . . . . . . . . . . . . . 9.2 tp10 -59.35 -45.55 91.09 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.238 -0.914 . . . . 2.35 109.908 -179.668 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' B' B ' 344' ' ' LEU . . . . . . . . . . . . . 49.2 mt -62.91 -44.57 95.72 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.288 -0.883 . . . . 0.18 109.968 -179.607 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' B' B ' 345' ' ' ASN . . . . . 0.498 HD22 HD11 ' D' ' 330' ' ' LEU . 55.7 t-20 -55.4 -49.68 71.75 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.22 -0.925 . . . . 1.09 109.685 -179.704 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' B' B ' 346' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -60.81 -36.16 78.34 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.215 -0.928 . . . . 1.66 109.599 -179.773 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' B' B ' 347' ' ' ALA . . . . . 0.872 ' HB1' ' HB1' ' A' ' 347' ' ' ALA . . . -60.34 -49.92 75.68 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.153 -0.967 . . . . 0.17 109.926 -179.816 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' B' B ' 348' ' ' LEU . . . . . 0.525 HD22 ' N ' ' B' ' 348' ' ' LEU . 3.7 mm? -62.25 -49.04 77.28 Favored 'General case' 0 N--CA 1.493 1.692 0 O-C-N 121.182 -0.949 . . . . 0.29 109.834 -179.67 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' B' B ' 349' ' ' GLU . . . . . . . . . . . . . 77.5 mt-10 -55.43 -35.58 65.57 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.251 -0.906 . . . . 1.95 109.642 -179.479 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' B' B ' 350' ' ' LEU . . . . . 0.783 HD22 HD13 ' A' ' 350' ' ' LEU . 5.7 tt -62.88 -45.18 93.76 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.255 -0.903 . . . . 0.45 109.247 179.905 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' B' B ' 351' ' ' LYS . . . . . . . . . . . . . 19.2 tttm -56.38 -38.64 71.73 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.309 -0.869 . . . . 1.38 109.412 179.922 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' B' B ' 352' ' ' ASP . . . . . . . . . . . . . 4.9 m-20 -55.6 -46.03 77.36 Favored 'General case' 0 N--CA 1.489 1.482 0 O-C-N 121.211 -0.931 . . . . 1.16 109.38 179.866 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' B' B ' 353' ' ' ALA . . . . . . . . . . . . . . . -67.96 -27.88 66.97 Favored 'General case' 0 N--CA 1.489 1.497 0 O-C-N 121.251 -0.906 . . . . 0.61 109.179 179.684 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' B' B ' 354' ' ' GLN . . . . . . . . . . . . . 3.1 tt0 . . . . . 0 N--CA 1.489 1.518 0 O-C-N 121.343 -0.848 . . . . 1.45 109.466 179.747 . . . . . . . . 0 0 . 1 . 023 nuclear nobuild core ' C' C ' 326' ' ' GLU . . . . . . . . . . . . . 2.3 mp0 . . . . . 0 N--CA 1.489 1.491 0 N-CA-C 109.057 -0.72 . . . . 2.17 109.057 . . . . . . . . . 0 0 . 1 . 023 nuclear nobuild core ' C' C ' 327' ' ' TYR . . . . . . . . . . . . . 38.7 m-85 -148.88 108.1 3.92 Favored 'General case' 0 C--N 1.302 -1.467 0 O-C-N 121.121 -0.987 . . . . 0.48 109.865 179.973 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' C' C ' 328' ' ' PHE . . . . . 0.417 ' CE1' ' HA ' ' A' ' 335' ' ' ARG . 88.8 m-85 -112.55 -166.71 1.1 Allowed 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.457 -0.777 . . . . 0.33 108.929 179.743 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' C' C ' 329' ' ' THR . . . . . . . . . . . . . 21.2 p -152.67 165.09 36.36 Favored 'General case' 0 N--CA 1.489 1.48 0 O-C-N 121.089 -1.007 . . . . 0.23 109.608 179.966 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' C' C ' 330' ' ' LEU . . . . . 0.425 HD11 HD22 ' A' ' 345' ' ' ASN . 51.5 tp -150.68 126.18 10.16 Favored 'General case' 0 N--CA 1.488 1.453 0 O-C-N 121.258 -0.901 . . . . 0.28 109.448 179.77 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' C' C ' 331' ' ' GLN . . . . . . . . . . . . . 4.4 tp-100 -86.74 117.37 25.45 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.325 -0.859 . . . . 1.48 109.3 179.883 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' C' C ' 332' ' ' ILE . . . . . 0.521 HD12 ' HD1' ' C' ' 338' ' ' PHE . 21.8 mt -103.49 110.12 28.99 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.554 0 O-C-N 121.119 -0.988 . . . . 0.24 109.684 179.949 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' C' C ' 333' ' ' ARG . . . . . 0.507 ' HG2' ' CE2' ' A' ' 327' ' ' TYR . 11.8 mtm180 -73.71 143.44 46.17 Favored 'General case' 0 N--CA 1.488 1.469 0 O-C-N 121.174 -0.954 . . . . 2.74 109.046 179.355 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' C' C ' 334' ' ' GLY . . . . . . . . . . . . . . . 90.16 134.67 5.71 Favored Glycine 0 N--CA 1.489 2.219 0 N-CA-C 109.618 -1.393 . . . . 0.35 109.618 179.931 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' C' C ' 335' ' ' ARG . . . . . 0.486 ' NH1' ' CG ' ' C' ' 335' ' ' ARG . 0.0 OUTLIER -79.49 -46.09 18.09 Favored 'General case' 0 N--CA 1.488 1.466 0 O-C-N 121.374 -1.074 . . . . 2.53 109.752 -179.939 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild core ' C' C ' 336' ' ' GLU . . . . . . . . . . . . . 3.8 mt-10 -57.34 -48.52 78.79 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.274 -0.891 . . . . 2.62 109.687 -179.747 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' C' C ' 337' ' ' ARG . . . . . 0.55 ' NH2' HD12 ' A' ' 348' ' ' LEU . 1.9 mtp180 -59.31 -34.93 72.91 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.36 -0.837 . . . . 2.81 109.788 -179.712 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' C' C ' 338' ' ' PHE . . . . . 0.521 ' HD1' HD12 ' C' ' 332' ' ' ILE . 51.4 t80 -55.81 -54.06 49.14 Favored 'General case' 0 N--CA 1.489 1.501 0 O-C-N 121.219 -0.926 . . . . 0.4 110.296 -179.65 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' C' C ' 339' ' ' GLU . . . . . . . . . . . . . 7.9 mt-10 -51.27 -34.71 34.04 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.186 -0.946 . . . . 2.05 110.705 -179.161 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' C' C ' 340' ' ' MET . . . . . . . . . . . . . 38.1 ttp -64.78 -55.02 22.28 Favored 'General case' 0 N--CA 1.493 1.722 0 O-C-N 120.962 -1.087 . . . . 0.32 110.626 -179.094 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' C' C ' 341' ' ' PHE . . . . . . . . . . . . . 49.3 m-85 -59.87 -44.8 93.98 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.143 -0.973 . . . . 0.18 110.126 -179.053 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' C' C ' 342' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -50.24 -42.86 52.52 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.164 -0.96 . . . . 2.91 110.27 -179.562 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' C' C ' 343' ' ' GLU . . . . . . . . . . . . . 1.8 tt0 -58.06 -48.93 78.64 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.154 -0.966 . . . . 2.14 110.072 -179.362 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' C' C ' 344' ' ' LEU . . . . . 0.45 ' O ' HD23 ' C' ' 348' ' ' LEU . 66.2 mt -61.79 -36.63 81.65 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.125 -0.984 . . . . 0.22 109.763 -179.714 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' C' C ' 345' ' ' ASN . . . . . . . . . . . . . 23.0 t-20 -57.89 -57.19 13.89 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.228 -0.92 . . . . 1.08 109.785 -179.814 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' C' C ' 346' ' ' GLU . . . . . . . . . . . . . 2.0 tm-20 -60.6 -29.3 69.13 Favored 'General case' 0 N--CA 1.489 1.525 0 O-C-N 121.291 -0.881 . . . . 2.21 109.752 -179.651 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' C' C ' 347' ' ' ALA . . . . . 0.757 ' HB1' ' HB1' ' D' ' 347' ' ' ALA . . . -62.08 -52.93 61.91 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.289 -0.882 . . . . 0.18 109.934 -179.864 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' C' C ' 348' ' ' LEU . . . . . 0.528 HD22 ' N ' ' C' ' 348' ' ' LEU . 3.8 mm? -61.26 -52.33 65.19 Favored 'General case' 0 N--CA 1.492 1.675 0 O-C-N 121.223 -0.923 . . . . 0.32 109.915 -179.487 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' C' C ' 349' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -56.57 -31.64 64.41 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.217 -0.927 . . . . 2.19 109.588 -179.568 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' C' C ' 350' ' ' LEU . . . . . 0.81 ' CD2' HD13 ' D' ' 350' ' ' LEU . 10.0 tt -64.92 -44.2 90.33 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.236 -0.915 . . . . 0.46 109.24 179.816 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' C' C ' 351' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -57.53 -40.84 79.67 Favored 'General case' 0 N--CA 1.488 1.47 0 O-C-N 121.466 -0.771 . . . . 1.35 109.128 179.878 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' C' C ' 352' ' ' ASP . . . . . . . . . . . . . 30.0 m-20 -57.56 -34.71 69.47 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.358 -0.839 . . . . 1.19 109.352 179.7 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' C' C ' 353' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 1.605 0 O-C-N 121.334 -0.854 . . . . 0.57 109.53 -179.857 . . . . . . . . 0 0 . 1 . 023 nuclear nobuild core ' D' D ' 326' ' ' GLU . . . . . . . . . . . . . 61.6 mm-40 . . . . . 0 N--CA 1.486 1.37 0 N-CA-C 108.87 -0.789 . . . . 2.13 108.87 . . . . . . . . . 0 0 . 1 . 023 nuclear nobuild core ' D' D ' 327' ' ' TYR . . . . . . . . . . . . . 38.7 m-85 -148.88 105.4 3.54 Favored 'General case' 0 C--N 1.301 -1.525 0 O-C-N 121.151 -0.968 . . . . 0.47 109.57 179.874 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' D' D ' 328' ' ' PHE . . . . . . . . . . . . . 98.1 m-85 -107.47 -166.92 1.2 Allowed 'General case' 0 C--N 1.302 -1.464 0 N-CA-C 108.953 -0.758 . . . . 0.3 108.953 179.815 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' D' D ' 329' ' ' THR . . . . . . . . . . . . . 66.8 p -151.24 164.54 36.36 Favored 'General case' 0 C--N 1.301 -1.539 0 O-C-N 121.204 -0.935 . . . . 0.22 109.212 -179.965 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' D' D ' 330' ' ' LEU . . . . . 0.498 HD11 HD22 ' B' ' 345' ' ' ASN . 15.8 tp -148.68 131.52 16.09 Favored 'General case' 0 C--N 1.302 -1.475 0 O-C-N 121.192 -0.943 . . . . 0.28 109.437 -179.557 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' D' D ' 331' ' ' GLN . . . . . . . . . . . . . 1.6 tp60 -85.43 114.22 22.31 Favored 'General case' 0 C--N 1.303 -1.429 0 O-C-N 121.338 -0.852 . . . . 0.93 109.167 179.868 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' D' D ' 332' ' ' ILE . . . . . 0.655 HG21 ' HA ' ' D' ' 338' ' ' PHE . 53.0 mt -102.98 102.52 13.73 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.513 0 O-C-N 121.272 -0.892 . . . . 0.25 109.38 -179.962 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' D' D ' 333' ' ' ARG . . . . . 0.442 ' HG2' ' CE2' ' B' ' 327' ' ' TYR . 80.5 mtt180 -72.46 154.88 40.63 Favored 'General case' 0 N--CA 1.489 1.477 0 O-C-N 121.256 -0.903 . . . . 2.93 109.517 -179.9 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' D' D ' 334' ' ' GLY . . . . . . . . . . . . . . . 79.6 134.57 1.14 Allowed Glycine 0 N--CA 1.49 2.262 0 N-CA-C 109.512 -1.435 . . . . 0.41 109.512 -179.918 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' D' D ' 335' ' ' ARG . . . . . 0.52 ' HG2' ' NH1' ' D' ' 335' ' ' ARG . 1.4 ttt-85 -80.0 -50.4 10.45 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.208 -1.172 . . . . 3.03 109.79 -179.731 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' D' D ' 336' ' ' GLU . . . . . . . . . . . . . 1.2 pt-20 -55.38 -48.11 74.81 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.178 -0.951 . . . . 2.26 109.631 -179.618 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' D' D ' 337' ' ' ARG . . . . . 0.457 HH11 ' CG ' ' D' ' 337' ' ' ARG . 0.0 OUTLIER -60.41 -34.98 74.72 Favored 'General case' 0 N--CA 1.489 1.488 0 O-C-N 121.137 -0.977 . . . . 2.92 109.507 179.914 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild core ' D' D ' 338' ' ' PHE . . . . . 0.655 ' HA ' HG21 ' D' ' 332' ' ' ILE . 62.5 t80 -55.55 -56.02 25.12 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.298 -0.876 . . . . 0.37 109.656 179.937 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' D' D ' 339' ' ' GLU . . . . . . . . . . . . . 3.4 mm-40 -51.02 -32.22 20.75 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.199 -0.938 . . . . 1.99 110.163 -179.643 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' D' D ' 340' ' ' MET . . . . . . . . . . . . . 19.3 ttp -64.45 -53.36 49.5 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.162 -0.961 . . . . 0.31 110.175 -179.433 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' D' D ' 341' ' ' PHE . . . . . . . . . . . . . 40.2 m-85 -62.47 -46.37 88.81 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.123 -0.986 . . . . 0.18 110.166 -179.188 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' D' D ' 342' ' ' ARG . . . . . . . . . . . . . 10.7 ttp180 -48.15 -41.13 25.9 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.08 -1.013 . . . . 2.41 109.787 -179.765 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' D' D ' 343' ' ' GLU . . . . . . . . . . . . . 9.3 tp10 -59.25 -45.77 90.3 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.292 -0.88 . . . . 2.35 109.933 -179.697 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' D' D ' 344' ' ' LEU . . . . . 0.43 HD22 HD22 ' C' ' 344' ' ' LEU . 46.3 mt -62.76 -44.56 95.88 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.164 -0.96 . . . . 0.19 110.013 -179.639 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' D' D ' 345' ' ' ASN . . . . . 0.573 HD22 HD11 ' B' ' 330' ' ' LEU . 56.5 t-20 -55.37 -49.45 72.25 Favored 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.204 -0.935 . . . . 1.09 109.64 -179.643 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' D' D ' 346' ' ' GLU . . . . . . . . . . . . . 1.1 tt0 -61.15 -35.92 78.38 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.236 -0.915 . . . . 1.69 109.652 -179.878 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' D' D ' 347' ' ' ALA . . . . . 0.757 ' HB1' ' HB1' ' C' ' 347' ' ' ALA . . . -60.25 -50.25 74.38 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.182 -0.949 . . . . 0.18 109.89 -179.892 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' D' D ' 348' ' ' LEU . . . . . 0.529 HD22 ' N ' ' D' ' 348' ' ' LEU . 3.7 mm? -62.04 -48.96 77.94 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.146 -0.971 . . . . 0.31 109.889 -179.685 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' D' D ' 349' ' ' GLU . . . . . . . . . . . . . 77.2 mt-10 -55.64 -35.04 65.49 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.114 -0.991 . . . . 1.95 109.81 -179.538 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' D' D ' 350' ' ' LEU . . . . . 0.81 HD13 ' CD2' ' C' ' 350' ' ' LEU . 5.8 tt -63.38 -44.47 94.65 Favored 'General case' 0 N--CA 1.489 1.479 0 O-C-N 121.267 -0.895 . . . . 0.43 109.233 179.943 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' D' D ' 351' ' ' LYS . . . . . . . . . . . . . 19.2 tttm -57.16 -38.28 73.34 Favored 'General case' 0 N--CA 1.489 1.481 0 O-C-N 121.446 -0.784 . . . . 1.4 109.416 179.879 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' D' D ' 352' ' ' ASP . . . . . . . . . . . . . 5.2 m-20 -55.85 -45.9 78.33 Favored 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.242 -0.911 . . . . 1.17 109.355 179.696 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' D' D ' 353' ' ' ALA . . . . . . . . . . . . . . . -68.04 -27.94 66.96 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.201 -0.937 . . . . 0.59 109.179 179.67 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' D' D ' 354' ' ' GLN . . . . . 0.455 ' NE2' ' CD1' ' C' ' 350' ' ' LEU . 3.1 tt0 . . . . . 0 N--CA 1.49 1.564 0 O-C-N 121.392 -0.818 . . . . 1.44 109.49 179.791 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 326' ' ' GLU . . . . . . . . . . . . . 2.2 mm-40 . . . . . 0 N--CA 1.492 1.653 0 CA-C-O 121.31 0.576 . . . . 2.13 109.627 . . . . . . . . . 0 0 . 1 . 024 nuclear nobuild core ' A' A ' 327' ' ' TYR . . . . . 0.525 ' CE1' ' HG2' ' C' ' 333' ' ' ARG . 43.2 m-85 -149.83 112.18 4.69 Favored 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.297 -0.877 . . . . 0.48 109.737 179.889 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 328' ' ' PHE . . . . . 0.504 ' CE1' ' HA ' ' C' ' 335' ' ' ARG . 71.0 m-85 -113.93 -168.81 1.4 Allowed 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.252 -0.905 . . . . 0.31 109.187 179.69 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 329' ' ' THR . . . . . 0.403 HG23 ' O ' ' A' ' 328' ' ' PHE . 40.3 p -154.58 167.54 29.77 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.2 -0.938 . . . . 0.22 109.451 -179.992 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 330' ' ' LEU . . . . . . . . . . . . . 24.2 tp -150.37 131.42 14.36 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.254 -0.904 . . . . 0.28 109.477 -179.888 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 331' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -87.13 111.94 21.44 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.3 -0.875 . . . . 0.91 109.436 179.861 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 332' ' ' ILE . . . . . 0.534 HG21 ' HA ' ' A' ' 338' ' ' PHE . 97.0 mt -103.56 104.03 16.07 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.592 0 O-C-N 121.232 -0.918 . . . . 0.26 109.529 -179.986 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 333' ' ' ARG . . . . . 0.596 ' HG2' ' CE2' ' C' ' 327' ' ' TYR . 13.3 mtp180 -72.53 149.99 43.59 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.259 -0.9 . . . . 2.92 109.479 179.868 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 334' ' ' GLY . . . . . . . . . . . . . . . 86.37 131.14 2.86 Favored Glycine 0 N--CA 1.493 2.438 0 N-CA-C 109.84 -1.304 . . . . 0.4 109.84 179.606 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 335' ' ' ARG . . . . . 0.457 ' O ' ' HB3' ' A' ' 338' ' ' PHE . 0.0 OUTLIER -80.26 -39.07 29.66 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.33 -1.1 . . . . 3.01 109.586 179.874 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild core ' A' A ' 336' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -57.99 -61.74 2.32 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.17 -0.956 . . . . 2.29 110.106 -179.561 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 337' ' ' ARG . . . . . 0.497 ' NE ' HD12 ' C' ' 348' ' ' LEU . 0.0 OUTLIER -59.96 -26.37 65.94 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.137 -0.977 . . . . 2.93 109.788 -179.509 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild core ' A' A ' 338' ' ' PHE . . . . . 0.534 ' HA ' HG21 ' A' ' 332' ' ' ILE . 50.8 t80 -55.67 -58.6 7.13 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.149 -0.969 . . . . 0.38 109.732 -179.869 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 339' ' ' GLU . . . . . . . . . . . . . 55.9 mt-10 -50.71 -32.94 20.97 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.269 -0.894 . . . . 1.97 109.876 -179.653 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 340' ' ' MET . . . . . . . . . . . . . 23.0 ttp -63.56 -51.19 66.44 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.107 -0.996 . . . . 0.31 110.044 -179.509 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 341' ' ' PHE . . . . . 0.434 ' HB2' HD13 ' A' ' 332' ' ' ILE . 36.7 m-85 -62.0 -45.84 91.85 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.166 -0.959 . . . . 0.18 110.081 -179.557 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 342' ' ' ARG . . . . . 0.473 ' NH1' ' HG3' ' A' ' 342' ' ' ARG . 0.0 OUTLIER -49.58 -42.55 44.78 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.14 -0.975 . . . . 2.42 110.047 -179.499 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild core ' A' A ' 343' ' ' GLU . . . . . . . . . . . . . 1.6 tt0 -58.61 -47.93 82.69 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.099 -1.0 . . . . 2.35 109.817 -179.57 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 344' ' ' LEU . . . . . 0.592 ' CD2' HD22 ' B' ' 344' ' ' LEU . 50.3 mt -61.39 -33.28 73.4 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.163 -0.961 . . . . 0.18 109.536 -179.794 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 345' ' ' ASN . . . . . . . . . . . . . 21.6 t-20 -57.82 -59.25 5.52 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.249 -0.907 . . . . 1.09 109.807 -179.944 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 346' ' ' GLU . . . . . . . . . . . . . 72.4 tt0 -62.16 -28.19 69.48 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.284 -0.885 . . . . 1.65 110.136 -179.592 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 347' ' ' ALA . . . . . 0.769 ' HB1' ' HB1' ' B' ' 347' ' ' ALA . . . -60.71 -56.91 15.64 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.11 -0.994 . . . . 0.18 110.006 -179.64 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 348' ' ' LEU . . . . . 0.539 HD22 ' N ' ' A' ' 348' ' ' LEU . 4.0 mm? -61.92 -46.49 89.13 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.13 -0.981 . . . . 0.3 110.134 -179.56 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 349' ' ' GLU . . . . . . . . . . . . . 33.3 mm-40 -57.17 -33.22 67.21 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.196 -0.94 . . . . 1.94 109.973 -179.452 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 350' ' ' LEU . . . . . 0.782 HD13 HD22 ' B' ' 350' ' ' LEU . 5.8 tt -64.66 -48.54 74.4 Favored 'General case' 0 N--CA 1.489 1.482 0 O-C-N 121.133 -0.98 . . . . 0.46 109.516 -179.883 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 351' ' ' LYS . . . . . . . . . . . . . 22.1 tttm -58.1 -39.57 78.98 Favored 'General case' 0 N--CA 1.488 1.469 0 O-C-N 121.343 -0.848 . . . . 1.4 109.413 -179.916 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 352' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -57.82 -52.5 65.21 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.295 -0.878 . . . . 1.16 109.856 179.975 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 353' ' ' ALA . . . . . . . . . . . . . . . -66.47 -10.01 40.04 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.26 -0.9 . . . . 0.63 109.823 -179.547 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 354' ' ' GLN . . . . . . . . . . . . . 2.5 tt0 . . . . . 0 N--CA 1.49 1.548 0 O-C-N 121.132 -0.98 . . . . 1.47 109.692 -179.98 . . . . . . . . 0 0 . 1 . 024 nuclear nobuild core ' B' B ' 326' ' ' GLU . . . . . . . . . . . . . 2.2 mm-40 . . . . . 0 N--CA 1.492 1.628 0 CA-C-O 121.357 0.599 . . . . 2.13 109.696 . . . . . . . . . 0 0 . 1 . 024 nuclear nobuild core ' B' B ' 327' ' ' TYR . . . . . 0.597 ' CE1' ' HG2' ' D' ' 333' ' ' ARG . 42.5 m-85 -149.93 112.11 4.64 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.298 -0.876 . . . . 0.48 109.755 179.977 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' B' B ' 328' ' ' PHE . . . . . 0.463 ' CE1' ' HA ' ' D' ' 335' ' ' ARG . 71.3 m-85 -113.81 -168.75 1.39 Allowed 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.242 -0.911 . . . . 0.32 109.252 179.754 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' B' B ' 329' ' ' THR . . . . . 0.405 HG23 ' O ' ' B' ' 328' ' ' PHE . 40.1 p -154.6 167.3 30.59 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.269 -0.894 . . . . 0.23 109.379 179.981 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' B' B ' 330' ' ' LEU . . . . . . . . . . . . . 24.2 tp -150.25 131.29 14.35 Favored 'General case' 0 N--CA 1.489 1.497 0 O-C-N 121.158 -0.964 . . . . 0.28 109.483 -179.867 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' B' B ' 331' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -87.02 111.95 21.37 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.3 -0.875 . . . . 0.91 109.428 179.927 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' B' B ' 332' ' ' ILE . . . . . 0.527 HG21 ' HA ' ' B' ' 338' ' ' PHE . 97.0 mt -103.51 103.88 15.83 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.534 0 O-C-N 121.226 -0.921 . . . . 0.24 109.602 179.937 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' B' B ' 333' ' ' ARG . . . . . 0.545 ' HG2' ' CE1' ' D' ' 327' ' ' TYR . 12.9 mtp180 -72.5 150.32 43.35 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.364 -0.835 . . . . 2.93 109.544 179.835 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' B' B ' 334' ' ' GLY . . . . . . . . . . . . . . . 86.07 131.0 2.71 Favored Glycine 0 N--CA 1.492 2.41 0 N-CA-C 109.812 -1.315 . . . . 0.4 109.812 179.679 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' B' B ' 335' ' ' ARG . . . . . 0.462 ' O ' ' HB3' ' B' ' 338' ' ' PHE . 0.0 OUTLIER -80.31 -38.85 29.87 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.301 -1.117 . . . . 3.01 109.625 179.905 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild core ' B' B ' 336' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -58.02 -61.83 2.26 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.21 -0.932 . . . . 2.28 110.056 -179.622 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' B' B ' 337' ' ' ARG . . . . . 0.481 ' HG2' ' NH1' ' B' ' 337' ' ' ARG . 0.0 OUTLIER -59.83 -26.55 65.88 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.067 -1.021 . . . . 2.93 109.818 -179.559 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild core ' B' B ' 338' ' ' PHE . . . . . 0.527 ' HA ' HG21 ' B' ' 332' ' ' ILE . 50.5 t80 -55.41 -58.85 6.06 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.11 -0.993 . . . . 0.37 109.692 -179.858 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' B' B ' 339' ' ' GLU . . . . . . . . . . . . . 56.8 mt-10 -50.62 -32.7 19.7 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.348 -0.845 . . . . 1.98 110.045 -179.666 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' B' B ' 340' ' ' MET . . . . . . . . . . . . . 23.9 ttp -63.79 -51.12 66.23 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.126 -0.983 . . . . 0.32 110.013 -179.54 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' B' B ' 341' ' ' PHE . . . . . 0.426 ' HB2' HD13 ' B' ' 332' ' ' ILE . 36.4 m-85 -62.09 -45.84 91.72 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.169 -0.957 . . . . 0.18 109.988 -179.569 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' B' B ' 342' ' ' ARG . . . . . 0.458 ' NH1' ' HG3' ' B' ' 342' ' ' ARG . 0.0 OUTLIER -49.59 -42.67 45.17 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.127 -0.983 . . . . 2.42 110.065 -179.578 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild core ' B' B ' 343' ' ' GLU . . . . . . . . . . . . . 1.6 tt0 -58.61 -47.95 82.64 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.072 -1.017 . . . . 2.35 109.856 -179.575 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' B' B ' 344' ' ' LEU . . . . . 0.592 HD22 ' CD2' ' A' ' 344' ' ' LEU . 50.4 mt -61.32 -33.24 73.28 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.155 -0.966 . . . . 0.18 109.544 -179.848 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' B' B ' 345' ' ' ASN . . . . . . . . . . . . . 21.5 t-20 -57.93 -59.28 5.5 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.225 -0.922 . . . . 1.09 109.731 -179.952 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' B' B ' 346' ' ' GLU . . . . . . . . . . . . . 71.8 tt0 -62.05 -28.53 69.66 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.267 -0.896 . . . . 1.66 110.076 -179.605 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' B' B ' 347' ' ' ALA . . . . . 0.769 ' HB1' ' HB1' ' A' ' 347' ' ' ALA . . . -60.42 -56.94 15.38 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.09 -1.006 . . . . 0.17 109.992 -179.567 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' B' B ' 348' ' ' LEU . . . . . 0.53 HD22 ' N ' ' B' ' 348' ' ' LEU . 4.0 mm? -61.95 -46.64 88.41 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.179 -0.95 . . . . 0.29 110.131 -179.491 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' B' B ' 349' ' ' GLU . . . . . . . . . . . . . 32.7 mm-40 -56.98 -33.26 66.93 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.133 -0.979 . . . . 1.95 110.092 -179.469 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' B' B ' 350' ' ' LEU . . . . . 0.782 HD22 HD13 ' A' ' 350' ' ' LEU . 5.8 tt -64.65 -48.42 74.86 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.17 -0.956 . . . . 0.45 109.48 -179.919 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' B' B ' 351' ' ' LYS . . . . . . . . . . . . . 22.2 tttm -58.27 -39.33 78.97 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.349 -0.844 . . . . 1.38 109.359 -179.907 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' B' B ' 352' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -58.01 -52.47 65.38 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.313 -0.867 . . . . 1.16 109.88 -179.984 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' B' B ' 353' ' ' ALA . . . . . . . . . . . . . . . -66.55 -9.94 40.09 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.298 -0.877 . . . . 0.61 109.847 -179.56 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' B' B ' 354' ' ' GLN . . . . . . . . . . . . . 2.5 tt0 . . . . . 0 N--CA 1.49 1.547 0 O-C-N 121.125 -0.984 . . . . 1.45 109.621 179.955 . . . . . . . . 0 0 . 1 . 024 nuclear nobuild core ' C' C ' 326' ' ' GLU . . . . . 0.421 ' O ' ' CD1' ' C' ' 327' ' ' TYR . 30.6 mm-40 . . . . . 0 N--CA 1.491 1.589 0 N-CA-C 109.402 -0.592 . . . . 2.17 109.402 . . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' C' C ' 327' ' ' TYR . . . . . 0.596 ' CE2' ' HG2' ' A' ' 333' ' ' ARG . 44.1 m-85 -149.36 114.31 5.41 Favored 'General case' 0 N--CA 1.488 1.437 0 O-C-N 121.254 -0.904 . . . . 0.48 109.819 -179.878 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' C' C ' 328' ' ' PHE . . . . . 0.44 ' CE2' ' HA ' ' A' ' 335' ' ' ARG . 86.5 m-85 -113.27 -173.54 2.28 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.316 -0.865 . . . . 0.33 109.132 179.595 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' C' C ' 329' ' ' THR . . . . . . . . . . . . . 22.6 p -152.38 165.2 35.74 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.12 -0.987 . . . . 0.23 109.664 -179.851 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' C' C ' 330' ' ' LEU . . . . . . . . . . . . . 14.4 tp -151.32 129.23 11.7 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.339 -0.851 . . . . 0.28 109.508 -179.853 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' C' C ' 331' ' ' GLN . . . . . 0.417 ' OE1' ' HB3' ' A' ' 327' ' ' TYR . 0.0 OUTLIER -89.13 116.56 27.48 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.174 -0.954 . . . . 1.48 109.837 -179.971 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild core ' C' C ' 332' ' ' ILE . . . . . 0.431 HD13 ' CD2' ' C' ' 341' ' ' PHE . 87.6 mt -104.06 112.36 37.3 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.621 0 O-C-N 121.201 -0.937 . . . . 0.24 109.555 179.661 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' C' C ' 333' ' ' ARG . . . . . 0.525 ' HG2' ' CE1' ' A' ' 327' ' ' TYR . 46.2 mtt180 -72.02 144.04 48.94 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.12 -0.988 . . . . 2.74 109.321 179.711 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' C' C ' 334' ' ' GLY . . . . . . . . . . . . . . . 89.15 128.34 3.27 Favored Glycine 0 N--CA 1.492 2.385 0 N-CA-C 109.48 -1.448 . . . . 0.35 109.48 -179.846 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' C' C ' 335' ' ' ARG . . . . . 0.504 ' HA ' ' CE1' ' A' ' 328' ' ' PHE . 37.1 ttp180 -78.98 -35.59 42.75 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.19 -1.183 . . . . 2.53 109.676 -179.88 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' C' C ' 336' ' ' GLU . . . . . . . . . . . . . 2.0 tt0 -57.0 -60.4 3.64 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.247 -0.908 . . . . 2.62 109.678 -179.808 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' C' C ' 337' ' ' ARG . . . . . 0.45 ' CG ' HH11 ' C' ' 337' ' ' ARG . 0.0 OUTLIER -59.51 -28.31 66.94 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.308 -0.87 . . . . 2.81 109.553 -179.811 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild core ' C' C ' 338' ' ' PHE . . . . . 0.467 ' HB3' ' O ' ' C' ' 335' ' ' ARG . 58.1 t80 -54.07 -55.37 28.14 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.249 -0.907 . . . . 0.4 109.352 -179.962 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' C' C ' 339' ' ' GLU . . . . . . . . . . . . . 41.5 mt-10 -52.42 -32.08 37.46 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.242 -0.911 . . . . 2.05 109.755 -179.997 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' C' C ' 340' ' ' MET . . . . . 0.436 ' HB3' ' O ' ' C' ' 337' ' ' ARG . 3.8 ttp -63.92 -55.03 25.62 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.227 -0.921 . . . . 0.32 110.285 -179.402 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' C' C ' 341' ' ' PHE . . . . . 0.431 ' CD2' HD13 ' C' ' 332' ' ' ILE . 48.5 m-85 -61.0 -46.16 91.9 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.167 -0.958 . . . . 0.18 109.701 -179.448 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' C' C ' 342' ' ' ARG . . . . . 0.404 ' CG ' HH11 ' C' ' 342' ' ' ARG . 0.2 OUTLIER -47.72 -41.47 22.96 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.287 -0.883 . . . . 2.91 109.278 179.761 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild core ' C' C ' 343' ' ' GLU . . . . . . . . . . . . . 43.3 tt0 -61.17 -48.74 80.18 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.245 -0.909 . . . . 2.14 109.951 -179.869 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' C' C ' 344' ' ' LEU . . . . . . . . . . . . . 35.4 mt -60.88 -30.14 69.97 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.135 -0.978 . . . . 0.22 109.828 -179.517 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' C' C ' 345' ' ' ASN . . . . . . . . . . . . . 25.8 t-20 -57.77 -58.31 8.91 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.261 -0.9 . . . . 1.08 109.488 179.879 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' C' C ' 346' ' ' GLU . . . . . 0.434 ' O ' ' HB2' ' C' ' 350' ' ' LEU . 20.1 tt0 -61.67 -25.63 67.51 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.301 -0.875 . . . . 2.21 109.922 -179.71 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' C' C ' 347' ' ' ALA . . . . . 0.469 ' O ' ' HB3' ' C' ' 350' ' ' LEU . . . -62.41 -55.62 26.07 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.106 -0.996 . . . . 0.18 109.715 -179.815 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' C' C ' 348' ' ' LEU . . . . . 0.622 HD22 ' N ' ' C' ' 348' ' ' LEU . 4.1 mm? -63.19 -55.91 21.11 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.131 -0.981 . . . . 0.32 109.969 -179.557 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' C' C ' 349' ' ' GLU . . . . . 0.426 ' OE2' ' HD3' ' A' ' 333' ' ' ARG . 41.6 mt-10 -56.61 -25.89 54.23 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.103 -0.998 . . . . 2.19 109.24 -179.782 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' C' C ' 350' ' ' LEU . . . . . 1.132 HD11 HD22 ' D' ' 350' ' ' LEU . 0.5 OUTLIER -65.62 -49.45 68.66 Favored 'General case' 0 C--N 1.301 -1.516 0 N-CA-C 108.811 -0.811 . . . . 0.46 108.811 179.813 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild core ' C' C ' 351' ' ' LYS . . . . . 0.546 ' N ' HD13 ' C' ' 350' ' ' LEU . 6.3 tttt -62.27 -41.95 98.92 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.291 -0.881 . . . . 1.35 109.298 179.319 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' C' C ' 352' ' ' ASP . . . . . . . . . . . . . 43.3 m-20 -56.06 -28.19 56.56 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.341 -0.849 . . . . 1.19 109.836 -179.867 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' C' C ' 353' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 1.638 0 O-C-N 121.227 -0.92 . . . . 0.57 109.78 -179.645 . . . . . . . . 0 0 . 1 . 024 nuclear nobuild core ' D' D ' 326' ' ' GLU . . . . . . . . . . . . . 2.2 mm-40 . . . . . 0 N--CA 1.491 1.601 0 CA-C-O 121.335 0.588 . . . . 2.13 109.551 . . . . . . . . . 0 0 . 1 . 024 nuclear nobuild core ' D' D ' 327' ' ' TYR . . . . . 0.545 ' CE1' ' HG2' ' B' ' 333' ' ' ARG . 43.0 m-85 -149.71 112.34 4.76 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.367 -0.833 . . . . 0.47 109.74 179.936 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' D' D ' 328' ' ' PHE . . . . . 0.404 ' O ' HG23 ' D' ' 329' ' ' THR . 71.8 m-85 -113.94 -168.68 1.39 Allowed 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.277 -0.889 . . . . 0.3 109.201 179.737 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' D' D ' 329' ' ' THR . . . . . 0.404 HG23 ' O ' ' D' ' 328' ' ' PHE . 39.5 p -154.59 167.34 30.43 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.19 -0.944 . . . . 0.22 109.41 179.987 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' D' D ' 330' ' ' LEU . . . . . . . . . . . . . 24.6 tp -150.24 131.36 14.43 Favored 'General case' 0 N--CA 1.488 1.472 0 O-C-N 121.239 -0.913 . . . . 0.28 109.512 -179.878 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' D' D ' 331' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -87.13 111.85 21.35 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.351 -0.843 . . . . 0.93 109.434 179.971 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' D' D ' 332' ' ' ILE . . . . . 0.545 HG21 ' HA ' ' D' ' 338' ' ' PHE . 97.0 mt -103.46 103.8 15.7 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.533 0 O-C-N 121.145 -0.972 . . . . 0.25 109.708 179.994 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' D' D ' 333' ' ' ARG . . . . . 0.597 ' HG2' ' CE1' ' B' ' 327' ' ' TYR . 13.2 mtp180 -72.57 150.11 43.42 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.256 -0.903 . . . . 2.93 109.458 179.887 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' D' D ' 334' ' ' GLY . . . . . . . . . . . . . . . 86.31 130.94 2.8 Favored Glycine 0 N--CA 1.491 2.333 0 N-CA-C 109.815 -1.314 . . . . 0.41 109.815 179.723 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' D' D ' 335' ' ' ARG . . . . . 0.463 ' HA ' ' CE1' ' B' ' 328' ' ' PHE . 0.0 OUTLIER -80.28 -38.94 29.83 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.308 -1.113 . . . . 3.03 109.575 179.883 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild core ' D' D ' 336' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -58.08 -61.79 2.29 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.241 -0.912 . . . . 2.26 110.031 -179.597 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' D' D ' 337' ' ' ARG . . . . . 0.474 ' NH1' ' HG2' ' D' ' 337' ' ' ARG . 0.0 OUTLIER -59.86 -26.38 65.79 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.175 -0.953 . . . . 2.92 109.862 -179.579 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild core ' D' D ' 338' ' ' PHE . . . . . 0.545 ' HA ' HG21 ' D' ' 332' ' ' ILE . 51.0 t80 -55.58 -58.7 6.71 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.195 -0.941 . . . . 0.37 109.725 -179.869 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' D' D ' 339' ' ' GLU . . . . . . . . . . . . . 55.6 mt-10 -50.63 -32.7 19.72 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.301 -0.874 . . . . 1.99 110.067 -179.711 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' D' D ' 340' ' ' MET . . . . . . . . . . . . . 23.2 ttp -63.78 -51.18 65.99 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.181 -0.95 . . . . 0.31 110.008 -179.62 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' D' D ' 341' ' ' PHE . . . . . 0.449 ' HB2' HD13 ' D' ' 332' ' ' ILE . 36.6 m-85 -62.01 -45.88 91.66 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.224 -0.922 . . . . 0.18 110.064 -179.55 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' D' D ' 342' ' ' ARG . . . . . 0.461 ' NH1' ' HG3' ' D' ' 342' ' ' ARG . 0.0 OUTLIER -49.58 -42.42 44.39 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.086 -1.009 . . . . 2.41 110.094 -179.513 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild core ' D' D ' 343' ' ' GLU . . . . . . . . . . . . . 1.6 tt0 -58.81 -47.69 83.93 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.018 -1.051 . . . . 2.35 109.886 -179.538 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' D' D ' 344' ' ' LEU . . . . . . . . . . . . . 49.5 mt -61.59 -33.13 73.35 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.106 -0.996 . . . . 0.19 109.435 -179.776 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' D' D ' 345' ' ' ASN . . . . . . . . . . . . . 21.7 t-20 -58.03 -59.14 5.73 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.299 -0.875 . . . . 1.09 109.716 -179.851 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' D' D ' 346' ' ' GLU . . . . . . . . . . . . . 72.1 tt0 -62.11 -28.61 69.75 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.337 -0.852 . . . . 1.69 110.059 -179.641 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' D' D ' 347' ' ' ALA . . . . . . . . . . . . . . . -60.24 -57.05 14.45 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.084 -1.01 . . . . 0.18 110.063 -179.641 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' D' D ' 348' ' ' LEU . . . . . 0.533 HD22 ' N ' ' D' ' 348' ' ' LEU . 4.0 mm? -61.92 -46.59 88.69 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.246 -0.909 . . . . 0.31 110.106 -179.426 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' D' D ' 349' ' ' GLU . . . . . . . . . . . . . 33.6 mm-40 -56.97 -33.41 67.06 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.187 -0.946 . . . . 1.95 109.964 -179.397 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' D' D ' 350' ' ' LEU . . . . . 1.132 HD22 HD11 ' C' ' 350' ' ' LEU . 5.8 tt -64.64 -48.19 75.74 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.15 -0.969 . . . . 0.43 109.666 -179.921 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' D' D ' 351' ' ' LYS . . . . . . . . . . . . . 22.3 tttm -58.43 -39.49 79.94 Favored 'General case' 0 N--CA 1.487 1.414 0 O-C-N 121.24 -0.913 . . . . 1.4 109.349 -179.874 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' D' D ' 352' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -57.97 -52.39 65.72 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.28 -0.887 . . . . 1.17 109.829 179.929 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' D' D ' 353' ' ' ALA . . . . . . . . . . . . . . . -66.58 -9.93 40.33 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.21 -0.931 . . . . 0.59 109.783 -179.483 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' D' D ' 354' ' ' GLN . . . . . . . . . . . . . 2.5 tt0 . . . . . 0 N--CA 1.49 1.569 0 O-C-N 121.134 -0.979 . . . . 1.44 109.613 179.996 . . . . . . . . 0 0 . 1 . 025 nuclear nobuild core ' A' A ' 326' ' ' GLU . . . . . . . . . . . . . 3.0 mm-40 . . . . . 0 N--CA 1.49 1.551 0 N-CA-C 109.371 -0.603 . . . . 2.13 109.371 . . . . . . . . . 0 0 . 1 . 025 nuclear nobuild core ' A' A ' 327' ' ' TYR . . . . . 0.417 ' CE1' ' HG2' ' C' ' 333' ' ' ARG . 48.4 m-85 -148.92 106.28 3.63 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.163 -0.96 . . . . 0.48 109.629 -179.919 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 328' ' ' PHE . . . . . . . . . . . . . 68.6 m-85 -112.97 -164.08 0.89 Allowed 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.23 -0.919 . . . . 0.31 109.55 179.834 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 329' ' ' THR . . . . . . . . . . . . . 20.9 p -153.83 173.96 15.21 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.228 -0.92 . . . . 0.22 109.227 179.833 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 330' ' ' LEU . . . . . 0.447 HD21 HD22 ' C' ' 345' ' ' ASN . 28.8 tp -152.16 131.95 13.25 Favored 'General case' 0 N--CA 1.489 1.476 0 O-C-N 120.94 -1.1 . . . . 0.28 109.833 -179.891 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 331' ' ' GLN . . . . . 0.402 ' NE2' ' O ' ' C' ' 328' ' ' PHE . 45.4 tp60 -88.97 107.34 18.97 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.354 -0.841 . . . . 0.91 109.192 179.533 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 332' ' ' ILE . . . . . . . . . . . . . 36.9 mt -103.3 107.21 21.64 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.624 0 O-C-N 121.112 -0.993 . . . . 0.26 109.778 -179.792 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 333' ' ' ARG . . . . . 0.601 ' HG2' ' CE2' ' C' ' 327' ' ' TYR . 0.0 OUTLIER -73.45 155.88 38.82 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.39 -0.819 . . . . 2.92 109.393 179.702 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild core ' A' A ' 334' ' ' GLY . . . . . . . . . . . . . . . 77.13 128.23 0.35 Allowed Glycine 0 N--CA 1.492 2.433 0 N-CA-C 109.898 -1.281 . . . . 0.4 109.898 179.584 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 335' ' ' ARG . . . . . 0.56 ' HG3' ' CE2' ' C' ' 328' ' ' PHE . 1.7 ttt-85 -80.0 -36.1 36.44 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.371 -1.076 . . . . 3.01 109.543 179.862 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 336' ' ' GLU . . . . . . . . . . . . . 2.2 tm-20 -56.22 -64.84 0.73 Allowed 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.27 -0.893 . . . . 2.29 109.723 -179.84 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 337' ' ' ARG . . . . . 0.714 ' HE ' HD12 ' C' ' 348' ' ' LEU . 0.0 OUTLIER -60.78 -28.9 69.09 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.339 -0.851 . . . . 2.93 109.542 -179.675 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild core ' A' A ' 338' ' ' PHE . . . . . . . . . . . . . 52.3 t80 -55.52 -60.17 3.8 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.163 -0.96 . . . . 0.38 109.462 -179.925 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 339' ' ' GLU . . . . . . . . . . . . . 65.0 mm-40 -51.24 -30.09 16.45 Favored 'General case' 0 N--CA 1.488 1.456 0 O-C-N 121.357 -0.839 . . . . 1.97 109.757 -179.903 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 340' ' ' MET . . . . . 0.432 ' HB3' ' O ' ' A' ' 337' ' ' ARG . 7.6 ttp -64.19 -50.45 68.03 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.175 -0.953 . . . . 0.31 109.575 -179.95 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 341' ' ' PHE . . . . . . . . . . . . . 45.5 m-85 -63.0 -45.7 91.14 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.33 -0.856 . . . . 0.18 109.981 -179.703 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 342' ' ' ARG . . . . . . . . . . . . . 5.4 ttm180 -49.29 -40.99 36.82 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.122 -0.986 . . . . 2.42 109.915 -179.535 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 343' ' ' GLU . . . . . . . . . . . . . 1.4 tt0 -58.71 -43.78 90.18 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.145 -0.972 . . . . 2.35 109.806 -179.714 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 344' ' ' LEU . . . . . 0.762 HD22 HD22 ' B' ' 344' ' ' LEU . 42.9 mt -63.28 -46.15 88.17 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.239 -0.913 . . . . 0.18 109.876 -179.749 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 345' ' ' ASN . . . . . 0.674 HD22 HD11 ' C' ' 330' ' ' LEU . 42.3 t-20 -55.61 -46.95 77.27 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.115 -0.991 . . . . 1.09 109.923 -179.481 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 346' ' ' GLU . . . . . . . . . . . . . 1.4 tp10 -60.72 -36.39 78.72 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.179 -0.951 . . . . 1.65 109.776 -179.66 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 347' ' ' ALA . . . . . 1.04 ' HB1' ' HB1' ' B' ' 347' ' ' ALA . . . -59.4 -51.1 71.37 Favored 'General case' 0 N--CA 1.493 1.692 0 O-C-N 121.222 -0.924 . . . . 0.18 109.944 -179.712 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 348' ' ' LEU . . . . . 0.597 HD22 ' N ' ' A' ' 348' ' ' LEU . 4.1 mm? -61.78 -43.86 98.01 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.237 -0.914 . . . . 0.3 109.658 -179.721 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 349' ' ' GLU . . . . . . . . . . . . . 2.2 mm-40 -59.17 -34.16 71.77 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.199 -0.938 . . . . 1.94 110.244 -179.551 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 350' ' ' LEU . . . . . 0.604 HD22 HD13 ' B' ' 350' ' ' LEU . 6.7 tt -63.12 -43.72 97.63 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.074 -1.016 . . . . 0.46 109.465 -179.773 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 351' ' ' LYS . . . . . . . . . . . . . 25.5 tttm -56.67 -42.73 79.51 Favored 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.22 -0.925 . . . . 1.4 109.861 -179.679 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 352' ' ' ASP . . . . . . . . . . . . . 36.2 m-20 -58.69 -49.92 75.78 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.186 -0.946 . . . . 1.16 109.817 179.974 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 353' ' ' ALA . . . . . . . . . . . . . . . -67.65 -10.27 50.73 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.27 -0.894 . . . . 0.63 109.534 -179.776 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 354' ' ' GLN . . . . . 0.6 ' NE2' HD11 ' B' ' 350' ' ' LEU . 2.9 tt0 . . . . . 0 C--N 1.302 -1.473 0 O-C-N 121.25 -0.906 . . . . 1.47 109.767 -179.917 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' B' B ' 326' ' ' GLU . . . . . . . . . . . . . 3.0 mm-40 . . . . . 0 N--CA 1.488 1.452 0 N-CA-C 109.349 -0.611 . . . . 2.13 109.349 . . . . . . . . . 0 0 . 1 . 025 nuclear nobuild core ' B' B ' 327' ' ' TYR . . . . . 0.59 ' CE1' ' HG2' ' D' ' 333' ' ' ARG . 47.6 m-85 -148.55 106.16 3.67 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.224 -0.923 . . . . 0.48 109.633 -179.841 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' B' B ' 328' ' ' PHE . . . . . 0.416 ' CZ ' ' HG3' ' D' ' 335' ' ' ARG . 66.7 m-85 -113.22 -164.5 0.92 Allowed 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.287 -0.883 . . . . 0.32 109.546 179.797 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' B' B ' 329' ' ' THR . . . . . . . . . . . . . 20.8 p -153.4 174.41 14.39 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.297 -0.877 . . . . 0.23 109.276 -179.956 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' B' B ' 330' ' ' LEU . . . . . . . . . . . . . 28.3 tp -152.75 131.53 12.41 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.062 -1.024 . . . . 0.28 109.917 -179.826 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' B' B ' 331' ' ' GLN . . . . . 0.43 ' NE2' ' O ' ' D' ' 328' ' ' PHE . 45.8 tp60 -88.81 107.91 19.23 Favored 'General case' 0 N--CA 1.489 1.48 0 O-C-N 121.33 -0.857 . . . . 0.91 109.135 179.507 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' B' B ' 332' ' ' ILE . . . . . . . . . . . . . 35.2 mt -103.84 107.15 21.62 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.584 0 O-C-N 121.136 -0.977 . . . . 0.24 109.618 -179.728 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' B' B ' 333' ' ' ARG . . . . . 0.529 ' HG2' ' CE1' ' D' ' 327' ' ' TYR . 0.0 OUTLIER -73.66 155.05 39.42 Favored 'General case' 0 N--CA 1.488 1.46 0 O-C-N 121.293 -0.879 . . . . 2.93 109.347 179.695 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild core ' B' B ' 334' ' ' GLY . . . . . . . . . . . . . . . 78.05 128.39 0.45 Allowed Glycine 0 N--CA 1.492 2.369 0 N-CA-C 109.965 -1.254 . . . . 0.4 109.965 179.702 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' B' B ' 335' ' ' ARG . . . . . 0.499 ' HG2' ' NH1' ' B' ' 335' ' ' ARG . 1.7 ttt-85 -80.01 -35.8 36.83 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.308 -1.113 . . . . 3.01 109.467 179.845 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' B' B ' 336' ' ' GLU . . . . . . . . . . . . . 2.3 tm-20 -56.49 -65.43 0.61 Allowed 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.333 -0.854 . . . . 2.28 109.725 -179.699 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' B' B ' 337' ' ' ARG . . . . . 0.582 ' HE ' HD12 ' D' ' 348' ' ' LEU . 0.0 OUTLIER -60.18 -29.25 68.57 Favored 'General case' 0 N--CA 1.488 1.463 0 O-C-N 121.283 -0.886 . . . . 2.93 109.647 -179.789 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild core ' B' B ' 338' ' ' PHE . . . . . . . . . . . . . 53.1 t80 -55.03 -59.83 4.2 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.243 -0.911 . . . . 0.37 109.542 -179.949 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' B' B ' 339' ' ' GLU . . . . . . . . . . . . . 62.4 mm-40 -51.6 -30.08 19.8 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.34 -0.85 . . . . 1.98 109.71 -179.963 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' B' B ' 340' ' ' MET . . . . . 0.44 ' HB3' ' O ' ' B' ' 337' ' ' ARG . 7.0 ttp -64.16 -50.91 66.32 Favored 'General case' 0 N--CA 1.489 1.499 0 O-C-N 121.192 -0.942 . . . . 0.32 109.592 -179.732 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' B' B ' 341' ' ' PHE . . . . . . . . . . . . . 47.0 m-85 -62.46 -46.24 89.41 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.231 -0.918 . . . . 0.18 109.939 -179.822 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' B' B ' 342' ' ' ARG . . . . . . . . . . . . . 5.4 ttm180 -48.98 -41.04 32.91 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.182 -0.949 . . . . 2.42 109.9 -179.437 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' B' B ' 343' ' ' GLU . . . . . . . . . . . . . 1.4 tt0 -58.91 -43.92 91.15 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.171 -0.956 . . . . 2.35 109.673 -179.641 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' B' B ' 344' ' ' LEU . . . . . 0.762 HD22 HD22 ' A' ' 344' ' ' LEU . 41.3 mt -62.95 -46.27 88.54 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.217 -0.927 . . . . 0.18 109.939 -179.8 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' B' B ' 345' ' ' ASN . . . . . . . . . . . . . 41.7 t-20 -55.42 -46.85 76.63 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.253 -0.904 . . . . 1.09 109.823 -179.527 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' B' B ' 346' ' ' GLU . . . . . . . . . . . . . 1.4 tp10 -60.76 -36.66 79.49 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.239 -0.913 . . . . 1.66 109.825 -179.714 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' B' B ' 347' ' ' ALA . . . . . 1.04 ' HB1' ' HB1' ' A' ' 347' ' ' ALA . . . -59.23 -51.46 69.88 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.177 -0.952 . . . . 0.17 109.886 -179.731 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' B' B ' 348' ' ' LEU . . . . . 0.603 HD22 ' N ' ' B' ' 348' ' ' LEU . 4.1 mm? -61.21 -44.36 97.4 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.234 -0.917 . . . . 0.29 109.723 -179.751 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' B' B ' 349' ' ' GLU . . . . . . . . . . . . . 2.3 mm-40 -58.51 -34.75 71.29 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.257 -0.902 . . . . 1.95 110.214 -179.584 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' B' B ' 350' ' ' LEU . . . . . 0.604 HD13 HD22 ' A' ' 350' ' ' LEU . 6.4 tt -62.53 -44.14 97.09 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.058 -1.026 . . . . 0.45 109.579 -179.888 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' B' B ' 351' ' ' LYS . . . . . . . . . . . . . 26.3 tttm -56.5 -43.24 79.51 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.312 -0.867 . . . . 1.38 109.797 -179.728 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' B' B ' 352' ' ' ASP . . . . . . . . . . . . . 35.0 m-20 -58.0 -50.41 73.5 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.218 -0.926 . . . . 1.16 109.712 179.972 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' B' B ' 353' ' ' ALA . . . . . . . . . . . . . . . -67.08 -10.96 55.55 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.087 -1.008 . . . . 0.61 109.62 -179.662 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' B' B ' 354' ' ' GLN . . . . . 0.559 ' NE2' HD11 ' A' ' 350' ' ' LEU . 3.0 tt0 . . . . . 0 N--CA 1.489 1.497 0 O-C-N 121.324 -0.86 . . . . 1.45 109.781 -179.774 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' C' C ' 326' ' ' GLU . . . . . . . . . . . . . 42.1 mm-40 . . . . . 0 N--CA 1.489 1.513 0 CA-C-O 121.415 0.626 . . . . 2.17 109.653 . . . . . . . . . 0 0 . 1 . 025 nuclear nobuild core ' C' C ' 327' ' ' TYR . . . . . 0.601 ' CE2' ' HG2' ' A' ' 333' ' ' ARG . 47.7 m-85 -149.66 101.88 3.11 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.325 -0.859 . . . . 0.48 109.258 -179.956 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' C' C ' 328' ' ' PHE . . . . . 0.56 ' CE2' ' HG3' ' A' ' 335' ' ' ARG . 71.1 m-85 -110.15 -161.34 0.75 Allowed 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.164 -0.96 . . . . 0.33 110.075 -179.799 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' C' C ' 329' ' ' THR . . . . . 0.441 HG23 ' C ' ' C' ' 328' ' ' PHE . 33.8 p -154.95 169.76 23.31 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.482 -0.761 . . . . 0.23 109.071 179.834 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' C' C ' 330' ' ' LEU . . . . . 0.674 HD11 HD22 ' A' ' 345' ' ' ASN . 16.8 tp -149.89 127.23 11.43 Favored 'General case' 0 N--CA 1.489 1.494 0 O-C-N 121.219 -0.925 . . . . 0.28 109.851 -179.924 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' C' C ' 331' ' ' GLN . . . . . . . . . . . . . 12.5 tp60 -87.76 113.2 23.21 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.401 -0.812 . . . . 1.48 109.162 179.658 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' C' C ' 332' ' ' ILE . . . . . . . . . . . . . 32.1 mt -103.14 110.11 28.79 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.6 0 O-C-N 121.117 -0.99 . . . . 0.24 109.782 -179.789 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' C' C ' 333' ' ' ARG . . . . . 0.417 ' HG2' ' CE1' ' A' ' 327' ' ' TYR . 18.7 mtt180 -73.08 148.13 44.32 Favored 'General case' 0 N--CA 1.488 1.435 0 O-C-N 121.368 -0.833 . . . . 2.74 109.3 179.594 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' C' C ' 334' ' ' GLY . . . . . . . . . . . . . . . 80.07 128.6 0.73 Allowed Glycine 0 N--CA 1.489 2.221 0 N-CA-C 109.749 -1.34 . . . . 0.35 109.749 179.945 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' C' C ' 335' ' ' ARG . . . . . 0.445 ' NH1' ' CG ' ' C' ' 335' ' ' ARG . 0.1 OUTLIER -78.38 -30.25 47.77 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.323 -1.104 . . . . 2.53 109.478 179.919 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild core ' C' C ' 336' ' ' GLU . . . . . . . . . . . . . 24.6 mt-10 -58.26 -66.02 0.55 Allowed 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.309 -0.869 . . . . 2.62 109.751 -179.924 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' C' C ' 337' ' ' ARG . . . . . . . . . . . . . 1.2 mtp180 -59.26 -26.92 65.33 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.211 -0.931 . . . . 2.81 109.614 -179.805 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' C' C ' 338' ' ' PHE . . . . . 0.426 ' HB3' ' O ' ' C' ' 335' ' ' ARG . 74.3 t80 -56.03 -59.1 5.4 Favored 'General case' 0 N--CA 1.489 1.476 0 O-C-N 121.154 -0.966 . . . . 0.4 109.808 -179.88 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' C' C ' 339' ' ' GLU . . . . . . . . . . . . . 4.2 mt-10 -50.5 -33.89 23.1 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.208 -0.932 . . . . 2.05 110.09 -179.512 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' C' C ' 340' ' ' MET . . . . . . . . . . . . . 31.2 ttp -63.72 -51.56 64.43 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.195 -0.941 . . . . 0.32 110.101 -179.498 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' C' C ' 341' ' ' PHE . . . . . . . . . . . . . 47.8 m-85 -61.22 -46.58 89.84 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.114 -0.991 . . . . 0.18 110.012 -179.417 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' C' C ' 342' ' ' ARG . . . . . 0.49 ' NH1' ' HG3' ' C' ' 342' ' ' ARG . 0.0 OUTLIER -48.31 -42.52 31.3 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.246 -0.909 . . . . 2.91 110.252 -179.508 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild core ' C' C ' 343' ' ' GLU . . . . . . . . . . . . . 44.4 tt0 -58.5 -47.37 84.31 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.165 -0.959 . . . . 2.14 110.095 -179.459 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' C' C ' 344' ' ' LEU . . . . . 0.779 HD22 HD22 ' D' ' 344' ' ' LEU . 92.6 mt -61.14 -44.58 97.1 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.119 -0.988 . . . . 0.22 109.952 -179.58 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' C' C ' 345' ' ' ASN . . . . . 0.447 HD22 HD21 ' A' ' 330' ' ' LEU . 64.7 t-20 -56.04 -51.72 66.79 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.218 -0.927 . . . . 1.08 110.045 -179.557 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' C' C ' 346' ' ' GLU . . . . . . . . . . . . . 7.7 tp10 -61.36 -31.95 71.84 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.059 -1.025 . . . . 2.21 109.553 -179.898 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' C' C ' 347' ' ' ALA . . . . . 1.037 ' HB1' ' HB1' ' D' ' 347' ' ' ALA . . . -59.97 -54.48 45.57 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.16 -0.962 . . . . 0.18 109.96 179.954 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' C' C ' 348' ' ' LEU . . . . . 0.714 HD12 ' HE ' ' A' ' 337' ' ' ARG . 4.0 mm? -61.11 -40.68 94.68 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.177 -0.952 . . . . 0.32 109.791 -179.839 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' C' C ' 349' ' ' GLU . . . . . . . . . . . . . 11.7 mm-40 -57.74 -38.83 76.01 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.277 -0.89 . . . . 2.19 110.01 -179.469 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' C' C ' 350' ' ' LEU . . . . . 0.589 HD22 HD13 ' D' ' 350' ' ' LEU . 6.7 tt -63.18 -39.9 95.98 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.113 -0.992 . . . . 0.46 109.612 -179.839 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' C' C ' 351' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -59.16 -50.64 73.26 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.19 -0.944 . . . . 1.35 109.484 -179.843 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' C' C ' 352' ' ' ASP . . . . . . . . . . . . . 73.5 m-20 -55.69 -38.41 69.63 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.344 -0.847 . . . . 1.19 109.864 179.953 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' C' C ' 353' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.493 1.686 0 O-C-N 121.33 -0.856 . . . . 0.57 110.554 -179.328 . . . . . . . . 0 0 . 1 . 025 nuclear nobuild core ' D' D ' 326' ' ' GLU . . . . . . . . . . . . . 3.1 mm-40 . . . . . 0 N--CA 1.489 1.478 0 N-CA-C 109.379 -0.601 . . . . 2.13 109.379 . . . . . . . . . 0 0 . 1 . 025 nuclear nobuild core ' D' D ' 327' ' ' TYR . . . . . 0.529 ' CE1' ' HG2' ' B' ' 333' ' ' ARG . 48.7 m-85 -148.99 105.76 3.57 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.201 -0.937 . . . . 0.47 109.676 -179.8 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' D' D ' 328' ' ' PHE . . . . . 0.43 ' O ' ' NE2' ' B' ' 331' ' ' GLN . 67.3 m-85 -112.8 -163.9 0.88 Allowed 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.281 -0.887 . . . . 0.3 109.613 179.782 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' D' D ' 329' ' ' THR . . . . . . . . . . . . . 21.1 p -153.97 174.17 15.01 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.178 -0.951 . . . . 0.22 109.192 179.94 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' D' D ' 330' ' ' LEU . . . . . . . . . . . . . 29.1 tp -152.29 132.07 13.22 Favored 'General case' 0 N--CA 1.489 1.494 0 O-C-N 121.166 -0.959 . . . . 0.28 109.852 -179.864 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' D' D ' 331' ' ' GLN . . . . . 0.408 ' NE2' ' O ' ' B' ' 328' ' ' PHE . 46.3 tp60 -89.31 107.98 19.37 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.355 -0.841 . . . . 0.93 109.095 179.463 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' D' D ' 332' ' ' ILE . . . . . . . . . . . . . 33.5 mt -103.67 106.98 21.21 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.518 0 O-C-N 121.195 -0.94 . . . . 0.25 109.766 -179.855 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' D' D ' 333' ' ' ARG . . . . . 0.59 ' HG2' ' CE1' ' B' ' 327' ' ' TYR . 0.0 OUTLIER -73.58 154.35 39.84 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.37 -0.831 . . . . 2.93 109.402 179.693 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild core ' D' D ' 334' ' ' GLY . . . . . . . . . . . . . . . 78.93 128.42 0.55 Allowed Glycine 0 N--CA 1.492 2.403 0 N-CA-C 109.94 -1.264 . . . . 0.41 109.94 179.607 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' D' D ' 335' ' ' ARG . . . . . 0.495 ' HG2' ' NH1' ' D' ' 335' ' ' ARG . 1.6 ttt-85 -80.24 -35.19 36.44 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.371 -1.076 . . . . 3.03 109.453 179.93 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' D' D ' 336' ' ' GLU . . . . . . . . . . . . . 2.4 tm-20 -57.19 -65.5 0.61 Allowed 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.311 -0.868 . . . . 2.26 109.685 -179.663 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' D' D ' 337' ' ' ARG . . . . . 0.55 ' HE ' HD12 ' B' ' 348' ' ' LEU . 0.0 OUTLIER -60.19 -29.11 68.49 Favored 'General case' 0 N--CA 1.489 1.486 0 O-C-N 121.392 -0.818 . . . . 2.92 109.543 -179.924 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild core ' D' D ' 338' ' ' PHE . . . . . . . . . . . . . 54.9 t80 -54.84 -60.04 3.9 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.246 -0.909 . . . . 0.37 109.554 179.883 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' D' D ' 339' ' ' GLU . . . . . . . . . . . . . 60.7 mm-40 -51.63 -29.59 18.27 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.287 -0.883 . . . . 1.99 109.838 -179.813 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' D' D ' 340' ' ' MET . . . . . 0.424 ' HB3' ' O ' ' D' ' 337' ' ' ARG . 6.6 ttp -64.6 -50.61 66.52 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.15 -0.969 . . . . 0.31 109.58 -179.818 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' D' D ' 341' ' ' PHE . . . . . . . . . . . . . 46.5 m-85 -62.8 -46.26 88.78 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.347 -0.846 . . . . 0.18 109.954 -179.735 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' D' D ' 342' ' ' ARG . . . . . . . . . . . . . 5.5 ttm180 -49.09 -41.38 35.35 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.262 -0.899 . . . . 2.41 109.922 -179.429 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' D' D ' 343' ' ' GLU . . . . . . . . . . . . . 1.4 tt0 -58.66 -44.02 90.01 Favored 'General case' 0 N--CA 1.489 1.5 0 O-C-N 121.215 -0.928 . . . . 2.35 109.543 -179.621 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' D' D ' 344' ' ' LEU . . . . . 0.779 HD22 HD22 ' C' ' 344' ' ' LEU . 40.1 mt -62.92 -46.22 88.81 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.346 -0.846 . . . . 0.19 110.025 -179.743 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' D' D ' 345' ' ' ASN . . . . . . . . . . . . . 41.6 t-20 -55.59 -46.56 77.25 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.159 -0.963 . . . . 1.09 109.837 -179.519 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' D' D ' 346' ' ' GLU . . . . . . . . . . . . . 1.4 tp10 -60.67 -36.75 79.5 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.152 -0.967 . . . . 1.69 109.774 -179.806 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' D' D ' 347' ' ' ALA . . . . . 1.037 ' HB1' ' HB1' ' C' ' 347' ' ' ALA . . . -59.05 -50.95 72.14 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.091 -1.006 . . . . 0.18 110.025 -179.737 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' D' D ' 348' ' ' LEU . . . . . 0.604 HD22 ' N ' ' D' ' 348' ' ' LEU . 4.0 mm? -61.89 -43.84 98.02 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.129 -0.982 . . . . 0.31 109.829 -179.791 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' D' D ' 349' ' ' GLU . . . . . . . . . . . . . 2.3 mm-40 -59.05 -34.47 71.97 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.318 -0.864 . . . . 1.95 110.085 -179.531 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' D' D ' 350' ' ' LEU . . . . . 0.589 HD13 HD22 ' C' ' 350' ' ' LEU . 6.2 tt -62.83 -43.8 97.84 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.135 -0.978 . . . . 0.43 109.518 -179.87 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' D' D ' 351' ' ' LYS . . . . . . . . . . . . . 27.2 tttm -56.98 -42.7 80.69 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.352 -0.842 . . . . 1.4 109.728 -179.676 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' D' D ' 352' ' ' ASP . . . . . . . . . . . . . 33.7 m-20 -58.55 -50.36 74.07 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.118 -0.989 . . . . 1.17 109.613 -179.969 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' D' D ' 353' ' ' ALA . . . . . . . . . . . . . . . -66.93 -11.01 55.03 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.28 -0.888 . . . . 0.59 109.634 -179.794 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' D' D ' 354' ' ' GLN . . . . . 0.408 ' NE2' ' CD1' ' C' ' 350' ' ' LEU . 3.1 tt0 . . . . . 0 C--N 1.3 -1.552 0 O-C-N 121.281 -0.887 . . . . 1.44 109.775 -179.774 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 326' ' ' GLU . . . . . . . . . . . . . 32.4 mp0 . . . . . 0 N--CA 1.489 1.515 0 CA-C-O 121.338 0.59 . . . . 2.13 109.611 . . . . . . . . . 0 0 . 1 . 026 nuclear nobuild core ' A' A ' 327' ' ' TYR . . . . . 0.584 ' CE1' ' HG2' ' C' ' 333' ' ' ARG . 41.5 m-85 -148.78 112.6 5.11 Favored 'General case' 0 N--CA 1.489 1.5 0 O-C-N 121.373 -0.829 . . . . 0.48 109.555 180.0 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 328' ' ' PHE . . . . . . . . . . . . . 98.0 m-85 -113.88 -169.43 1.51 Allowed 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.258 -0.901 . . . . 0.31 109.369 179.804 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 329' ' ' THR . . . . . . . . . . . . . 20.8 p -153.29 168.95 24.32 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.302 -0.874 . . . . 0.22 109.665 -179.761 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 330' ' ' LEU . . . . . . . . . . . . . 41.7 tp -152.19 129.11 10.98 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.29 -0.881 . . . . 0.28 109.591 -179.856 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 331' ' ' GLN . . . . . . . . . . . . . 1.4 tt0 -87.13 114.61 23.89 Favored 'General case' 0 N--CA 1.488 1.429 0 O-C-N 121.403 -0.81 . . . . 0.91 109.14 179.537 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 332' ' ' ILE . . . . . 0.653 HG21 ' HA ' ' A' ' 338' ' ' PHE . 45.8 mt -103.32 104.3 16.44 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.54 0 O-C-N 121.095 -1.003 . . . . 0.26 109.487 -179.933 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 333' ' ' ARG . . . . . 0.482 ' HG2' ' CE2' ' C' ' 327' ' ' TYR . 49.4 mtt180 -72.82 143.58 47.82 Favored 'General case' 0 N--CA 1.488 1.433 0 O-C-N 121.306 -0.871 . . . . 2.92 109.108 179.822 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 334' ' ' GLY . . . . . . . . . . . . . . . 89.2 125.72 2.7 Favored Glycine 0 N--CA 1.491 2.342 0 N-CA-C 109.423 -1.471 . . . . 0.4 109.423 -179.93 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 335' ' ' ARG . . . . . . . . . . . . . 15.1 ttt180 -76.41 -40.39 50.97 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.202 -1.175 . . . . 3.01 109.742 -179.897 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 336' ' ' GLU . . . . . . . . . . . . . 20.0 tt0 -58.09 -58.76 7.03 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.42 -0.8 . . . . 2.29 109.928 -179.746 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 337' ' ' ARG . . . . . 0.433 ' CG ' HH11 ' A' ' 337' ' ' ARG . 0.0 OUTLIER -61.18 -32.51 72.25 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.229 -0.919 . . . . 2.93 109.509 -179.833 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild core ' A' A ' 338' ' ' PHE . . . . . 0.653 ' HA ' HG21 ' A' ' 332' ' ' ILE . 53.0 t80 -55.75 -53.88 51.25 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.303 -0.873 . . . . 0.38 109.392 179.908 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 339' ' ' GLU . . . . . . . . . . . . . 43.1 mt-10 -50.8 -32.49 20.18 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.247 -0.908 . . . . 1.97 109.861 -179.644 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 340' ' ' MET . . . . . . . . . . . . . 19.6 ttp -63.1 -51.64 65.77 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.088 -1.007 . . . . 0.31 109.79 -179.551 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 341' ' ' PHE . . . . . . . . . . . . . 37.3 m-85 -62.06 -41.47 98.19 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.133 -0.98 . . . . 0.18 109.816 -179.829 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 342' ' ' ARG . . . . . . . . . . . . . 6.1 tpt180 -49.1 -43.46 41.32 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.261 -0.899 . . . . 2.42 110.105 -179.497 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 343' ' ' GLU . . . . . . . . . . . . . 1.3 tt0 -59.95 -46.02 90.75 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.202 -0.936 . . . . 2.35 109.639 -179.757 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 344' ' ' LEU . . . . . . . . . . . . . 57.6 mt -62.04 -30.28 70.87 Favored 'General case' 0 N--CA 1.488 1.467 0 O-C-N 121.315 -0.866 . . . . 0.18 109.372 -179.954 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 345' ' ' ASN . . . . . . . . . . . . . 12.4 t-20 -59.24 -58.09 10.14 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.346 -0.846 . . . . 1.09 109.965 -179.725 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 346' ' ' GLU . . . . . . . . . . . . . 15.8 tt0 -61.74 -28.15 69.23 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.212 -0.93 . . . . 1.65 109.731 -179.555 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 347' ' ' ALA . . . . . 0.704 ' HB1' ' HB1' ' B' ' 347' ' ' ALA . . . -60.9 -61.71 2.38 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.099 -1.001 . . . . 0.18 110.011 -179.607 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 348' ' ' LEU . . . . . 0.603 HD22 ' N ' ' A' ' 348' ' ' LEU . 3.8 mm? -61.52 -45.65 93.3 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.278 -0.889 . . . . 0.3 110.21 -179.396 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 349' ' ' GLU . . . . . 0.433 ' OE2' ' HD2' ' C' ' 333' ' ' ARG . 3.5 mt-10 -57.69 -32.93 67.84 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.226 -0.921 . . . . 1.94 110.072 -179.339 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 350' ' ' LEU . . . . . 0.69 HD22 HD22 ' B' ' 350' ' ' LEU . 7.8 tt -65.75 -43.99 87.24 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.032 -1.043 . . . . 0.46 109.391 -179.91 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 351' ' ' LYS . . . . . . . . . . . . . 13.3 tttt -59.07 -50.95 72.11 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.381 -0.824 . . . . 1.4 109.352 -179.937 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 352' ' ' ASP . . . . . . . . . . . . . 2.3 m-20 -56.24 -31.23 63.36 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.205 -0.934 . . . . 1.16 109.82 -179.922 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 353' ' ' ALA . . . . . . . . . . . . . . . -67.25 -33.25 74.93 Favored 'General case' 0 N--CA 1.495 1.776 0 O-C-N 121.13 -0.981 . . . . 0.63 110.072 -179.731 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 354' ' ' GLN . . . . . . . . . . . . . 20.1 mt-30 . . . . . 0 N--CA 1.491 1.6 0 O-C-N 121.128 -0.983 . . . . 1.47 109.576 -179.696 . . . . . . . . 0 0 . 1 . 026 nuclear nobuild core ' B' B ' 326' ' ' GLU . . . . . . . . . . . . . 34.5 mp0 . . . . . 0 N--CA 1.491 1.611 0 CA-C-O 121.326 0.584 . . . . 2.13 109.768 . . . . . . . . . 0 0 . 1 . 026 nuclear nobuild core ' B' B ' 327' ' ' TYR . . . . . . . . . . . . . 41.8 m-85 -149.37 112.2 4.83 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.354 -0.841 . . . . 0.48 109.898 -179.994 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' B' B ' 328' ' ' PHE . . . . . 0.451 ' CE2' ' HA ' ' D' ' 335' ' ' ARG . 97.3 m-85 -113.52 -169.51 1.51 Allowed 'General case' 0 N--CA 1.487 1.411 0 O-C-N 121.342 -0.849 . . . . 0.32 109.503 179.942 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' B' B ' 329' ' ' THR . . . . . . . . . . . . . 18.0 p -152.94 169.27 23.28 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.182 -0.948 . . . . 0.23 109.792 -179.661 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' B' B ' 330' ' ' LEU . . . . . . . . . . . . . 39.6 tp -152.4 129.31 10.99 Favored 'General case' 0 N--CA 1.489 1.478 0 O-C-N 121.365 -0.835 . . . . 0.28 109.668 179.998 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' B' B ' 331' ' ' GLN . . . . . . . . . . . . . 1.3 tt0 -87.01 115.27 24.28 Favored 'General case' 0 N--CA 1.488 1.475 0 O-C-N 121.36 -0.837 . . . . 0.91 109.115 179.504 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' B' B ' 332' ' ' ILE . . . . . 0.668 HG21 ' HA ' ' B' ' 338' ' ' PHE . 42.6 mt -103.48 103.59 15.38 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.599 0 O-C-N 120.945 -1.097 . . . . 0.24 109.7 179.964 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' B' B ' 333' ' ' ARG . . . . . . . . . . . . . 50.3 mtt180 -72.4 142.75 48.7 Favored 'General case' 0 C--N 1.302 -1.463 0 O-C-N 121.085 -1.01 . . . . 2.93 109.261 179.759 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' B' B ' 334' ' ' GLY . . . . . . . . . . . . . . . 89.79 125.6 2.86 Favored Glycine 0 N--CA 1.49 2.29 0 N-CA-C 109.583 -1.407 . . . . 0.4 109.583 -179.821 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' B' B ' 335' ' ' ARG . . . . . . . . . . . . . 16.6 ttt180 -76.45 -40.37 50.69 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.151 -1.206 . . . . 3.01 109.72 -179.928 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' B' B ' 336' ' ' GLU . . . . . . . . . . . . . 24.1 tt0 -58.23 -59.31 5.51 Favored 'General case' 0 N--CA 1.489 1.49 0 O-C-N 121.083 -1.011 . . . . 2.28 109.69 -179.577 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' B' B ' 337' ' ' ARG . . . . . 0.455 HH11 ' CG ' ' B' ' 337' ' ' ARG . 0.0 OUTLIER -60.26 -32.42 71.14 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.12 -0.987 . . . . 2.93 109.766 -179.795 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild core ' B' B ' 338' ' ' PHE . . . . . 0.668 ' HA ' HG21 ' B' ' 332' ' ' ILE . 52.4 t80 -55.93 -52.94 62.36 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.226 -0.921 . . . . 0.37 109.625 -179.895 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' B' B ' 339' ' ' GLU . . . . . . . . . . . . . 35.3 mt-10 -51.12 -33.03 24.71 Favored 'General case' 0 N--CA 1.488 1.461 0 O-C-N 121.35 -0.844 . . . . 1.98 109.848 -179.574 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' B' B ' 340' ' ' MET . . . . . . . . . . . . . 20.0 ttp -62.83 -51.36 67.32 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.115 -0.99 . . . . 0.32 109.924 -179.512 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' B' B ' 341' ' ' PHE . . . . . . . . . . . . . 35.6 m-85 -62.41 -41.72 98.9 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.128 -0.982 . . . . 0.18 109.796 -179.834 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' B' B ' 342' ' ' ARG . . . . . . . . . . . . . 5.7 tpt180 -48.88 -44.32 39.82 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.383 -0.823 . . . . 2.42 109.68 -179.806 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' B' B ' 343' ' ' GLU . . . . . . . . . . . . . 1.3 tt0 -58.44 -47.42 84.04 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.085 -1.009 . . . . 2.35 109.705 -179.85 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' B' B ' 344' ' ' LEU . . . . . . . . . . . . . 51.6 mt -61.01 -30.52 70.35 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.158 -0.964 . . . . 0.18 109.684 -179.831 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' B' B ' 345' ' ' ASN . . . . . . . . . . . . . 12.1 t-20 -58.91 -58.33 9.12 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.314 -0.866 . . . . 1.09 110.132 -179.837 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' B' B ' 346' ' ' GLU . . . . . . . . . . . . . 17.7 tt0 -61.65 -28.44 69.38 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.112 -0.993 . . . . 1.66 109.568 -179.464 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' B' B ' 347' ' ' ALA . . . . . 0.704 ' HB1' ' HB1' ' A' ' 347' ' ' ALA . . . -60.59 -61.14 2.81 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.248 -0.908 . . . . 0.17 110.199 -179.778 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' B' B ' 348' ' ' LEU . . . . . 0.599 HD22 ' N ' ' B' ' 348' ' ' LEU . 3.8 mm? -62.36 -46.05 90.44 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.307 -0.871 . . . . 0.29 110.023 -179.279 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' B' B ' 349' ' ' GLU . . . . . . . . . . . . . 3.9 mt-10 -57.09 -33.2 67.07 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.025 -1.047 . . . . 1.95 110.099 -179.48 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' B' B ' 350' ' ' LEU . . . . . 0.69 HD22 HD22 ' A' ' 350' ' ' LEU . 7.8 tt -65.41 -44.3 87.87 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.159 -0.963 . . . . 0.45 109.442 -179.923 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' B' B ' 351' ' ' LYS . . . . . . . . . . . . . 15.0 tttt -58.74 -50.65 73.12 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.233 -0.917 . . . . 1.38 109.454 -179.984 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' B' B ' 352' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 -56.35 -31.92 64.23 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.224 -0.922 . . . . 1.16 109.841 -179.85 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' B' B ' 353' ' ' ALA . . . . . . . . . . . . . . . -66.82 -33.0 74.65 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.194 -0.941 . . . . 0.61 109.896 -179.661 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' B' B ' 354' ' ' GLN . . . . . . . . . . . . . 20.3 mt-30 . . . . . 0 N--CA 1.493 1.687 0 O-C-N 121.107 -0.995 . . . . 1.45 109.515 -179.914 . . . . . . . . 0 0 . 1 . 026 nuclear nobuild core ' C' C ' 326' ' ' GLU . . . . . 0.408 ' O ' ' CD1' ' C' ' 327' ' ' TYR . 3.5 mt-10 . . . . . 0 N--CA 1.49 1.566 0 N-CA-C 109.382 -0.599 . . . . 2.17 109.382 . . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' C' C ' 327' ' ' TYR . . . . . 0.482 ' CE2' ' HG2' ' A' ' 333' ' ' ARG . 33.7 m-85 -149.33 112.09 4.81 Favored 'General case' 0 N--CA 1.488 1.45 0 O-C-N 121.375 -0.828 . . . . 0.48 110.458 179.721 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' C' C ' 328' ' ' PHE . . . . . 0.448 ' O ' HG23 ' C' ' 329' ' ' THR . 68.9 m-85 -112.96 -166.36 1.07 Allowed 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.423 -0.798 . . . . 0.33 108.975 179.458 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' C' C ' 329' ' ' THR . . . . . 0.448 HG23 ' O ' ' C' ' 328' ' ' PHE . 4.4 p -154.28 166.01 34.5 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.259 -0.901 . . . . 0.23 109.492 -179.944 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' C' C ' 330' ' ' LEU . . . . . . . . . . . . . 42.0 tp -150.07 129.42 12.9 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.24 -0.912 . . . . 0.28 109.762 -179.692 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' C' C ' 331' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -87.59 116.48 25.74 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.278 -0.889 . . . . 1.48 109.095 179.683 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' C' C ' 332' ' ' ILE . . . . . 0.635 HG21 ' HA ' ' C' ' 338' ' ' PHE . 76.1 mt -104.14 110.71 31.16 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.559 0 O-C-N 121.195 -0.941 . . . . 0.24 109.828 -179.748 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' C' C ' 333' ' ' ARG . . . . . 0.584 ' HG2' ' CE1' ' A' ' 327' ' ' TYR . 58.2 mtt180 -73.89 143.01 45.98 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.238 -0.914 . . . . 2.74 109.368 179.64 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' C' C ' 334' ' ' GLY . . . . . . . . . . . . . . . 80.92 133.71 1.38 Allowed Glycine 0 N--CA 1.491 2.341 0 N-CA-C 109.884 -1.286 . . . . 0.35 109.884 179.845 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' C' C ' 335' ' ' ARG . . . . . . . . . . . . . 3.8 ttt180 -77.69 -35.35 52.27 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.271 -1.135 . . . . 2.53 109.402 179.81 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' C' C ' 336' ' ' GLU . . . . . . . . . . . . . 2.0 mp0 -56.93 -57.38 12.78 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.239 -0.913 . . . . 2.62 109.763 -179.85 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' C' C ' 337' ' ' ARG . . . . . 0.441 HH11 ' HG3' ' C' ' 337' ' ' ARG . 0.3 OUTLIER -59.44 -34.52 72.62 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.158 -0.964 . . . . 2.81 109.683 -179.746 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild core ' C' C ' 338' ' ' PHE . . . . . 0.635 ' HA ' HG21 ' C' ' 332' ' ' ILE . 61.2 t80 -54.87 -55.65 28.07 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.415 -0.803 . . . . 0.4 109.747 -179.841 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' C' C ' 339' ' ' GLU . . . . . . . . . . . . . 11.4 mm-40 -50.92 -35.85 35.4 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.319 -0.863 . . . . 2.05 110.367 -179.592 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' C' C ' 340' ' ' MET . . . . . . . . . . . . . 34.6 ttp -63.33 -48.66 77.11 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.112 -0.993 . . . . 0.32 110.054 -179.343 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' C' C ' 341' ' ' PHE . . . . . . . . . . . . . 30.9 m-85 -63.23 -46.32 87.5 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.187 -0.946 . . . . 0.18 110.251 -179.351 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' C' C ' 342' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -48.89 -39.96 27.95 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.015 -1.053 . . . . 2.91 109.799 -179.663 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' C' C ' 343' ' ' GLU . . . . . . . . . . . . . 31.3 tt0 -58.41 -52.82 63.99 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.08 -1.013 . . . . 2.14 109.507 179.913 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' C' C ' 344' ' ' LEU . . . . . . . . . . . . . 86.4 mt -62.02 -25.02 67.41 Favored 'General case' 0 N--CA 1.488 1.454 0 O-C-N 121.344 -0.848 . . . . 0.22 109.23 -179.943 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' C' C ' 345' ' ' ASN . . . . . . . . . . . . . 6.9 t-20 -60.31 -61.43 2.61 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.322 -0.861 . . . . 1.08 109.341 -179.942 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' C' C ' 346' ' ' GLU . . . . . . . . . . . . . 34.5 tt0 -61.29 -23.2 65.53 Favored 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.316 -0.865 . . . . 2.21 109.487 -179.931 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' C' C ' 347' ' ' ALA . . . . . 0.418 ' HB1' ' HB1' ' D' ' 347' ' ' ALA . . . -63.2 -62.8 1.45 Allowed 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.308 -0.87 . . . . 0.18 109.776 -179.941 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' C' C ' 348' ' ' LEU . . . . . 0.523 HD13 ' HA ' ' C' ' 348' ' ' LEU . 3.5 mm? -61.6 -40.77 95.99 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.333 -0.854 . . . . 0.32 109.712 -179.676 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' C' C ' 349' ' ' GLU . . . . . 0.441 ' HA ' ' OE1' ' C' ' 349' ' ' GLU . 7.8 mm-40 -57.28 -38.66 74.26 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 120.994 -1.066 . . . . 2.19 109.52 -179.825 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' C' C ' 350' ' ' LEU . . . . . 0.518 HD22 HD22 ' D' ' 350' ' ' LEU . 9.5 tt -63.74 -44.02 94.75 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.429 -0.794 . . . . 0.46 109.07 179.853 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' C' C ' 351' ' ' LYS . . . . . . . . . . . . . 2.6 tttt -59.46 -39.4 83.52 Favored 'General case' 0 C--N 1.301 -1.532 0 O-C-N 121.504 -0.748 . . . . 1.35 109.431 179.981 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' C' C ' 352' ' ' ASP . . . . . . . . . . . . . 24.6 m-20 -58.44 -39.9 81.1 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.316 -0.865 . . . . 1.19 109.561 -179.781 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' C' C ' 353' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 1.569 0 O-C-N 121.276 -0.89 . . . . 0.57 109.795 -179.657 . . . . . . . . 0 0 . 1 . 026 nuclear nobuild core ' D' D ' 326' ' ' GLU . . . . . . . . . . . . . 33.9 mp0 . . . . . 0 N--CA 1.489 1.478 0 CA-C-O 121.413 0.625 . . . . 2.13 109.642 . . . . . . . . . 0 0 . 1 . 026 nuclear nobuild core ' D' D ' 327' ' ' TYR . . . . . . . . . . . . . 41.6 m-85 -149.62 112.21 4.76 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.321 -0.862 . . . . 0.47 109.784 -179.866 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' D' D ' 328' ' ' PHE . . . . . . . . . . . . . 98.7 m-85 -113.1 -169.41 1.48 Allowed 'General case' 0 C--N 1.302 -1.498 0 O-C-N 121.315 -0.866 . . . . 0.3 109.381 -179.969 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' D' D ' 329' ' ' THR . . . . . . . . . . . . . 16.9 p -152.66 168.71 24.73 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.222 -0.924 . . . . 0.22 109.639 -179.753 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' D' D ' 330' ' ' LEU . . . . . . . . . . . . . 41.4 tp -152.1 129.28 11.18 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.283 -0.885 . . . . 0.28 109.754 -179.982 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' D' D ' 331' ' ' GLN . . . . . . . . . . . . . 1.5 tt0 -87.55 115.31 24.89 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.112 -0.992 . . . . 0.93 109.291 179.654 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' D' D ' 332' ' ' ILE . . . . . 0.655 HG21 ' HA ' ' D' ' 338' ' ' PHE . 39.3 mt -103.2 102.92 14.33 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.562 0 O-C-N 121.165 -0.959 . . . . 0.25 109.739 -179.886 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' D' D ' 333' ' ' ARG . . . . . . . . . . . . . 49.3 mtt180 -71.84 141.88 49.61 Favored 'General case' 0 N--CA 1.487 1.403 0 O-C-N 121.372 -0.83 . . . . 2.93 109.189 179.626 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' D' D ' 334' ' ' GLY . . . . . . . . . . . . . . . 90.87 125.04 3.08 Favored Glycine 0 N--CA 1.492 2.377 0 N-CA-C 109.376 -1.49 . . . . 0.41 109.376 -179.931 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' D' D ' 335' ' ' ARG . . . . . 0.451 ' HA ' ' CE2' ' B' ' 328' ' ' PHE . 18.5 ttt180 -76.64 -40.64 48.57 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.158 -1.201 . . . . 3.03 109.734 -179.971 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' D' D ' 336' ' ' GLU . . . . . . . . . . . . . 24.1 tt0 -57.86 -58.58 7.76 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.269 -0.895 . . . . 2.26 109.785 -179.771 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' D' D ' 337' ' ' ARG . . . . . 0.46 ' NH1' ' CG ' ' D' ' 337' ' ' ARG . 0.0 OUTLIER -61.45 -32.33 72.31 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.072 -1.017 . . . . 2.92 109.581 -179.669 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild core ' D' D ' 338' ' ' PHE . . . . . 0.655 ' HA ' HG21 ' D' ' 332' ' ' ILE . 52.7 t80 -55.6 -53.24 58.91 Favored 'General case' 0 N--CA 1.489 1.492 0 O-C-N 121.304 -0.872 . . . . 0.37 109.527 179.926 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' D' D ' 339' ' ' GLU . . . . . . . . . . . . . 28.7 mt-10 -50.91 -32.3 20.22 Favored 'General case' 0 N--CA 1.494 1.762 0 O-C-N 121.308 -0.87 . . . . 1.99 110.109 -179.806 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' D' D ' 340' ' ' MET . . . . . . . . . . . . . 20.7 ttp -63.7 -51.28 65.75 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.069 -1.019 . . . . 0.31 109.642 -179.626 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' D' D ' 341' ' ' PHE . . . . . . . . . . . . . 34.9 m-85 -62.48 -41.59 98.89 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.11 -0.994 . . . . 0.18 109.937 -179.656 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' D' D ' 342' ' ' ARG . . . . . . . . . . . . . 6.4 tpt180 -49.27 -43.51 43.09 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.162 -0.961 . . . . 2.41 109.819 -179.793 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' D' D ' 343' ' ' GLU . . . . . . . . . . . . . 1.3 tt0 -59.26 -47.3 85.87 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.293 -0.879 . . . . 2.35 109.679 -179.766 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' D' D ' 344' ' ' LEU . . . . . . . . . . . . . 48.3 mt -61.42 -30.22 70.43 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.241 -0.912 . . . . 0.19 109.354 -179.89 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' D' D ' 345' ' ' ASN . . . . . . . . . . . . . 11.8 t-20 -58.67 -59.18 5.81 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.186 -0.946 . . . . 1.09 109.981 -179.979 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' D' D ' 346' ' ' GLU . . . . . . . . . . . . . 19.1 tt0 -60.87 -27.81 68.39 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.228 -0.92 . . . . 1.69 109.927 -179.542 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' D' D ' 347' ' ' ALA . . . . . 0.418 ' HB1' ' HB1' ' C' ' 347' ' ' ALA . . . -61.09 -61.49 2.53 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.082 -1.011 . . . . 0.18 110.111 -179.705 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' D' D ' 348' ' ' LEU . . . . . 0.629 HD22 ' N ' ' D' ' 348' ' ' LEU . 3.8 mm? -62.1 -45.89 91.49 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.368 -0.832 . . . . 0.31 110.239 -179.441 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' D' D ' 349' ' ' GLU . . . . . . . . . . . . . 3.8 mt-10 -57.6 -33.19 67.94 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.186 -0.946 . . . . 1.95 109.784 -179.299 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' D' D ' 350' ' ' LEU . . . . . 0.518 HD22 HD22 ' C' ' 350' ' ' LEU . 7.7 tt -65.01 -43.88 91.03 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.302 -0.874 . . . . 0.43 109.531 -179.98 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' D' D ' 351' ' ' LYS . . . . . . . . . . . . . 16.7 tttt -59.5 -50.16 74.98 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.502 -0.749 . . . . 1.4 109.543 -179.783 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' D' D ' 352' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 -56.62 -32.37 65.24 Favored 'General case' 0 N--CA 1.488 1.458 0 O-C-N 121.293 -0.879 . . . . 1.17 109.767 -179.799 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' D' D ' 353' ' ' ALA . . . . . . . . . . . . . . . -66.51 -32.31 73.58 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.296 -0.878 . . . . 0.59 109.929 -179.732 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' D' D ' 354' ' ' GLN . . . . . . . . . . . . . 19.9 mt-30 . . . . . 0 N--CA 1.49 1.552 0 O-C-N 121.1 -1.0 . . . . 1.44 109.687 -179.702 . . . . . . . . 0 0 . 1 . 027 nuclear nobuild core ' A' A ' 326' ' ' GLU . . . . . . . . . . . . . 5.7 mm-40 . . . . . 0 N--CA 1.492 1.657 0 N-CA-C 109.242 -0.651 . . . . 2.13 109.242 . . . . . . . . . 0 0 . 1 . 027 nuclear nobuild core ' A' A ' 327' ' ' TYR . . . . . 0.59 ' CE1' ' HG3' ' C' ' 333' ' ' ARG . 41.0 m-85 -148.76 108.07 3.94 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.25 -0.906 . . . . 0.48 109.849 -179.909 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 328' ' ' PHE . . . . . 0.477 ' CE2' ' HA ' ' C' ' 335' ' ' ARG . 46.7 m-85 -113.35 -166.45 1.09 Allowed 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.214 -0.929 . . . . 0.31 109.297 179.691 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 329' ' ' THR . . . . . . . . . . . . . 20.2 p -152.75 171.29 18.46 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.131 -0.98 . . . . 0.22 109.238 179.729 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 330' ' ' LEU . . . . . 0.773 HD11 HD22 ' C' ' 345' ' ' ASN . 35.0 tp -151.47 130.29 12.43 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.109 -0.995 . . . . 0.28 109.815 -179.799 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 331' ' ' GLN . . . . . . . . . . . . . 13.4 tp60 -88.22 109.12 19.67 Favored 'General case' 0 N--CA 1.488 1.471 0 O-C-N 121.446 -0.784 . . . . 0.91 108.938 179.463 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 332' ' ' ILE . . . . . . . . . . . . . 30.6 mt -103.21 106.68 20.55 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.6 0 O-C-N 120.965 -1.084 . . . . 0.26 109.641 -179.814 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 333' ' ' ARG . . . . . 0.463 ' HG2' ' CE1' ' C' ' 327' ' ' TYR . 61.8 mtt180 -72.81 148.67 44.29 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.205 -0.935 . . . . 2.92 109.585 179.873 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 334' ' ' GLY . . . . . . . . . . . . . . . 83.27 129.52 1.5 Allowed Glycine 0 N--CA 1.492 2.377 0 N-CA-C 109.648 -1.381 . . . . 0.4 109.648 179.734 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 335' ' ' ARG . . . . . . . . . . . . . 15.2 ttt180 -79.76 -32.8 41.03 Favored 'General case' 0 N--CA 1.489 1.476 0 O-C-N 121.27 -1.135 . . . . 3.01 109.486 179.774 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 336' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -56.87 -62.87 1.44 Allowed 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.359 -0.838 . . . . 2.29 109.415 -179.812 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 337' ' ' ARG . . . . . . . . . . . . . 1.4 mmt180 -60.92 -29.89 69.87 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.323 -0.861 . . . . 2.93 109.638 179.974 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 338' ' ' PHE . . . . . . . . . . . . . 72.0 t80 -54.72 -57.75 10.27 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.344 -0.848 . . . . 0.38 109.759 -179.881 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 339' ' ' GLU . . . . . . . . . . . . . 50.7 mt-10 -52.11 -36.18 50.26 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.087 -1.008 . . . . 1.97 109.958 -179.869 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 340' ' ' MET . . . . . . . . . . . . . 41.5 ttp -63.44 -46.39 86.54 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.137 -0.977 . . . . 0.31 109.888 -179.647 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 341' ' ' PHE . . . . . . . . . . . . . 39.9 m-85 -62.79 -46.25 88.86 Favored 'General case' 0 N--CA 1.494 1.74 0 O-C-N 121.106 -0.997 . . . . 0.18 110.076 -179.734 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 342' ' ' ARG . . . . . . . . . . . . . 22.3 ttt180 -49.38 -44.12 44.66 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.219 -0.926 . . . . 2.42 110.296 -179.414 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 343' ' ' GLU . . . . . . . . . . . . . 1.8 tp10 -57.33 -45.34 84.38 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.115 -0.991 . . . . 2.35 110.005 -179.735 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 344' ' ' LEU . . . . . 0.573 HD22 ' CD2' ' B' ' 344' ' ' LEU . 69.6 mt -62.59 -41.5 99.0 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.17 -0.956 . . . . 0.18 110.034 -179.558 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 345' ' ' ASN . . . . . 0.558 ' HB2' HD21 ' C' ' 330' ' ' LEU . 62.9 t-20 -56.95 -49.78 74.64 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.244 -0.91 . . . . 1.09 109.665 -179.737 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 346' ' ' GLU . . . . . . . . . . . . . 4.5 tp10 -62.72 -34.41 77.11 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.167 -0.958 . . . . 1.65 110.14 -179.788 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 347' ' ' ALA . . . . . 1.001 ' HB1' ' HB1' ' B' ' 347' ' ' ALA . . . -59.26 -55.44 34.83 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.083 -1.01 . . . . 0.18 109.956 -179.602 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 348' ' ' LEU . . . . . 0.564 HD22 ' N ' ' A' ' 348' ' ' LEU . 3.9 mm? -61.19 -44.62 97.01 Favored 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.345 -0.847 . . . . 0.3 109.871 -179.552 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 349' ' ' GLU . . . . . . . . . . . . . 2.5 mt-10 -57.4 -33.46 67.87 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.359 -0.838 . . . . 1.94 109.93 -179.364 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 350' ' ' LEU . . . . . 0.687 ' O ' HD23 ' A' ' 350' ' ' LEU . 4.8 tt -63.29 -46.27 87.51 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.175 -0.953 . . . . 0.46 109.299 -179.604 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 351' ' ' LYS . . . . . . . . . . . . . 42.8 tttt -59.58 -37.61 78.97 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.42 -0.8 . . . . 1.4 109.312 179.946 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 352' ' ' ASP . . . . . . . . . . . . . 3.5 m-20 -57.43 -43.6 84.0 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.34 -0.85 . . . . 1.16 109.698 179.837 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 353' ' ' ALA . . . . . . . . . . . . . . . -67.65 -18.69 65.04 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.183 -0.948 . . . . 0.63 109.936 -179.357 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 354' ' ' GLN . . . . . . . . . . . . . 5.7 tt0 . . . . . 0 N--CA 1.49 1.529 0 O-C-N 121.086 -1.009 . . . . 1.47 109.445 -179.887 . . . . . . . . 0 0 . 1 . 027 nuclear nobuild core ' B' B ' 326' ' ' GLU . . . . . . . . . . . . . 5.4 mm-40 . . . . . 0 N--CA 1.487 1.379 0 N-CA-C 109.209 -0.663 . . . . 2.13 109.209 . . . . . . . . . 0 0 . 1 . 027 nuclear nobuild core ' B' B ' 327' ' ' TYR . . . . . . . . . . . . . 40.0 m-85 -149.36 107.22 3.69 Favored 'General case' 0 C--N 1.303 -1.421 0 O-C-N 121.183 -0.948 . . . . 0.48 109.824 -179.983 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' B' B ' 328' ' ' PHE . . . . . . . . . . . . . 45.3 m-85 -113.03 -166.13 1.05 Allowed 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.213 -0.929 . . . . 0.32 109.12 179.8 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' B' B ' 329' ' ' THR . . . . . . . . . . . . . 22.4 p -153.33 170.63 20.17 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.321 -0.862 . . . . 0.23 109.197 -179.934 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' B' B ' 330' ' ' LEU . . . . . 0.587 HD11 HD22 ' D' ' 345' ' ' ASN . 33.4 tp -150.64 130.64 13.42 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.22 -0.925 . . . . 0.28 110.023 -179.804 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' B' B ' 331' ' ' GLN . . . . . . . . . . . . . 12.6 tp60 -88.49 108.87 19.62 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.335 -0.853 . . . . 0.91 108.934 179.415 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' B' B ' 332' ' ' ILE . . . . . . . . . . . . . 30.4 mt -103.08 106.75 20.65 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.546 0 O-C-N 121.171 -0.955 . . . . 0.24 109.651 -179.621 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' B' B ' 333' ' ' ARG . . . . . 0.41 ' HG2' ' CE1' ' D' ' 327' ' ' TYR . 62.2 mtt180 -72.89 148.81 44.03 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.361 -0.837 . . . . 2.93 109.632 179.911 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' B' B ' 334' ' ' GLY . . . . . . . . . . . . . . . 83.16 129.9 1.52 Allowed Glycine 0 N--CA 1.49 2.281 0 N-CA-C 109.569 -1.412 . . . . 0.4 109.569 179.585 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' B' B ' 335' ' ' ARG . . . . . . . . . . . . . 16.7 ttt180 -79.88 -32.81 40.37 Favored 'General case' 0 N--CA 1.489 1.5 0 O-C-N 121.351 -1.087 . . . . 3.01 109.425 179.929 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' B' B ' 336' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -57.22 -62.42 1.78 Allowed 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.063 -1.023 . . . . 2.28 109.677 -179.853 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' B' B ' 337' ' ' ARG . . . . . . . . . . . . . 1.1 mmt180 -61.11 -30.61 70.46 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.223 -0.923 . . . . 2.93 109.625 -179.907 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' B' B ' 338' ' ' PHE . . . . . . . . . . . . . 69.0 t80 -54.4 -56.8 15.0 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.315 -0.865 . . . . 0.37 109.731 -179.82 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' B' B ' 339' ' ' GLU . . . . . . . . . . . . . 51.7 mt-10 -52.86 -35.59 57.79 Favored 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.24 -0.912 . . . . 1.98 109.824 -179.692 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' B' B ' 340' ' ' MET . . . . . . . . . . . . . 42.1 ttp -63.87 -46.46 84.82 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.211 -0.931 . . . . 0.32 109.874 -179.678 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' B' B ' 341' ' ' PHE . . . . . . . . . . . . . 39.6 m-85 -62.73 -46.12 89.58 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.212 -0.93 . . . . 0.18 110.055 -179.57 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' B' B ' 342' ' ' ARG . . . . . . . . . . . . . 23.0 ttt180 -48.98 -43.93 40.56 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.302 -0.874 . . . . 2.42 110.318 -179.584 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' B' B ' 343' ' ' GLU . . . . . . . . . . . . . 1.9 tp10 -58.14 -45.0 88.12 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.224 -0.922 . . . . 2.35 109.934 -179.309 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' B' B ' 344' ' ' LEU . . . . . 0.573 ' CD2' HD22 ' A' ' 344' ' ' LEU . 70.6 mt -62.68 -42.26 99.53 Favored 'General case' 0 N--CA 1.488 1.459 0 O-C-N 121.18 -0.95 . . . . 0.18 109.808 -179.693 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' B' B ' 345' ' ' ASN . . . . . 0.603 HD22 HD11 ' D' ' 330' ' ' LEU . 63.2 t-20 -55.9 -49.97 71.96 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.197 -0.939 . . . . 1.09 109.786 -179.804 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' B' B ' 346' ' ' GLU . . . . . . . . . . . . . 4.3 tp10 -62.98 -34.65 78.0 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.261 -0.899 . . . . 1.66 109.909 -179.584 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' B' B ' 347' ' ' ALA . . . . . 1.001 ' HB1' ' HB1' ' A' ' 347' ' ' ALA . . . -58.99 -55.79 30.57 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.072 -1.018 . . . . 0.17 110.047 -179.587 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' B' B ' 348' ' ' LEU . . . . . 0.58 HD22 ' N ' ' B' ' 348' ' ' LEU . 3.9 mm? -60.86 -45.05 96.06 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.213 -0.93 . . . . 0.29 109.804 -179.709 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' B' B ' 349' ' ' GLU . . . . . . . . . . . . . 2.6 mt-10 -57.21 -32.84 66.91 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.442 -0.786 . . . . 1.95 110.06 -179.509 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' B' B ' 350' ' ' LEU . . . . . 0.681 ' O ' HD23 ' B' ' 350' ' ' LEU . 4.8 tt -63.82 -46.7 83.91 Favored 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.091 -1.006 . . . . 0.45 109.399 -179.685 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' B' B ' 351' ' ' LYS . . . . . . . . . . . . . 42.6 tttt -59.19 -37.15 76.69 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.299 -0.876 . . . . 1.38 109.294 179.716 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' B' B ' 352' ' ' ASP . . . . . . . . . . . . . 2.3 m-20 -57.84 -43.46 85.86 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.336 -0.853 . . . . 1.16 109.873 -179.979 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' B' B ' 353' ' ' ALA . . . . . . . . . . . . . . . -67.42 -19.4 65.37 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.313 -0.867 . . . . 0.61 109.834 -179.722 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' B' B ' 354' ' ' GLN . . . . . . . . . . . . . 5.7 tt0 . . . . . 0 N--CA 1.493 1.676 0 O-C-N 121.037 -1.039 . . . . 1.45 109.534 -179.713 . . . . . . . . 0 0 . 1 . 027 nuclear nobuild core ' C' C ' 326' ' ' GLU . . . . . . . . . . . . . 1.8 mt-10 . . . . . 0 N--CA 1.488 1.444 0 N-CA-C 109.066 -0.716 . . . . 2.17 109.066 . . . . . . . . . 0 0 . 1 . 027 nuclear nobuild core ' C' C ' 327' ' ' TYR . . . . . 0.463 ' CE1' ' HG2' ' A' ' 333' ' ' ARG . 39.9 m-85 -150.81 108.37 3.65 Favored 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.139 -0.976 . . . . 0.48 109.86 -179.99 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' C' C ' 328' ' ' PHE . . . . . . . . . . . . . 98.4 m-85 -113.79 -166.97 1.14 Allowed 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.149 -0.97 . . . . 0.33 109.453 179.731 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' C' C ' 329' ' ' THR . . . . . 0.422 ' HA ' ' O ' ' A' ' 330' ' ' LEU . 6.7 p -152.03 172.41 16.34 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.107 -0.996 . . . . 0.23 109.595 -179.929 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' C' C ' 330' ' ' LEU . . . . . 0.558 HD21 ' HB2' ' A' ' 345' ' ' ASN . 31.1 tp -151.69 130.14 12.15 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.137 -0.977 . . . . 0.28 109.757 -179.609 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' C' C ' 331' ' ' GLN . . . . . . . . . . . . . 2.4 tp60 -86.85 109.85 19.58 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.208 -0.933 . . . . 1.48 109.355 179.8 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' C' C ' 332' ' ' ILE . . . . . 0.749 HG21 ' HA ' ' C' ' 338' ' ' PHE . 70.1 mt -103.16 106.04 19.37 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.518 0 O-C-N 121.185 -0.947 . . . . 0.24 109.945 -179.616 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' C' C ' 333' ' ' ARG . . . . . 0.59 ' HG3' ' CE1' ' A' ' 327' ' ' TYR . 0.0 OUTLIER -72.27 151.61 42.69 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.381 -0.825 . . . . 2.74 109.174 179.588 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild core ' C' C ' 334' ' ' GLY . . . . . . . . . . . . . . . 80.19 129.92 0.84 Allowed Glycine 0 N--CA 1.49 2.237 0 N-CA-C 109.434 -1.466 . . . . 0.35 109.434 -179.91 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' C' C ' 335' ' ' ARG . . . . . 0.477 ' HA ' ' CE2' ' A' ' 328' ' ' PHE . 10.1 ttp180 -79.18 -35.8 41.28 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.246 -1.15 . . . . 2.53 109.876 -179.678 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' C' C ' 336' ' ' GLU . . . . . . . . . . . . . 89.4 mt-10 -58.6 -63.01 1.44 Allowed 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.201 -0.937 . . . . 2.62 109.921 -179.697 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' C' C ' 337' ' ' ARG . . . . . 0.46 ' NH1' ' CG ' ' C' ' 337' ' ' ARG . 0.3 OUTLIER -59.16 -31.06 68.63 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.126 -0.983 . . . . 2.81 109.278 179.966 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild core ' C' C ' 338' ' ' PHE . . . . . 0.749 ' HA ' HG21 ' C' ' 332' ' ' ILE . 66.8 t80 -52.95 -58.58 6.48 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.272 -0.892 . . . . 0.4 109.071 179.57 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' C' C ' 339' ' ' GLU . . . . . . . . . . . . . 2.7 mm-40 -51.55 -31.29 23.84 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.341 -0.849 . . . . 2.05 109.741 179.713 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' C' C ' 340' ' ' MET . . . . . . . . . . . . . 29.5 ttp -63.74 -53.14 55.66 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.153 -0.967 . . . . 0.32 109.681 -179.811 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' C' C ' 341' ' ' PHE . . . . . 0.442 ' HB2' HD13 ' C' ' 332' ' ' ILE . 46.0 m-85 -60.58 -38.1 83.51 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.345 -0.847 . . . . 0.18 109.413 -179.989 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' C' C ' 342' ' ' ARG . . . . . . . . . . . . . 11.7 ttp180 -51.71 -53.14 42.54 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.449 -0.782 . . . . 2.91 110.283 -179.683 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' C' C ' 343' ' ' GLU . . . . . . . . . . . . . 15.9 tp10 -55.73 -42.16 74.93 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.199 -0.938 . . . . 2.14 110.26 -179.135 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' C' C ' 344' ' ' LEU . . . . . 0.452 ' O ' HD23 ' C' ' 348' ' ' LEU . 57.7 mt -61.83 -40.85 96.74 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.117 -0.99 . . . . 0.22 109.503 -179.706 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' C' C ' 345' ' ' ASN . . . . . 0.773 HD22 HD11 ' A' ' 330' ' ' LEU . 46.8 t-20 -57.6 -51.08 70.97 Favored 'General case' 0 C--N 1.303 -1.451 0 O-C-N 121.441 -0.787 . . . . 1.08 109.331 179.803 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' C' C ' 346' ' ' GLU . . . . . . . . . . . . . 3.6 tm-20 -61.75 -32.4 72.65 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.376 -0.828 . . . . 2.21 109.751 -179.993 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' C' C ' 347' ' ' ALA . . . . . 0.732 ' HB1' ' HB1' ' D' ' 347' ' ' ALA . . . -62.79 -52.85 61.56 Favored 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.249 -0.907 . . . . 0.18 109.821 -179.846 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' C' C ' 348' ' ' LEU . . . . . 0.547 HD22 ' N ' ' C' ' 348' ' ' LEU . 4.2 mm? -61.13 -48.89 79.54 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.284 -0.885 . . . . 0.32 109.644 -179.544 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' C' C ' 349' ' ' GLU . . . . . . . . . . . . . 61.1 mt-10 -58.71 -31.21 68.06 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.293 -0.88 . . . . 2.19 109.754 -179.797 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' C' C ' 350' ' ' LEU . . . . . 0.911 ' CD2' HD13 ' D' ' 350' ' ' LEU . 10.2 tt -63.37 -40.72 98.02 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.218 -0.926 . . . . 0.46 109.109 179.838 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' C' C ' 351' ' ' LYS . . . . . . . . . . . . . 36.1 tttm -61.4 -43.22 99.25 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.362 -0.836 . . . . 1.35 109.483 179.869 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' C' C ' 352' ' ' ASP . . . . . . . . . . . . . 4.4 m-20 -56.23 -49.04 75.27 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.246 -0.909 . . . . 1.19 109.551 -179.957 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' C' C ' 353' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.488 1.471 0 O-C-N 121.312 -0.868 . . . . 0.57 109.363 -179.886 . . . . . . . . 0 0 . 1 . 027 nuclear nobuild core ' D' D ' 326' ' ' GLU . . . . . . . . . . . . . 5.6 mm-40 . . . . . 0 N--CA 1.489 1.476 0 N-CA-C 109.039 -0.726 . . . . 2.13 109.039 . . . . . . . . . 0 0 . 1 . 027 nuclear nobuild core ' D' D ' 327' ' ' TYR . . . . . 0.41 ' CE1' ' HG2' ' B' ' 333' ' ' ARG . 41.2 m-85 -149.54 107.25 3.67 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.106 -0.996 . . . . 0.47 109.75 -179.899 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' D' D ' 328' ' ' PHE . . . . . . . . . . . . . 45.9 m-85 -112.99 -166.06 1.05 Allowed 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.336 -0.852 . . . . 0.3 109.458 179.708 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' D' D ' 329' ' ' THR . . . . . . . . . . . . . 30.8 p -153.07 170.46 20.41 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.167 -0.958 . . . . 0.22 109.348 179.879 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' D' D ' 330' ' ' LEU . . . . . 0.603 HD11 HD22 ' B' ' 345' ' ' ASN . 32.4 tp -150.46 130.41 13.4 Favored 'General case' 0 C--N 1.304 -1.41 0 O-C-N 121.125 -0.984 . . . . 0.28 109.911 -179.973 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' D' D ' 331' ' ' GLN . . . . . . . . . . . . . 11.0 tp60 -88.41 108.56 19.43 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.427 -0.795 . . . . 0.93 108.961 179.526 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' D' D ' 332' ' ' ILE . . . . . . . . . . . . . 25.3 mt -103.0 106.41 20.01 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.617 0 O-C-N 121.045 -1.034 . . . . 0.25 109.831 -179.632 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' D' D ' 333' ' ' ARG . . . . . . . . . . . . . 60.6 mtt180 -72.46 148.35 45.21 Favored 'General case' 0 N--CA 1.488 1.452 0 O-C-N 121.403 -0.811 . . . . 2.93 109.574 179.956 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' D' D ' 334' ' ' GLY . . . . . . . . . . . . . . . 83.47 130.43 1.71 Allowed Glycine 0 N--CA 1.492 2.37 0 N-CA-C 109.834 -1.306 . . . . 0.41 109.834 179.676 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' D' D ' 335' ' ' ARG . . . . . . . . . . . . . 19.5 ttt180 -79.82 -32.81 40.67 Favored 'General case' 0 N--CA 1.489 1.478 0 O-C-N 121.293 -1.122 . . . . 3.03 109.499 179.851 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' D' D ' 336' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -57.44 -63.49 1.21 Allowed 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.272 -0.892 . . . . 2.26 109.636 -179.91 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' D' D ' 337' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -60.45 -29.88 69.3 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.112 -0.992 . . . . 2.92 109.694 -179.983 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' D' D ' 338' ' ' PHE . . . . . . . . . . . . . 69.2 t80 -55.23 -56.7 16.95 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.224 -0.922 . . . . 0.37 109.648 -179.722 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' D' D ' 339' ' ' GLU . . . . . . . . . . . . . 52.9 mt-10 -52.53 -35.62 53.81 Favored 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.278 -0.889 . . . . 1.99 109.948 -179.824 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' D' D ' 340' ' ' MET . . . . . . . . . . . . . 42.4 ttp -63.94 -45.98 86.74 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.25 -0.906 . . . . 0.31 109.916 -179.615 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' D' D ' 341' ' ' PHE . . . . . . . . . . . . . 40.1 m-85 -63.44 -45.53 90.47 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.306 -0.871 . . . . 0.18 110.005 -179.464 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' D' D ' 342' ' ' ARG . . . . . . . . . . . . . 22.1 ttt180 -49.4 -43.5 44.47 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.172 -0.955 . . . . 2.41 110.145 -179.401 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' D' D ' 343' ' ' GLU . . . . . . . . . . . . . 2.1 tp10 -57.98 -45.44 86.75 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.138 -0.976 . . . . 2.35 109.96 -179.263 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' D' D ' 344' ' ' LEU . . . . . . . . . . . . . 70.9 mt -62.5 -42.28 99.4 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.257 -0.902 . . . . 0.19 109.956 -179.661 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' D' D ' 345' ' ' ASN . . . . . 0.587 HD22 HD11 ' B' ' 330' ' ' LEU . 63.5 t-20 -56.27 -49.56 73.87 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.145 -0.972 . . . . 1.09 109.471 -179.723 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' D' D ' 346' ' ' GLU . . . . . . . . . . . . . 4.1 tp10 -62.64 -34.96 78.13 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.269 -0.894 . . . . 1.69 110.116 -179.932 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' D' D ' 347' ' ' ALA . . . . . 0.732 ' HB1' ' HB1' ' C' ' 347' ' ' ALA . . . -59.44 -56.04 27.09 Favored 'General case' 0 N--CA 1.493 1.692 0 O-C-N 120.984 -1.072 . . . . 0.18 110.104 -179.611 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' D' D ' 348' ' ' LEU . . . . . 0.583 HD22 ' N ' ' D' ' 348' ' ' LEU . 3.9 mm? -60.67 -44.84 95.99 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.156 -0.965 . . . . 0.31 109.789 -179.761 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' D' D ' 349' ' ' GLU . . . . . . . . . . . . . 2.5 mt-10 -57.71 -32.62 67.58 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.421 -0.8 . . . . 1.95 109.97 -179.45 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' D' D ' 350' ' ' LEU . . . . . 0.911 HD13 ' CD2' ' C' ' 350' ' ' LEU . 4.9 tt -63.8 -46.75 83.74 Favored 'General case' 0 N--CA 1.489 1.479 0 O-C-N 120.927 -1.108 . . . . 0.43 109.365 -179.79 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' D' D ' 351' ' ' LYS . . . . . . . . . . . . . 39.0 tttt -59.29 -36.7 76.07 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.443 -0.786 . . . . 1.4 109.413 -179.935 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' D' D ' 352' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -58.31 -43.08 87.99 Favored 'General case' 0 N--CA 1.489 1.475 0 O-C-N 121.34 -0.85 . . . . 1.17 109.634 -179.961 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' D' D ' 353' ' ' ALA . . . . . . . . . . . . . . . -67.59 -19.06 65.2 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.201 -0.937 . . . . 0.59 110.091 -179.413 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' D' D ' 354' ' ' GLN . . . . . . . . . . . . . 5.9 tt0 . . . . . 0 N--CA 1.489 1.516 0 O-C-N 121.285 -0.885 . . . . 1.44 109.554 -179.744 . . . . . . . . 0 0 . 1 . 028 nuclear nobuild core ' A' A ' 326' ' ' GLU . . . . . . . . . . . . . 32.2 mm-40 . . . . . 0 N--CA 1.488 1.447 0 CA-C-O 121.375 0.607 . . . . 2.13 109.594 . . . . . . . . . 0 0 . 1 . 028 nuclear nobuild core ' A' A ' 327' ' ' TYR . . . . . 0.424 ' CE1' ' HG2' ' C' ' 333' ' ' ARG . 39.4 m-85 -148.24 110.99 4.77 Favored 'General case' 0 C--N 1.303 -1.416 0 O-C-N 121.246 -0.909 . . . . 0.48 109.759 179.998 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 328' ' ' PHE . . . . . . . . . . . . . 29.5 m-85 -113.9 -171.78 1.96 Allowed 'General case' 0 C--N 1.301 -1.533 0 O-C-N 121.428 -0.795 . . . . 0.31 109.395 179.753 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 329' ' ' THR . . . . . . . . . . . . . 3.3 p -149.16 167.0 27.14 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.307 -0.871 . . . . 0.22 109.059 179.898 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 330' ' ' LEU . . . . . 0.413 ' O ' ' HA ' ' C' ' 329' ' ' THR . 63.3 tp -149.82 129.29 13.01 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.313 -0.867 . . . . 0.28 109.762 -179.576 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 331' ' ' GLN . . . . . . . . . . . . . 1.1 tp60 -87.32 113.2 22.83 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.394 -0.816 . . . . 0.91 109.418 179.701 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 332' ' ' ILE . . . . . 0.665 HG21 ' HA ' ' A' ' 338' ' ' PHE . 69.7 mt -102.19 107.63 22.16 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.527 0 O-C-N 121.112 -0.993 . . . . 0.26 109.611 -179.959 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 333' ' ' ARG . . . . . 0.462 ' HG2' ' CE1' ' C' ' 327' ' ' TYR . 76.1 mtt180 -72.51 143.75 48.25 Favored 'General case' 0 C--N 1.303 -1.445 0 O-C-N 121.492 -0.755 . . . . 2.92 109.456 179.925 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 334' ' ' GLY . . . . . . . . . . . . . . . 85.43 128.26 1.98 Allowed Glycine 0 N--CA 1.49 2.252 0 N-CA-C 109.596 -1.402 . . . . 0.4 109.596 179.949 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 335' ' ' ARG . . . . . . . . . . . . . 9.2 ttp180 -77.06 -33.36 57.22 Favored 'General case' 0 C--N 1.303 -1.433 0 O-C-N 121.388 -1.066 . . . . 3.01 109.197 179.903 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 336' ' ' GLU . . . . . . . . . . . . . 15.1 mt-10 -59.19 -63.89 1.14 Allowed 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.326 -0.859 . . . . 2.29 109.936 -179.781 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 337' ' ' ARG . . . . . 0.46 ' NH1' ' CG ' ' A' ' 337' ' ' ARG . 0.0 OUTLIER -59.25 -29.83 67.83 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 120.985 -1.072 . . . . 2.93 109.496 -179.791 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild core ' A' A ' 338' ' ' PHE . . . . . 0.665 ' HA ' HG21 ' A' ' 332' ' ' ILE . 66.5 t80 -55.3 -54.14 47.22 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.199 -0.938 . . . . 0.38 109.544 179.867 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 339' ' ' GLU . . . . . . . . . . . . . 44.6 mt-10 -53.89 -35.37 61.51 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.26 -0.9 . . . . 1.97 109.91 179.979 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 340' ' ' MET . . . . . . . . . . . . . 6.7 ttp -63.46 -52.74 60.12 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.17 -0.956 . . . . 0.31 110.442 -179.075 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 341' ' ' PHE . . . . . . . . . . . . . 51.7 m-85 -60.74 -42.38 97.22 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.05 -1.031 . . . . 0.18 109.816 -179.353 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 342' ' ' ARG . . . . . . . . . . . . . 60.6 ttt180 -50.86 -43.34 59.31 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.357 -0.84 . . . . 2.42 109.884 -179.73 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 343' ' ' GLU . . . . . . . . . . . . . 3.9 tt0 -59.67 -45.99 90.4 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.178 -0.951 . . . . 2.35 109.954 -179.553 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 344' ' ' LEU . . . . . 0.456 HD22 ' CD2' ' B' ' 344' ' ' LEU . 42.8 mt -61.3 -38.69 87.72 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.248 -0.907 . . . . 0.18 109.889 -179.625 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 345' ' ' ASN . . . . . . . . . . . . . 64.2 t-20 -57.77 -49.64 75.9 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.202 -0.936 . . . . 1.09 110.002 -179.773 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 346' ' ' GLU . . . . . . . . . . . . . 45.8 tt0 -60.78 -33.1 72.47 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.103 -0.998 . . . . 1.65 109.837 -179.666 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 347' ' ' ALA . . . . . 0.973 ' HB1' ' HB1' ' B' ' 347' ' ' ALA . . . -59.7 -55.4 34.81 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.058 -1.026 . . . . 0.18 110.013 -179.618 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 348' ' ' LEU . . . . . 0.629 HD22 ' N ' ' A' ' 348' ' ' LEU . 3.9 mm? -62.7 -40.22 96.46 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.167 -0.958 . . . . 0.3 109.909 -179.455 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 349' ' ' GLU . . . . . 0.449 ' OE2' ' HD3' ' C' ' 333' ' ' ARG . 7.3 mm-40 -57.65 -39.48 77.11 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.218 -0.926 . . . . 1.94 109.792 -179.431 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 350' ' ' LEU . . . . . 0.705 HD13 HD22 ' B' ' 350' ' ' LEU . 7.6 tt -61.86 -44.59 96.52 Favored 'General case' 0 N--CA 1.488 1.463 0 O-C-N 121.321 -0.862 . . . . 0.46 109.334 -179.972 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 351' ' ' LYS . . . . . . . . . . . . . 42.0 tttt -58.85 -43.5 90.81 Favored 'General case' 0 N--CA 1.488 1.468 0 O-C-N 121.326 -0.859 . . . . 1.4 109.235 179.98 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 352' ' ' ASP . . . . . . . . . . . . . 7.3 m-20 -56.65 -55.37 34.93 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.346 -0.846 . . . . 1.16 109.676 -179.976 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 353' ' ' ALA . . . . . . . . . . . . . . . -69.02 -11.45 60.8 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.23 -0.919 . . . . 0.63 109.386 179.937 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 354' ' ' GLN . . . . . 0.409 ' HB2' ' O ' ' A' ' 350' ' ' LEU . 2.9 tt0 . . . . . 0 N--CA 1.489 1.511 0 O-C-N 121.181 -0.95 . . . . 1.47 109.488 -179.699 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' B' B ' 326' ' ' GLU . . . . . . . . . . . . . 30.9 mm-40 . . . . . 0 N--CA 1.49 1.565 0 CA-C-O 121.392 0.615 . . . . 2.13 109.522 . . . . . . . . . 0 0 . 1 . 028 nuclear nobuild core ' B' B ' 327' ' ' TYR . . . . . . . . . . . . . 38.0 m-85 -148.62 110.51 4.55 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.324 -0.86 . . . . 0.48 109.764 -179.695 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' B' B ' 328' ' ' PHE . . . . . 0.442 ' CZ ' ' HB2' ' D' ' 335' ' ' ARG . 30.7 m-85 -114.3 -172.9 2.19 Favored 'General case' 0 N--CA 1.489 1.491 0 O-C-N 121.53 -0.731 . . . . 0.32 109.626 179.862 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' B' B ' 329' ' ' THR . . . . . 0.418 ' HA ' ' O ' ' D' ' 330' ' ' LEU . 3.2 p -148.36 167.19 25.89 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.096 -1.002 . . . . 0.23 109.143 -179.905 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' B' B ' 330' ' ' LEU . . . . . . . . . . . . . 62.0 tp -150.17 129.6 12.97 Favored 'General case' 0 C--N 1.303 -1.438 0 O-C-N 121.238 -0.914 . . . . 0.28 109.617 -179.501 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' B' B ' 331' ' ' GLN . . . . . . . . . . . . . 1.1 tp60 -87.47 114.17 23.84 Favored 'General case' 0 C--N 1.304 -1.412 0 O-C-N 121.3 -0.875 . . . . 0.91 109.007 179.608 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' B' B ' 332' ' ' ILE . . . . . 0.643 HG21 ' HA ' ' B' ' 338' ' ' PHE . 70.1 mt -102.87 106.75 20.59 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.465 0 O-C-N 121.227 -0.921 . . . . 0.24 109.256 -179.749 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' B' B ' 333' ' ' ARG . . . . . . . . . . . . . 74.9 mtt180 -71.78 144.42 49.2 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.157 -0.964 . . . . 2.93 109.458 -179.871 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' B' B ' 334' ' ' GLY . . . . . . . . . . . . . . . 84.75 128.39 1.79 Allowed Glycine 0 N--CA 1.489 2.229 0 N-CA-C 109.741 -1.344 . . . . 0.4 109.741 179.886 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' B' B ' 335' ' ' ARG . . . . . . . . . . . . . 8.5 ttp180 -77.42 -32.96 55.02 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.321 -1.106 . . . . 3.01 109.449 179.866 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' B' B ' 336' ' ' GLU . . . . . . . . . . . . . 14.1 mt-10 -59.77 -62.8 1.61 Allowed 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.242 -0.911 . . . . 2.28 109.843 -179.69 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' B' B ' 337' ' ' ARG . . . . . 0.476 HH11 ' CG ' ' B' ' 337' ' ' ARG . 0.0 OUTLIER -59.96 -30.04 68.83 Favored 'General case' 0 N--CA 1.488 1.472 0 O-C-N 121.166 -0.959 . . . . 2.93 109.354 -179.794 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild core ' B' B ' 338' ' ' PHE . . . . . 0.643 ' HA ' HG21 ' B' ' 332' ' ' ILE . 66.8 t80 -55.39 -53.75 52.31 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.146 -0.971 . . . . 0.37 109.629 179.9 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' B' B ' 339' ' ' GLU . . . . . . . . . . . . . 49.3 mt-10 -53.84 -35.83 61.91 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.134 -0.979 . . . . 1.98 109.976 179.827 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' B' B ' 340' ' ' MET . . . . . . . . . . . . . 6.2 ttp -63.12 -52.21 63.48 Favored 'General case' 0 N--CA 1.495 1.785 0 O-C-N 121.196 -0.94 . . . . 0.32 110.649 -179.141 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' B' B ' 341' ' ' PHE . . . . . . . . . . . . . 49.5 m-85 -60.93 -43.49 98.57 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.13 -0.981 . . . . 0.18 109.59 -179.494 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' B' B ' 342' ' ' ARG . . . . . . . . . . . . . 61.7 ttt180 -49.99 -43.38 50.45 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.433 -0.792 . . . . 2.42 109.993 -179.841 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' B' B ' 343' ' ' GLU . . . . . . . . . . . . . 3.7 tt0 -59.88 -45.86 91.16 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.232 -0.918 . . . . 2.35 110.14 -179.536 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' B' B ' 344' ' ' LEU . . . . . 0.456 ' CD2' HD22 ' A' ' 344' ' ' LEU . 43.5 mt -61.84 -37.95 86.36 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.189 -0.945 . . . . 0.18 110.024 -179.621 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' B' B ' 345' ' ' ASN . . . . . 0.543 HD22 HD11 ' D' ' 330' ' ' LEU . 64.8 t-20 -58.23 -49.05 78.45 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.291 -0.88 . . . . 1.09 109.879 -179.708 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' B' B ' 346' ' ' GLU . . . . . . . . . . . . . 46.8 tt0 -60.98 -32.95 72.5 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.209 -0.932 . . . . 1.66 109.819 -179.669 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' B' B ' 347' ' ' ALA . . . . . 0.973 ' HB1' ' HB1' ' A' ' 347' ' ' ALA . . . -60.03 -56.18 24.87 Favored 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.101 -1.0 . . . . 0.17 110.009 -179.598 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' B' B ' 348' ' ' LEU . . . . . 0.642 HD22 ' N ' ' B' ' 348' ' ' LEU . 3.9 mm? -62.25 -40.36 95.94 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.284 -0.885 . . . . 0.29 109.866 -179.567 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' B' B ' 349' ' ' GLU . . . . . . . . . . . . . 7.2 mm-40 -57.43 -39.17 75.65 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 121.211 -0.93 . . . . 1.95 109.913 -179.648 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' B' B ' 350' ' ' LEU . . . . . 0.705 HD22 HD13 ' A' ' 350' ' ' LEU . 7.7 tt -62.35 -45.29 93.84 Favored 'General case' 0 N--CA 1.488 1.456 0 O-C-N 121.201 -0.937 . . . . 0.45 109.242 -179.786 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' B' B ' 351' ' ' LYS . . . . . . . . . . . . . 39.2 tttt -58.16 -43.94 87.69 Favored 'General case' 0 C--N 1.302 -1.457 0 O-C-N 121.297 -0.877 . . . . 1.38 109.286 179.975 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' B' B ' 352' ' ' ASP . . . . . . . . . . . . . 7.4 m-20 -56.13 -55.72 29.56 Favored 'General case' 0 N--CA 1.488 1.439 0 O-C-N 121.279 -0.888 . . . . 1.16 109.526 -179.953 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' B' B ' 353' ' ' ALA . . . . . . . . . . . . . . . -68.38 -12.35 60.98 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.153 -0.967 . . . . 0.61 109.777 179.977 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' B' B ' 354' ' ' GLN . . . . . 0.437 ' NE2' ' CD1' ' A' ' 350' ' ' LEU . 3.2 tt0 . . . . . 0 N--CA 1.492 1.666 0 O-C-N 121.326 -0.859 . . . . 1.45 109.683 -179.772 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' C' C ' 326' ' ' GLU . . . . . 0.51 ' HB3' ' CE2' ' C' ' 328' ' ' PHE . 13.5 mm-40 . . . . . 0 N--CA 1.49 1.562 0 N-CA-C 109.398 -0.593 . . . . 2.17 109.398 . . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' C' C ' 327' ' ' TYR . . . . . 0.462 ' CE1' ' HG2' ' A' ' 333' ' ' ARG . 38.4 m-85 -147.22 99.09 3.11 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.184 -0.948 . . . . 0.48 109.475 179.965 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' C' C ' 328' ' ' PHE . . . . . 0.51 ' CE2' ' HB3' ' C' ' 326' ' ' GLU . 95.0 m-85 -106.85 -167.03 1.23 Allowed 'General case' 0 N--CA 1.487 1.406 0 O-C-N 121.485 -0.759 . . . . 0.33 109.055 179.914 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' C' C ' 329' ' ' THR . . . . . 0.413 ' HA ' ' O ' ' A' ' 330' ' ' LEU . 41.5 p -150.98 169.0 22.86 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.31 -0.869 . . . . 0.23 109.353 179.967 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' C' C ' 330' ' ' LEU . . . . . 0.401 HD12 ' HA ' ' C' ' 330' ' ' LEU . 29.0 tp -148.72 127.52 12.58 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.214 -0.929 . . . . 0.28 109.622 -179.853 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' C' C ' 331' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -87.62 111.64 21.47 Favored 'General case' 0 N--CA 1.489 1.479 0 O-C-N 121.308 -0.87 . . . . 1.48 109.367 179.806 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' C' C ' 332' ' ' ILE . . . . . 0.439 HD12 ' CD1' ' C' ' 338' ' ' PHE . 7.3 mt -103.9 108.04 23.67 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.448 0 O-C-N 121.183 -0.948 . . . . 0.24 109.436 179.748 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' C' C ' 333' ' ' ARG . . . . . 0.468 ' NH1' ' HG2' ' C' ' 333' ' ' ARG . 0.0 OUTLIER -73.47 158.39 35.02 Favored 'General case' 0 C--N 1.303 -1.424 0 O-C-N 121.293 -0.879 . . . . 2.74 108.871 179.516 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild core ' C' C ' 334' ' ' GLY . . . . . . . . . . . . . . . 74.04 125.94 0.13 Allowed Glycine 0 N--CA 1.491 2.303 0 N-CA-C 109.452 -1.459 . . . . 0.35 109.452 -179.929 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' C' C ' 335' ' ' ARG . . . . . 0.521 ' HG3' ' NH1' ' C' ' 335' ' ' ARG . 0.0 OUTLIER -74.75 -33.32 62.31 Favored 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.117 -1.226 . . . . 2.53 109.775 -179.861 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild core ' C' C ' 336' ' ' GLU . . . . . . . . . . . . . 1.3 mt-10 -57.49 -59.84 4.55 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.115 -0.991 . . . . 2.62 109.678 -179.88 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' C' C ' 337' ' ' ARG . . . . . . . . . . . . . 1.7 mpt_? -61.16 -32.97 72.69 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.252 -0.905 . . . . 2.81 109.982 -179.688 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' C' C ' 338' ' ' PHE . . . . . 0.439 ' CD1' HD12 ' C' ' 332' ' ' ILE . 63.7 t80 -55.49 -61.62 2.22 Favored 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.041 -1.037 . . . . 0.4 109.615 -179.797 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' C' C ' 339' ' ' GLU . . . . . . . . . . . . . 1.1 mm-40 -49.38 -36.64 22.39 Favored 'General case' 0 C--N 1.3 -1.547 0 O-C-N 121.407 -0.808 . . . . 2.05 110.358 -179.114 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' C' C ' 340' ' ' MET . . . . . . . . . . . . . 37.9 ttp -63.9 -48.5 76.37 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.036 -1.04 . . . . 0.32 110.051 -179.212 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' C' C ' 341' ' ' PHE . . . . . . . . . . . . . 38.8 m-85 -61.37 -45.92 92.35 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 120.951 -1.093 . . . . 0.18 109.539 -179.763 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' C' C ' 342' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -47.63 -38.42 14.67 Favored 'General case' 0 N--CA 1.489 1.491 0 O-C-N 121.252 -0.905 . . . . 2.91 109.959 -179.804 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' C' C ' 343' ' ' GLU . . . . . . . . . . . . . 29.0 tp10 -59.04 -50.96 72.09 Favored 'General case' 0 N--CA 1.488 1.47 0 O-C-N 121.182 -0.949 . . . . 2.14 109.598 -179.906 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' C' C ' 344' ' ' LEU . . . . . . . . . . . . . 70.8 mt -62.37 -31.55 72.22 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.364 -0.835 . . . . 0.22 109.56 179.931 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' C' C ' 345' ' ' ASN . . . . . . . . . . . . . 18.7 t-20 -57.07 -58.36 8.52 Favored 'General case' 0 N--CA 1.487 1.412 0 O-C-N 121.254 -0.904 . . . . 1.08 109.564 179.928 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' C' C ' 346' ' ' GLU . . . . . . . . . . . . . 8.4 tm-20 -61.44 -27.87 68.87 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.46 -0.775 . . . . 2.21 110.028 -179.731 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' C' C ' 347' ' ' ALA . . . . . 0.652 ' HB1' ' HB1' ' D' ' 347' ' ' ALA . . . -62.93 -61.79 2.16 Favored 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.024 -1.048 . . . . 0.18 110.16 -179.651 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' C' C ' 348' ' ' LEU . . . . . 0.567 HD22 ' N ' ' C' ' 348' ' ' LEU . 4.2 mm? -60.59 -42.87 97.62 Favored 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.209 -0.932 . . . . 0.32 109.707 -179.72 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' C' C ' 349' ' ' GLU . . . . . . . . . . . . . 3.7 mm-40 -58.49 -35.98 73.06 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.11 -0.994 . . . . 2.19 109.834 -179.729 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' C' C ' 350' ' ' LEU . . . . . 0.626 ' CD2' HD13 ' D' ' 350' ' ' LEU . 4.1 tt -65.16 -39.59 93.18 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.048 -1.033 . . . . 0.46 109.043 179.766 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' C' C ' 351' ' ' LYS . . . . . . . . . . . . . 4.1 tttm -59.25 -40.82 87.19 Favored 'General case' 0 N--CA 1.488 1.452 0 O-C-N 121.394 -0.816 . . . . 1.35 109.108 179.914 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' C' C ' 352' ' ' ASP . . . . . . . . . . . . . 41.8 m-20 -57.73 -48.91 78.25 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.41 -0.806 . . . . 1.19 109.519 -179.996 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' C' C ' 353' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.487 1.42 0 O-C-N 121.42 -0.8 . . . . 0.57 109.537 -179.873 . . . . . . . . 0 0 . 1 . 028 nuclear nobuild core ' D' D ' 326' ' ' GLU . . . . . . . . . . . . . 32.9 mm-40 . . . . . 0 N--CA 1.49 1.574 0 N-CA-C 109.464 -0.569 . . . . 2.13 109.464 . . . . . . . . . 0 0 . 1 . 028 nuclear nobuild core ' D' D ' 327' ' ' TYR . . . . . . . . . . . . . 39.1 m-85 -148.45 110.67 4.63 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.187 -0.945 . . . . 0.47 109.574 179.916 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' D' D ' 328' ' ' PHE . . . . . 0.404 ' CD1' ' N ' ' D' ' 328' ' ' PHE . 32.9 m-85 -114.06 -171.66 1.95 Allowed 'General case' 0 N--CA 1.488 1.437 0 O-C-N 121.297 -0.877 . . . . 0.3 109.402 179.925 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' D' D ' 329' ' ' THR . . . . . . . . . . . . . 3.2 p -149.73 165.95 30.87 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.457 -0.777 . . . . 0.22 109.058 179.944 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' D' D ' 330' ' ' LEU . . . . . 0.543 HD11 HD22 ' B' ' 345' ' ' ASN . 63.0 tp -149.46 130.17 14.11 Favored 'General case' 0 C--N 1.303 -1.414 0 O-C-N 121.14 -0.975 . . . . 0.28 109.783 -179.534 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' D' D ' 331' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -87.27 113.12 22.72 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.396 -0.815 . . . . 0.93 109.302 179.838 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' D' D ' 332' ' ' ILE . . . . . 0.665 HG21 ' HA ' ' D' ' 338' ' ' PHE . 64.5 mt -101.89 106.09 19.11 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.41 0 O-C-N 121.15 -0.969 . . . . 0.25 109.467 -179.877 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' D' D ' 333' ' ' ARG . . . . . . . . . . . . . 72.6 mtt180 -71.74 142.54 49.77 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.476 -0.765 . . . . 2.93 109.552 179.952 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' D' D ' 334' ' ' GLY . . . . . . . . . . . . . . . 86.76 127.71 2.3 Favored Glycine 0 N--CA 1.489 2.209 0 N-CA-C 109.56 -1.416 . . . . 0.41 109.56 179.732 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' D' D ' 335' ' ' ARG . . . . . 0.442 ' HB2' ' CZ ' ' B' ' 328' ' ' PHE . 7.8 ttp180 -76.96 -33.66 57.65 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.129 -1.218 . . . . 3.03 109.31 -179.938 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' D' D ' 336' ' ' GLU . . . . . . . . . . . . . 12.3 mt-10 -58.6 -63.06 1.42 Allowed 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.414 -0.804 . . . . 2.26 110.093 -179.854 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' D' D ' 337' ' ' ARG . . . . . 0.456 ' NH1' ' CG ' ' D' ' 337' ' ' ARG . 0.0 OUTLIER -60.42 -29.25 68.87 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.085 -1.009 . . . . 2.92 109.307 -179.868 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild core ' D' D ' 338' ' ' PHE . . . . . 0.665 ' HA ' HG21 ' D' ' 332' ' ' ILE . 66.6 t80 -55.83 -53.98 50.13 Favored 'General case' 0 N--CA 1.489 1.492 0 O-C-N 121.247 -0.908 . . . . 0.37 109.288 179.98 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' D' D ' 339' ' ' GLU . . . . . . . . . . . . . 53.4 mt-10 -53.94 -34.97 61.18 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.199 -0.938 . . . . 1.99 110.081 179.94 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' D' D ' 340' ' ' MET . . . . . . . . . . . . . 5.3 ttp -63.68 -52.75 59.26 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.258 -0.901 . . . . 0.31 110.263 -179.112 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' D' D ' 341' ' ' PHE . . . . . . . . . . . . . 50.5 m-85 -60.35 -42.86 96.6 Favored 'General case' 0 N--CA 1.496 1.827 0 O-C-N 121.087 -1.008 . . . . 0.18 109.807 -179.656 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' D' D ' 342' ' ' ARG . . . . . . . . . . . . . 62.2 ttt180 -50.66 -43.27 57.32 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.369 -0.832 . . . . 2.41 110.123 -179.844 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' D' D ' 343' ' ' GLU . . . . . . . . . . . . . 3.3 tt0 -59.68 -46.66 88.39 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.272 -0.893 . . . . 2.35 109.851 -179.712 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' D' D ' 344' ' ' LEU . . . . . . . . . . . . . 43.4 mt -61.07 -39.24 89.12 Favored 'General case' 0 N--CA 1.489 1.525 0 O-C-N 121.207 -0.933 . . . . 0.19 110.004 -179.465 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' D' D ' 345' ' ' ASN . . . . . . . . . . . . . 61.8 t-20 -56.99 -48.95 77.22 Favored 'General case' 0 N--CA 1.488 1.438 0 O-C-N 121.177 -0.952 . . . . 1.09 109.943 -179.768 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' D' D ' 346' ' ' GLU . . . . . . . . . . . . . 46.4 tt0 -61.15 -32.69 72.4 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 120.918 -1.114 . . . . 1.69 110.037 -179.52 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' D' D ' 347' ' ' ALA . . . . . 0.652 ' HB1' ' HB1' ' C' ' 347' ' ' ALA . . . -60.12 -56.5 20.86 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.073 -1.017 . . . . 0.18 110.104 -179.752 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' D' D ' 348' ' ' LEU . . . . . 0.642 HD22 ' N ' ' D' ' 348' ' ' LEU . 3.9 mm? -62.43 -40.35 96.28 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.141 -0.974 . . . . 0.31 109.881 -179.509 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' D' D ' 349' ' ' GLU . . . . . . . . . . . . . 10.3 mm-40 -57.3 -39.74 76.39 Favored 'General case' 0 N--CA 1.495 1.777 0 O-C-N 121.304 -0.872 . . . . 1.95 109.858 -179.568 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' D' D ' 350' ' ' LEU . . . . . 0.626 HD13 ' CD2' ' C' ' 350' ' ' LEU . 7.9 tt -61.89 -45.71 92.56 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.285 -0.885 . . . . 0.43 109.317 179.936 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' D' D ' 351' ' ' LYS . . . . . . . . . . . . . 34.4 tttt -58.05 -42.95 86.5 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.418 -0.802 . . . . 1.4 109.453 179.851 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' D' D ' 352' ' ' ASP . . . . . . . . . . . . . 8.0 m-20 -57.01 -54.88 41.69 Favored 'General case' 0 N--CA 1.488 1.448 0 O-C-N 121.262 -0.899 . . . . 1.17 109.473 -179.993 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' D' D ' 353' ' ' ALA . . . . . . . . . . . . . . . -69.2 -12.36 61.61 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.326 -0.859 . . . . 0.59 109.705 179.923 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' D' D ' 354' ' ' GLN . . . . . . . . . . . . . 3.2 tt0 . . . . . 0 N--CA 1.488 1.472 0 O-C-N 121.161 -0.962 . . . . 1.44 109.802 -179.918 . . . . . . . . 0 0 . 1 . 029 nuclear nobuild core ' A' A ' 326' ' ' GLU . . . . . . . . . . . . . 2.4 mt-10 . . . . . 0 N--CA 1.489 1.508 0 N-CA-C 109.151 -0.685 . . . . 2.13 109.151 . . . . . . . . . 0 0 . 1 . 029 nuclear nobuild core ' A' A ' 327' ' ' TYR . . . . . 0.554 ' CE1' ' HG2' ' C' ' 333' ' ' ARG . 46.3 m-85 -150.29 108.56 3.77 Favored 'General case' 0 N--CA 1.488 1.463 0 O-C-N 121.152 -0.967 . . . . 0.48 109.788 -179.888 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 328' ' ' PHE . . . . . 0.469 ' CZ ' ' HG3' ' C' ' 335' ' ' ARG . 86.6 m-85 -108.45 -161.86 0.79 Allowed 'General case' 0 N--CA 1.488 1.47 0 O-C-N 121.308 -0.87 . . . . 0.31 109.377 179.936 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 329' ' ' THR . . . . . 0.442 HG23 ' O ' ' A' ' 328' ' ' PHE . 24.2 p -155.27 167.69 29.53 Favored 'General case' 0 N--CA 1.488 1.469 0 O-C-N 121.272 -0.892 . . . . 0.22 109.193 179.913 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 330' ' ' LEU . . . . . 0.426 ' O ' ' HA ' ' C' ' 329' ' ' THR . 24.4 tp -150.06 125.4 10.15 Favored 'General case' 0 N--CA 1.489 1.486 0 O-C-N 121.212 -0.93 . . . . 0.28 109.594 -179.924 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 331' ' ' GLN . . . . . . . . . . . . . 1.3 tt0 -87.01 115.69 24.56 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.316 -0.865 . . . . 0.91 109.209 179.857 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 332' ' ' ILE . . . . . 0.719 HG21 ' HA ' ' A' ' 338' ' ' PHE . 68.6 mt -103.61 113.98 41.96 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.511 0 O-C-N 121.217 -0.927 . . . . 0.26 109.588 -179.871 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 333' ' ' ARG . . . . . 0.416 ' HG2' ' CE1' ' C' ' 327' ' ' TYR . 31.6 mtt180 -72.74 151.84 41.94 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.313 -0.867 . . . . 2.92 109.404 179.9 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 334' ' ' GLY . . . . . . . . . . . . . . . 73.92 131.47 0.21 Allowed Glycine 0 N--CA 1.492 2.374 0 N-CA-C 109.589 -1.404 . . . . 0.4 109.589 -179.967 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 335' ' ' ARG . . . . . 0.429 ' HA ' ' CE1' ' C' ' 328' ' ' PHE . 0.1 OUTLIER -77.59 -35.29 53.06 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.283 -1.128 . . . . 3.01 109.463 -179.994 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild core ' A' A ' 336' ' ' GLU . . . . . . . . . . . . . 45.3 mt-10 -57.59 -61.5 2.46 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.259 -0.901 . . . . 2.29 109.723 -179.843 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 337' ' ' ARG . . . . . 0.917 ' CZ ' HD12 ' C' ' 348' ' ' LEU . 1.9 mtp180 -60.07 -31.35 69.91 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.273 -0.892 . . . . 2.93 109.571 -179.877 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 338' ' ' PHE . . . . . 0.719 ' HA ' HG21 ' A' ' 332' ' ' ILE . 44.5 t80 -54.89 -61.1 2.53 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.297 -0.877 . . . . 0.38 109.284 179.835 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 339' ' ' GLU . . . . . . . . . . . . . 93.4 mt-10 -51.43 -27.8 11.23 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.273 -0.892 . . . . 1.97 109.586 -179.941 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 340' ' ' MET . . . . . 0.411 ' HB3' ' O ' ' A' ' 337' ' ' ARG . 26.9 ttp -64.74 -54.26 34.29 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.241 -0.912 . . . . 0.31 109.716 -179.903 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 341' ' ' PHE . . . . . 0.432 ' HB2' HD13 ' A' ' 332' ' ' ILE . 47.5 m-85 -61.79 -41.77 98.15 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.24 -0.912 . . . . 0.18 109.656 -179.746 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 342' ' ' ARG . . . . . . . . . . . . . 4.4 ttt180 -49.2 -42.2 39.44 Favored 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.3 -0.875 . . . . 2.42 109.524 179.988 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 343' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -59.2 -46.66 87.85 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.175 -0.953 . . . . 2.35 109.735 -179.835 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 344' ' ' LEU . . . . . . . . . . . . . 36.6 mt -61.85 -31.82 72.11 Favored 'General case' 0 N--CA 1.489 1.486 0 O-C-N 121.144 -0.972 . . . . 0.18 109.559 -179.91 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 345' ' ' ASN . . . . . . . . . . . . . 26.5 t-20 -57.95 -57.31 13.37 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.231 -0.918 . . . . 1.09 109.683 -179.867 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 346' ' ' GLU . . . . . . . . . . . . . 20.3 tt0 -60.66 -28.32 68.5 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.306 -0.871 . . . . 1.65 109.912 -179.571 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 347' ' ' ALA . . . . . 0.726 ' HB1' ' HB1' ' B' ' 347' ' ' ALA . . . -60.47 -58.95 6.32 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.225 -0.922 . . . . 0.18 109.933 -179.805 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 348' ' ' LEU . . . . . 0.621 HD22 ' N ' ' A' ' 348' ' ' LEU . 4.0 mm? -62.23 -46.83 87.12 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.196 -0.94 . . . . 0.3 110.007 -179.482 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 349' ' ' GLU . . . . . . . . . . . . . 2.3 mt-10 -58.21 -29.05 65.37 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.22 -0.925 . . . . 1.94 109.965 -179.459 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 350' ' ' LEU . . . . . 0.787 ' CD1' HD22 ' B' ' 350' ' ' LEU . 3.4 tt -64.17 -50.93 66.2 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.118 -0.989 . . . . 0.46 109.22 179.957 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 351' ' ' LYS . . . . . . . . . . . . . 24.7 tttt -60.03 -38.54 83.03 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.372 -0.83 . . . . 1.4 109.375 179.965 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 352' ' ' ASP . . . . . 0.43 ' OD1' ' NH2' ' C' ' 337' ' ' ARG . 16.9 m-20 -56.95 -44.78 82.91 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.206 -0.934 . . . . 1.16 109.756 179.997 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 353' ' ' ALA . . . . . . . . . . . . . . . -67.01 -20.1 65.81 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.29 -0.881 . . . . 0.63 109.798 -179.624 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 354' ' ' GLN . . . . . . . . . . . . . 1.5 mt-30 . . . . . 0 N--CA 1.49 1.569 0 O-C-N 121.06 -1.025 . . . . 1.47 109.561 -179.999 . . . . . . . . 0 0 . 1 . 029 nuclear nobuild core ' B' B ' 326' ' ' GLU . . . . . . . . . . . . . 2.4 mt-10 . . . . . 0 N--CA 1.49 1.572 0 N-CA-C 109.158 -0.682 . . . . 2.13 109.158 . . . . . . . . . 0 0 . 1 . 029 nuclear nobuild core ' B' B ' 327' ' ' TYR . . . . . 0.442 ' CE1' ' HG2' ' D' ' 333' ' ' ARG . 46.9 m-85 -150.24 108.55 3.77 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.163 -0.96 . . . . 0.48 109.815 -179.902 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' B' B ' 328' ' ' PHE . . . . . 0.438 ' O ' HG23 ' B' ' 329' ' ' THR . 86.5 m-85 -108.45 -162.18 0.81 Allowed 'General case' 0 N--CA 1.489 1.48 0 O-C-N 121.267 -0.895 . . . . 0.32 109.404 179.817 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' B' B ' 329' ' ' THR . . . . . 0.438 HG23 ' O ' ' B' ' 328' ' ' PHE . 24.2 p -155.11 167.52 30.09 Favored 'General case' 0 N--CA 1.489 1.491 0 O-C-N 121.27 -0.893 . . . . 0.23 109.283 179.795 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' B' B ' 330' ' ' LEU . . . . . 0.467 ' O ' ' HA ' ' D' ' 329' ' ' THR . 24.3 tp -149.79 125.74 10.55 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.171 -0.955 . . . . 0.28 109.531 -179.846 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' B' B ' 331' ' ' GLN . . . . . . . . . . . . . 1.3 tt0 -87.28 115.6 24.79 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.256 -0.902 . . . . 0.91 109.289 179.832 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' B' B ' 332' ' ' ILE . . . . . 0.746 HG21 ' HA ' ' B' ' 338' ' ' PHE . 68.4 mt -103.47 114.47 43.17 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.521 0 O-C-N 121.136 -0.978 . . . . 0.24 109.644 -179.971 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' B' B ' 333' ' ' ARG . . . . . 0.472 ' HG2' ' CE1' ' D' ' 327' ' ' TYR . 32.6 mtt180 -73.15 151.86 41.38 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.253 -0.904 . . . . 2.93 109.429 179.887 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' B' B ' 334' ' ' GLY . . . . . . . . . . . . . . . 73.88 131.2 0.2 Allowed Glycine 0 N--CA 1.491 2.327 0 N-CA-C 109.523 -1.431 . . . . 0.4 109.523 179.959 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' B' B ' 335' ' ' ARG . . . . . 0.423 ' HA ' ' CE1' ' D' ' 328' ' ' PHE . 0.1 OUTLIER -77.36 -35.34 54.62 Favored 'General case' 0 N--CA 1.488 1.47 0 O-C-N 121.294 -1.121 . . . . 3.01 109.477 -179.979 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild core ' B' B ' 336' ' ' GLU . . . . . . . . . . . . . 46.3 mt-10 -57.22 -61.79 2.22 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.295 -0.878 . . . . 2.28 109.656 -179.926 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' B' B ' 337' ' ' ARG . . . . . 0.487 ' NH2' HD12 ' D' ' 348' ' ' LEU . 1.9 mtp180 -60.14 -30.99 69.67 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.249 -0.907 . . . . 2.93 109.611 -179.698 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' B' B ' 338' ' ' PHE . . . . . 0.746 ' HA ' HG21 ' B' ' 332' ' ' ILE . 44.8 t80 -55.21 -60.94 2.7 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.235 -0.916 . . . . 0.37 109.293 179.872 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' B' B ' 339' ' ' GLU . . . . . . . . . . . . . 93.4 mt-10 -51.4 -27.81 11.06 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.271 -0.893 . . . . 1.98 109.483 179.952 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' B' B ' 340' ' ' MET . . . . . 0.409 ' HB3' ' O ' ' B' ' 337' ' ' ARG . 27.4 ttp -64.75 -54.21 34.91 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.351 -0.843 . . . . 0.32 109.698 -179.852 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' B' B ' 341' ' ' PHE . . . . . 0.427 ' HB2' HD13 ' B' ' 332' ' ' ILE . 46.9 m-85 -61.79 -42.07 98.53 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.317 -0.865 . . . . 0.18 109.656 -179.69 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' B' B ' 342' ' ' ARG . . . . . . . . . . . . . 4.3 ttt180 -49.01 -42.12 36.91 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.219 -0.926 . . . . 2.42 109.552 -179.95 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' B' B ' 343' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -59.24 -46.63 87.96 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.278 -0.889 . . . . 2.35 109.681 -179.797 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' B' B ' 344' ' ' LEU . . . . . . . . . . . . . 36.2 mt -61.87 -31.93 72.24 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.178 -0.951 . . . . 0.18 109.559 -179.928 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' B' B ' 345' ' ' ASN . . . . . . . . . . . . . 27.1 t-20 -57.69 -57.67 11.7 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.326 -0.858 . . . . 1.09 109.759 -179.909 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' B' B ' 346' ' ' GLU . . . . . . . . . . . . . 20.4 tt0 -60.36 -28.29 68.07 Favored 'General case' 0 N--CA 1.489 1.525 0 O-C-N 121.385 -0.822 . . . . 1.66 109.916 -179.589 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' B' B ' 347' ' ' ALA . . . . . 0.726 ' HB1' ' HB1' ' A' ' 347' ' ' ALA . . . -60.7 -58.71 7.31 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.12 -0.988 . . . . 0.17 109.894 -179.732 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' B' B ' 348' ' ' LEU . . . . . 0.626 HD22 ' N ' ' B' ' 348' ' ' LEU . 4.0 mm? -62.1 -47.2 85.67 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.23 -0.918 . . . . 0.29 109.955 -179.563 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' B' B ' 349' ' ' GLU . . . . . . . . . . . . . 2.3 mt-10 -57.95 -29.05 64.87 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.233 -0.917 . . . . 1.95 109.967 -179.458 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' B' B ' 350' ' ' LEU . . . . . 0.787 HD22 ' CD1' ' A' ' 350' ' ' LEU . 3.5 tt -64.17 -51.11 65.38 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.15 -0.969 . . . . 0.45 109.207 179.871 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' B' B ' 351' ' ' LYS . . . . . . . . . . . . . 24.1 tttt -59.81 -38.43 81.95 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.403 -0.811 . . . . 1.38 109.41 -179.938 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' B' B ' 352' ' ' ASP . . . . . . . . . . . . . 18.1 m-20 -57.07 -44.88 83.51 Favored 'General case' 0 N--CA 1.491 1.625 0 O-C-N 121.334 -0.854 . . . . 1.16 109.773 -179.971 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' B' B ' 353' ' ' ALA . . . . . . . . . . . . . . . -66.88 -19.9 65.82 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.208 -0.933 . . . . 0.61 109.742 -179.572 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' B' B ' 354' ' ' GLN . . . . . . . . . . . . . 1.6 mt-30 . . . . . 0 N--CA 1.491 1.595 0 O-C-N 121.215 -0.928 . . . . 1.45 109.527 -179.973 . . . . . . . . 0 0 . 1 . 029 nuclear nobuild core ' C' C ' 326' ' ' GLU . . . . . . . . . . . . . 80.2 mm-40 . . . . . 0 N--CA 1.49 1.545 0 N-CA-C 109.146 -0.687 . . . . 2.17 109.146 . . . . . . . . . 0 0 . 1 . 029 nuclear nobuild core ' C' C ' 327' ' ' TYR . . . . . 0.416 ' CE1' ' HG2' ' A' ' 333' ' ' ARG . 55.5 m-85 -149.57 107.14 3.65 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.058 -1.026 . . . . 0.48 109.816 -179.744 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' C' C ' 328' ' ' PHE . . . . . 0.441 ' O ' HG23 ' C' ' 329' ' ' THR . 80.8 m-85 -107.16 -162.86 0.87 Allowed 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.126 -0.984 . . . . 0.33 109.36 179.663 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' C' C ' 329' ' ' THR . . . . . 0.441 HG23 ' O ' ' C' ' 328' ' ' PHE . 34.0 p -155.23 163.31 40.35 Favored 'General case' 0 N--CA 1.489 1.497 0 O-C-N 121.272 -0.892 . . . . 0.23 109.259 179.915 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' C' C ' 330' ' ' LEU . . . . . . . . . . . . . 48.5 tp -149.55 128.56 12.67 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.235 -0.916 . . . . 0.28 109.555 -179.767 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' C' C ' 331' ' ' GLN . . . . . . . . . . . . . 1.1 tt0 -86.29 117.72 25.28 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.231 -0.918 . . . . 1.48 109.251 179.881 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' C' C ' 332' ' ' ILE . . . . . 0.708 HG21 ' HA ' ' C' ' 338' ' ' PHE . 40.6 mt -103.38 112.36 36.57 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.557 0 O-C-N 121.244 -0.91 . . . . 0.24 109.714 -179.805 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' C' C ' 333' ' ' ARG . . . . . 0.554 ' HG2' ' CE1' ' A' ' 327' ' ' TYR . 0.1 OUTLIER -74.25 136.34 42.69 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.303 -0.873 . . . . 2.74 109.546 179.847 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild core ' C' C ' 334' ' ' GLY . . . . . . . . . . . . . . . 87.52 132.81 3.79 Favored Glycine 0 N--CA 1.492 2.388 0 N-CA-C 109.741 -1.344 . . . . 0.35 109.741 179.692 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' C' C ' 335' ' ' ARG . . . . . 0.469 ' HG3' ' CZ ' ' A' ' 328' ' ' PHE . 1.8 tmm_? -80.43 -38.06 30.84 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.292 -1.122 . . . . 2.53 109.724 -179.971 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' C' C ' 336' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -56.44 -58.22 8.95 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.13 -0.981 . . . . 2.62 109.67 -179.831 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' C' C ' 337' ' ' ARG . . . . . 0.43 ' NH2' ' OD1' ' A' ' 352' ' ' ASP . 0.4 OUTLIER -60.63 -30.14 69.68 Favored 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.28 -0.887 . . . . 2.81 109.657 -179.803 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild core ' C' C ' 338' ' ' PHE . . . . . 0.708 ' HA ' HG21 ' C' ' 332' ' ' ILE . 61.1 t80 -56.01 -55.91 27.06 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.152 -0.968 . . . . 0.4 109.87 -179.841 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' C' C ' 339' ' ' GLU . . . . . . . . . . . . . 5.1 mt-10 -50.16 -34.14 21.39 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.11 -0.994 . . . . 2.05 109.887 -179.735 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' C' C ' 340' ' ' MET . . . . . . . . . . . . . 3.5 ttt -62.98 -50.2 71.7 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.118 -0.989 . . . . 0.32 109.889 -179.702 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' C' C ' 341' ' ' PHE . . . . . . . . . . . . . 37.1 m-85 -62.14 -49.62 75.15 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.087 -1.008 . . . . 0.18 110.113 -179.664 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' C' C ' 342' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -47.86 -38.71 16.79 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.222 -0.924 . . . . 2.91 110.011 -179.655 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' C' C ' 343' ' ' GLU . . . . . . . . . . . . . 2.5 tt0 -58.27 -49.47 77.03 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.143 -0.973 . . . . 2.14 109.579 -179.823 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' C' C ' 344' ' ' LEU . . . . . 0.56 HD22 ' CD2' ' D' ' 344' ' ' LEU . 81.3 mt -63.52 -33.52 75.76 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.257 -0.902 . . . . 0.22 109.836 -179.971 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' C' C ' 345' ' ' ASN . . . . . 0.418 ' C ' ' OD1' ' C' ' 345' ' ' ASN . 16.6 t-20 -57.5 -58.76 6.86 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.192 -0.942 . . . . 1.08 109.732 -179.791 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' C' C ' 346' ' ' GLU . . . . . . . . . . . . . 1.3 tt0 -60.46 -26.61 66.89 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.192 -0.943 . . . . 2.21 109.57 -179.603 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' C' C ' 347' ' ' ALA . . . . . 0.81 ' HB1' ' HB1' ' D' ' 347' ' ' ALA . . . -62.9 -56.69 15.0 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.185 -0.947 . . . . 0.18 109.738 179.923 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' C' C ' 348' ' ' LEU . . . . . 0.917 HD12 ' CZ ' ' A' ' 337' ' ' ARG . 4.2 mm? -61.73 -47.97 82.82 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.245 -0.909 . . . . 0.32 110.061 -179.672 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' C' C ' 349' ' ' GLU . . . . . . . . . . . . . 47.9 mm-40 -57.78 -34.6 69.75 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.25 -0.906 . . . . 2.19 110.269 -179.229 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' C' C ' 350' ' ' LEU . . . . . 0.795 HD22 ' CD1' ' D' ' 350' ' ' LEU . 5.4 tt -63.98 -45.88 87.07 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.11 -0.994 . . . . 0.46 109.221 -179.887 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' C' C ' 351' ' ' LYS . . . . . . . . . . . . . 12.7 tttp -60.15 -46.45 89.62 Favored 'General case' 0 N--CA 1.488 1.426 0 O-C-N 121.455 -0.778 . . . . 1.35 109.381 179.892 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' C' C ' 352' ' ' ASP . . . . . . . . . . . . . 76.6 m-20 -57.7 -37.93 74.34 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.351 -0.843 . . . . 1.19 109.565 -179.967 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' C' C ' 353' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.493 1.676 0 O-C-N 121.287 -0.883 . . . . 0.57 109.767 -179.809 . . . . . . . . 0 0 . 1 . 029 nuclear nobuild core ' D' D ' 326' ' ' GLU . . . . . . . . . . . . . 2.4 mt-10 . . . . . 0 N--CA 1.489 1.498 0 N-CA-C 109.287 -0.634 . . . . 2.13 109.287 . . . . . . . . . 0 0 . 1 . 029 nuclear nobuild core ' D' D ' 327' ' ' TYR . . . . . 0.472 ' CE1' ' HG2' ' B' ' 333' ' ' ARG . 47.2 m-85 -150.12 108.42 3.77 Favored 'General case' 0 N--CA 1.489 1.485 0 O-C-N 121.162 -0.961 . . . . 0.47 109.818 -179.803 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' D' D ' 328' ' ' PHE . . . . . 0.457 ' O ' HG23 ' D' ' 329' ' ' THR . 87.4 m-85 -108.25 -161.96 0.8 Allowed 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.302 -0.874 . . . . 0.3 109.433 179.771 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' D' D ' 329' ' ' THR . . . . . 0.467 ' HA ' ' O ' ' B' ' 330' ' ' LEU . 23.6 p -155.24 167.64 29.71 Favored 'General case' 0 N--CA 1.489 1.49 0 O-C-N 121.253 -0.905 . . . . 0.22 109.244 179.864 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' D' D ' 330' ' ' LEU . . . . . 0.436 ' O ' ' HA ' ' B' ' 329' ' ' THR . 24.0 tp -149.98 125.51 10.27 Favored 'General case' 0 N--CA 1.489 1.478 0 O-C-N 121.195 -0.941 . . . . 0.28 109.605 -179.951 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' D' D ' 331' ' ' GLN . . . . . . . . . . . . . 1.3 tt0 -87.03 115.6 24.52 Favored 'General case' 0 N--CA 1.488 1.471 0 O-C-N 121.245 -0.909 . . . . 0.93 109.23 179.837 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' D' D ' 332' ' ' ILE . . . . . 0.731 HG21 ' HA ' ' D' ' 338' ' ' PHE . 69.9 mt -103.55 114.24 42.59 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.507 0 O-C-N 121.177 -0.952 . . . . 0.25 109.537 -179.898 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' D' D ' 333' ' ' ARG . . . . . 0.442 ' HG2' ' CE1' ' B' ' 327' ' ' TYR . 32.9 mtt180 -72.83 151.98 41.76 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.321 -0.862 . . . . 2.93 109.391 179.835 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' D' D ' 334' ' ' GLY . . . . . . . . . . . . . . . 73.64 131.38 0.19 Allowed Glycine 0 N--CA 1.491 2.33 0 N-CA-C 109.546 -1.422 . . . . 0.41 109.546 179.902 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' D' D ' 335' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -77.45 -35.36 53.99 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.269 -1.136 . . . . 3.03 109.453 -179.986 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' D' D ' 336' ' ' GLU . . . . . . . . . . . . . 47.8 mt-10 -57.33 -61.6 2.36 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.251 -0.906 . . . . 2.26 109.647 -179.909 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' D' D ' 337' ' ' ARG . . . . . 0.495 ' NH2' HD12 ' B' ' 348' ' ' LEU . 1.9 mtp180 -60.18 -31.03 69.73 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.304 -0.873 . . . . 2.92 109.64 -179.755 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' D' D ' 338' ' ' PHE . . . . . 0.731 ' HA ' HG21 ' D' ' 332' ' ' ILE . 45.2 t80 -55.18 -60.72 3.0 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.301 -0.874 . . . . 0.37 109.279 179.909 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' D' D ' 339' ' ' GLU . . . . . . . . . . . . . 92.9 mt-10 -51.62 -27.86 12.58 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.401 -0.812 . . . . 1.99 109.565 179.988 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' D' D ' 340' ' ' MET . . . . . 0.4 ' HB3' ' O ' ' D' ' 337' ' ' ARG . 28.0 ttp -64.73 -54.2 35.26 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.204 -0.935 . . . . 0.31 109.748 -179.953 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' D' D ' 341' ' ' PHE . . . . . 0.434 ' HB2' HD13 ' D' ' 332' ' ' ILE . 47.3 m-85 -61.78 -41.92 98.34 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.222 -0.924 . . . . 0.18 109.713 -179.728 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' D' D ' 342' ' ' ARG . . . . . . . . . . . . . 4.5 ttt180 -49.25 -41.77 38.61 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.264 -0.898 . . . . 2.41 109.563 -179.972 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' D' D ' 343' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -59.59 -46.64 88.34 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.361 -0.837 . . . . 2.35 109.63 -179.839 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' D' D ' 344' ' ' LEU . . . . . 0.56 ' CD2' HD22 ' C' ' 344' ' ' LEU . 36.7 mt -61.99 -31.63 72.01 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.132 -0.98 . . . . 0.19 109.515 -179.939 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' D' D ' 345' ' ' ASN . . . . . . . . . . . . . 26.7 t-20 -58.07 -57.15 14.09 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.174 -0.954 . . . . 1.09 109.736 -179.868 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' D' D ' 346' ' ' GLU . . . . . . . . . . . . . 19.3 tt0 -60.75 -28.28 68.58 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.358 -0.839 . . . . 1.69 109.916 -179.542 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' D' D ' 347' ' ' ALA . . . . . 0.81 ' HB1' ' HB1' ' C' ' 347' ' ' ALA . . . -60.89 -58.56 7.91 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.189 -0.944 . . . . 0.18 109.83 -179.71 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' D' D ' 348' ' ' LEU . . . . . 0.637 HD22 ' N ' ' D' ' 348' ' ' LEU . 4.0 mm? -62.22 -47.01 86.3 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.19 -0.944 . . . . 0.31 109.98 -179.514 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' D' D ' 349' ' ' GLU . . . . . . . . . . . . . 2.4 mt-10 -58.25 -29.03 65.44 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.168 -0.957 . . . . 1.95 110.04 -179.493 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' D' D ' 350' ' ' LEU . . . . . 0.795 ' CD1' HD22 ' C' ' 350' ' ' LEU . 3.5 tt -63.98 -50.87 66.86 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.141 -0.974 . . . . 0.43 109.235 179.818 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' D' D ' 351' ' ' LYS . . . . . . . . . . . . . 24.2 tttt -59.94 -38.53 82.67 Favored 'General case' 0 N--CA 1.489 1.487 0 O-C-N 121.44 -0.787 . . . . 1.4 109.47 179.915 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' D' D ' 352' ' ' ASP . . . . . . . . . . . . . 19.9 m-20 -57.19 -44.34 83.5 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.202 -0.936 . . . . 1.17 109.797 -179.94 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' D' D ' 353' ' ' ALA . . . . . . . . . . . . . . . -67.26 -20.2 65.62 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.232 -0.917 . . . . 0.59 109.743 -179.652 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' D' D ' 354' ' ' GLN . . . . . . . . . . . . . 1.5 mt-30 . . . . . 0 N--CA 1.491 1.577 0 O-C-N 121.115 -0.991 . . . . 1.44 109.554 -179.925 . . . . . . . . 0 0 . 1 . 030 nuclear nobuild core ' A' A ' 326' ' ' GLU . . . . . . . . . . . . . 8.6 mt-10 . . . . . 0 N--CA 1.487 1.38 0 N-CA-C 109.457 -0.571 . . . . 2.13 109.457 . . . . . . . . . 0 0 . 1 . 030 nuclear nobuild core ' A' A ' 327' ' ' TYR . . . . . 0.573 ' CE1' ' HG2' ' C' ' 333' ' ' ARG . 44.9 m-85 -149.08 107.96 3.87 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.082 -1.011 . . . . 0.48 109.885 -179.529 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 328' ' ' PHE . . . . . . . . . . . . . 18.4 m-85 -112.88 -166.72 1.1 Allowed 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.341 -0.849 . . . . 0.31 109.389 179.912 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 329' ' ' THR . . . . . . . . . . . . . 13.6 p -153.88 169.53 23.19 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.431 -0.793 . . . . 0.22 109.012 179.98 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 330' ' ' LEU . . . . . . . . . . . . . 18.2 tp -151.51 134.23 15.61 Favored 'General case' 0 C--N 1.302 -1.457 0 O-C-N 121.176 -0.952 . . . . 0.28 109.561 179.758 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 331' ' ' GLN . . . . . . . . . . . . . 2.1 tp60 -86.66 114.19 23.16 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.204 -0.935 . . . . 0.91 109.413 179.835 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 332' ' ' ILE . . . . . 0.907 HG21 ' HA ' ' A' ' 338' ' ' PHE . 64.0 mt -103.17 101.65 12.5 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.392 0 O-C-N 121.323 -0.861 . . . . 0.26 109.331 179.835 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 333' ' ' ARG . . . . . . . . . . . . . 57.3 mtt180 -71.86 152.72 42.4 Favored 'General case' 0 N--CA 1.487 1.409 0 O-C-N 121.403 -0.81 . . . . 2.92 109.829 -179.516 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 334' ' ' GLY . . . . . . . . . . . . . . . 76.27 131.36 0.39 Allowed Glycine 0 N--CA 1.489 2.224 0 N-CA-C 109.813 -1.315 . . . . 0.4 109.813 179.974 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 335' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -74.61 -34.85 62.91 Favored 'General case' 0 N--CA 1.488 1.449 0 O-C-N 121.181 -1.188 . . . . 3.01 109.743 -179.867 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 336' ' ' GLU . . . . . . . . . . . . . 15.1 mt-10 -58.82 -58.35 9.0 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.195 -0.941 . . . . 2.29 109.777 -179.864 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 337' ' ' ARG . . . . . 0.428 ' CZ ' HD12 ' C' ' 348' ' ' LEU . 5.8 mmt180 -60.73 -36.2 78.26 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.082 -1.011 . . . . 2.93 109.754 -179.783 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 338' ' ' PHE . . . . . 0.907 ' HA ' HG21 ' A' ' 332' ' ' ILE . 59.7 t80 -53.89 -60.89 2.74 Favored 'General case' 0 C--N 1.302 -1.486 0 O-C-N 120.95 -1.094 . . . . 0.38 109.419 179.978 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 339' ' ' GLU . . . . . . . . . . . . . 73.8 mt-10 -49.44 -36.31 22.05 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.384 -0.823 . . . . 1.97 110.64 -179.432 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 340' ' ' MET . . . . . . . . . . . . . 48.2 ttp -63.28 -49.65 73.21 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 120.979 -1.076 . . . . 0.31 110.145 -179.417 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 341' ' ' PHE . . . . . . . . . . . . . 52.7 m-85 -62.52 -46.17 89.62 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.308 -0.87 . . . . 0.18 109.636 -179.546 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 342' ' ' ARG . . . . . . . . . . . . . 12.6 ttp180 -47.43 -43.89 24.27 Favored 'General case' 0 N--CA 1.493 1.711 0 O-C-N 121.401 -0.812 . . . . 2.42 109.928 -179.579 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 343' ' ' GLU . . . . . . . . . . . . . 29.1 tt0 -58.6 -48.51 80.71 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.372 -0.83 . . . . 2.35 109.869 -179.517 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 344' ' ' LEU . . . . . 0.439 ' O ' ' HB3' ' A' ' 347' ' ' ALA . 55.3 mt -60.97 -30.79 70.47 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.196 -0.94 . . . . 0.18 109.566 -179.671 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 345' ' ' ASN . . . . . . . . . . . . . 11.3 t-20 -57.8 -59.59 5.0 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.252 -0.905 . . . . 1.09 109.635 -179.943 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 346' ' ' GLU . . . . . . . . . . . . . 79.4 tt0 -60.01 -24.78 64.76 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.148 -0.97 . . . . 1.65 109.652 -179.767 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 347' ' ' ALA . . . . . 0.6 ' HB1' ' HB1' ' B' ' 347' ' ' ALA . . . -61.84 -61.61 2.38 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.376 -0.827 . . . . 0.18 109.75 179.809 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 348' ' ' LEU . . . . . 0.621 HD22 ' N ' ' A' ' 348' ' ' LEU . 3.8 mm? -61.39 -46.67 89.19 Favored 'General case' 0 N--CA 1.495 1.812 0 O-C-N 121.31 -0.869 . . . . 0.3 109.868 -179.604 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 349' ' ' GLU . . . . . . . . . . . . . 25.8 mm-40 -56.44 -34.0 66.4 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.235 -0.916 . . . . 1.94 109.736 -179.456 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 350' ' ' LEU . . . . . 0.649 HD11 ' NE2' ' B' ' 354' ' ' GLN . 5.8 tt -62.5 -47.03 85.76 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.197 -0.939 . . . . 0.46 109.02 -179.936 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 351' ' ' LYS . . . . . . . . . . . . . 6.3 tttt -57.44 -43.36 83.83 Favored 'General case' 0 C--N 1.302 -1.489 0 O-C-N 121.329 -0.857 . . . . 1.4 109.385 179.621 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 352' ' ' ASP . . . . . . . . . . . . . 23.1 m-20 -55.87 -40.1 72.46 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.275 -0.891 . . . . 1.16 109.397 179.857 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 353' ' ' ALA . . . . . . . . . . . . . . . -69.01 -26.65 65.11 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.37 -0.831 . . . . 0.63 109.736 -179.901 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 354' ' ' GLN . . . . . 0.538 ' NE2' HD11 ' B' ' 350' ' ' LEU . 5.1 tt0 . . . . . 0 N--CA 1.495 1.782 0 O-C-N 121.116 -0.99 . . . . 1.47 109.877 -179.893 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' B' B ' 326' ' ' GLU . . . . . . . . . . . . . 6.2 mt-10 . . . . . 0 N--CA 1.489 1.48 0 N-CA-C 109.282 -0.636 . . . . 2.13 109.282 . . . . . . . . . 0 0 . 1 . 030 nuclear nobuild core ' B' B ' 327' ' ' TYR . . . . . . . . . . . . . 41.3 m-85 -149.37 108.94 3.99 Favored 'General case' 0 C--N 1.303 -1.429 0 O-C-N 121.324 -0.86 . . . . 0.48 109.684 -179.843 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' B' B ' 328' ' ' PHE . . . . . . . . . . . . . 18.9 m-85 -113.0 -166.96 1.13 Allowed 'General case' 0 C--N 1.302 -1.476 0 O-C-N 121.273 -0.892 . . . . 0.32 109.366 179.964 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' B' B ' 329' ' ' THR . . . . . . . . . . . . . 16.5 p -153.9 169.2 24.01 Favored 'General case' 0 N--CA 1.488 1.463 0 O-C-N 121.351 -0.843 . . . . 0.23 108.994 179.611 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' B' B ' 330' ' ' LEU . . . . . 0.4 ' O ' ' HA ' ' D' ' 329' ' ' THR . 18.1 tp -151.53 134.42 15.73 Favored 'General case' 0 N--CA 1.491 1.625 0 O-C-N 121.334 -0.854 . . . . 0.28 109.673 179.796 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' B' B ' 331' ' ' GLN . . . . . . . . . . . . . 2.1 tp60 -86.94 114.58 23.69 Favored 'General case' 0 C--N 1.302 -1.47 0 O-C-N 121.416 -0.803 . . . . 0.91 109.66 179.672 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' B' B ' 332' ' ' ILE . . . . . 0.877 HG21 ' HA ' ' B' ' 338' ' ' PHE . 58.0 mt -103.03 101.93 12.89 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.458 0 O-C-N 121.245 -0.909 . . . . 0.24 109.181 179.751 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' B' B ' 333' ' ' ARG . . . . . . . . . . . . . 54.7 mtt180 -72.1 152.14 42.56 Favored 'General case' 0 N--CA 1.488 1.456 0 O-C-N 121.259 -0.901 . . . . 2.93 109.613 -179.71 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' B' B ' 334' ' ' GLY . . . . . . . . . . . . . . . 77.51 130.42 0.49 Allowed Glycine 0 N--CA 1.491 2.33 0 N-CA-C 109.795 -1.322 . . . . 0.4 109.795 179.735 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' B' B ' 335' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -74.22 -34.56 63.73 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.165 -1.197 . . . . 3.01 109.759 179.9 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' B' B ' 336' ' ' GLU . . . . . . . . . . . . . 11.4 mt-10 -59.22 -58.28 9.34 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.199 -0.938 . . . . 2.28 109.688 -179.697 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' B' B ' 337' ' ' ARG . . . . . . . . . . . . . 5.1 mmt180 -60.81 -36.13 78.28 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.441 -0.787 . . . . 2.93 109.655 -179.674 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' B' B ' 338' ' ' PHE . . . . . 0.877 ' HA ' HG21 ' B' ' 332' ' ' ILE . 62.7 t80 -54.23 -60.07 3.83 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.233 -0.917 . . . . 0.37 109.435 179.884 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' B' B ' 339' ' ' GLU . . . . . . . . . . . . . 80.8 mt-10 -49.9 -36.56 27.91 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.262 -0.899 . . . . 1.98 110.379 -179.64 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' B' B ' 340' ' ' MET . . . . . . . . . . . . . 47.9 ttp -63.38 -50.32 70.35 Favored 'General case' 0 N--CA 1.494 1.76 0 O-C-N 121.088 -1.008 . . . . 0.32 110.278 -179.387 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' B' B ' 341' ' ' PHE . . . . . . . . . . . . . 54.5 m-85 -62.24 -45.72 92.05 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.128 -0.983 . . . . 0.18 109.998 -179.707 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' B' B ' 342' ' ' ARG . . . . . . . . . . . . . 13.0 ttp180 -47.59 -43.75 25.81 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.329 -0.857 . . . . 2.42 109.849 -179.931 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' B' B ' 343' ' ' GLU . . . . . . . . . . . . . 30.6 tt0 -58.84 -48.91 79.67 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.417 -0.802 . . . . 2.35 109.68 -179.578 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' B' B ' 344' ' ' LEU . . . . . 0.408 ' O ' ' HB3' ' B' ' 347' ' ' ALA . 52.9 mt -60.97 -29.96 69.97 Favored 'General case' 0 N--CA 1.489 1.486 0 O-C-N 121.021 -1.049 . . . . 0.18 109.576 -179.538 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' B' B ' 345' ' ' ASN . . . . . . . . . . . . . 11.2 t-20 -58.13 -59.99 4.44 Favored 'General case' 0 N--CA 1.489 1.493 0 O-C-N 121.248 -0.908 . . . . 1.09 109.702 179.875 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' B' B ' 346' ' ' GLU . . . . . . . . . . . . . 86.1 tt0 -60.16 -24.14 64.5 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.253 -0.904 . . . . 1.66 109.382 -179.724 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' B' B ' 347' ' ' ALA . . . . . 0.6 ' HB1' ' HB1' ' A' ' 347' ' ' ALA . . . -62.18 -61.8 2.21 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.147 -0.97 . . . . 0.17 109.967 -179.829 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' B' B ' 348' ' ' LEU . . . . . 0.62 HD22 ' N ' ' B' ' 348' ' ' LEU . 3.8 mm? -61.26 -45.77 93.14 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.325 -0.86 . . . . 0.29 109.824 -179.722 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' B' B ' 349' ' ' GLU . . . . . . . . . . . . . 27.6 mm-40 -56.68 -33.49 66.47 Favored 'General case' 0 N--CA 1.494 1.762 0 O-C-N 121.399 -0.813 . . . . 1.95 109.832 -179.399 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' B' B ' 350' ' ' LEU . . . . . 0.591 ' O ' HD23 ' B' ' 350' ' ' LEU . 5.7 tt -63.53 -46.75 84.59 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.381 -0.824 . . . . 0.45 108.847 -179.943 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' B' B ' 351' ' ' LYS . . . . . . . . . . . . . 5.7 tttt -57.62 -44.04 85.25 Favored 'General case' 0 C--N 1.302 -1.481 0 O-C-N 121.449 -0.782 . . . . 1.38 109.022 179.584 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' B' B ' 352' ' ' ASP . . . . . . . . . . . . . 25.2 m-20 -55.3 -39.55 70.05 Favored 'General case' 0 N--CA 1.488 1.456 0 O-C-N 121.389 -0.82 . . . . 1.16 109.502 179.82 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' B' B ' 353' ' ' ALA . . . . . . . . . . . . . . . -69.53 -26.45 64.53 Favored 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.454 -0.779 . . . . 0.61 109.889 -179.898 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' B' B ' 354' ' ' GLN . . . . . 0.649 ' NE2' HD11 ' A' ' 350' ' ' LEU . 4.6 tt0 . . . . . 0 C--N 1.302 -1.479 0 O-C-N 120.954 -1.091 . . . . 1.45 109.798 -179.91 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' C' C ' 326' ' ' GLU . . . . . . . . . . . . . 2.9 mp0 . . . . . 0 N--CA 1.486 1.362 0 CA-C-O 121.326 0.584 . . . . 2.17 109.433 . . . . . . . . . 0 0 . 1 . 030 nuclear nobuild core ' C' C ' 327' ' ' TYR . . . . . . . . . . . . . 49.5 m-85 -150.75 114.19 4.89 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.062 -1.024 . . . . 0.48 109.835 179.752 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' C' C ' 328' ' ' PHE . . . . . 0.458 ' O ' HG23 ' C' ' 329' ' ' THR . 79.5 m-85 -113.38 -167.81 1.25 Allowed 'General case' 0 N--CA 1.488 1.466 0 O-C-N 121.217 -0.927 . . . . 0.33 109.491 179.542 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' C' C ' 329' ' ' THR . . . . . 0.458 HG23 ' O ' ' C' ' 328' ' ' PHE . 4.4 p -153.91 161.84 41.69 Favored 'General case' 0 C--N 1.301 -1.508 0 O-C-N 121.068 -1.02 . . . . 0.23 109.536 -179.881 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' C' C ' 330' ' ' LEU . . . . . . . . . . . . . 15.0 tp -149.24 129.43 13.65 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.291 -0.881 . . . . 0.28 109.671 -179.703 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' C' C ' 331' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -87.15 119.88 27.85 Favored 'General case' 0 N--CA 1.487 1.4 0 O-C-N 121.334 -0.854 . . . . 1.48 109.229 179.632 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' C' C ' 332' ' ' ILE . . . . . 0.719 HG21 ' HA ' ' C' ' 338' ' ' PHE . 14.1 mt -103.23 105.89 19.12 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.574 0 O-C-N 121.18 -0.95 . . . . 0.24 109.299 179.915 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' C' C ' 333' ' ' ARG . . . . . 0.573 ' HG2' ' CE1' ' A' ' 327' ' ' TYR . 8.3 mtt180 -72.65 134.9 45.32 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.228 -0.92 . . . . 2.74 109.155 179.624 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' C' C ' 334' ' ' GLY . . . . . . . . . . . . . . . 92.78 134.79 6.94 Favored Glycine 0 N--CA 1.489 2.176 0 N-CA-C 109.714 -1.354 . . . . 0.35 109.714 179.959 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' C' C ' 335' ' ' ARG . . . . . 0.408 ' O ' ' HB3' ' C' ' 338' ' ' PHE . 6.7 tpt180 -80.33 -34.25 36.83 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.502 -0.999 . . . . 2.53 109.319 179.922 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' C' C ' 336' ' ' GLU . . . . . . . . . . . . . 1.3 tt0 -57.96 -61.45 2.53 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.189 -0.945 . . . . 2.62 109.69 -179.974 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' C' C ' 337' ' ' ARG . . . . . . . . . . . . . 3.0 mtt180 -59.19 -28.57 66.76 Favored 'General case' 0 N--CA 1.487 1.384 0 O-C-N 121.065 -1.022 . . . . 2.81 109.553 -179.91 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' C' C ' 338' ' ' PHE . . . . . 0.719 ' HA ' HG21 ' C' ' 332' ' ' ILE . 48.4 t80 -55.21 -62.4 1.69 Allowed 'General case' 0 N--CA 1.487 1.389 0 O-C-N 121.275 -0.891 . . . . 0.4 109.61 179.887 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' C' C ' 339' ' ' GLU . . . . . . . . . . . . . 1.3 mm-40 -49.79 -31.44 11.63 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 120.994 -1.066 . . . . 2.05 109.662 -179.819 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' C' C ' 340' ' ' MET . . . . . . . . . . . . . 24.2 ttp -63.27 -57.38 10.62 Favored 'General case' 0 N--CA 1.488 1.462 0 O-C-N 121.271 -0.893 . . . . 0.32 110.35 -179.429 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' C' C ' 341' ' ' PHE . . . . . 0.444 ' HB2' ' CD1' ' C' ' 332' ' ' ILE . 51.7 m-85 -61.57 -47.87 83.54 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.004 -1.06 . . . . 0.18 109.715 -179.575 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' C' C ' 342' ' ' ARG . . . . . 0.439 HH11 ' CG ' ' C' ' 342' ' ' ARG . 0.0 OUTLIER -47.15 -40.93 16.76 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.556 -0.715 . . . . 2.91 109.947 -179.983 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild core ' C' C ' 343' ' ' GLU . . . . . 0.442 ' HA ' ' OE1' ' C' ' 343' ' ' GLU . 4.6 tp10 -60.1 -48.73 80.51 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.236 -0.915 . . . . 2.14 109.611 -179.951 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' C' C ' 344' ' ' LEU . . . . . . . . . . . . . 28.7 mt -62.18 -31.1 71.57 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.324 -0.86 . . . . 0.22 109.47 -179.899 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' C' C ' 345' ' ' ASN . . . . . . . . . . . . . 8.8 t-20 -57.57 -50.53 72.79 Favored 'General case' 0 C--N 1.301 -1.529 0 O-C-N 121.16 -0.962 . . . . 1.08 109.258 -179.928 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' C' C ' 346' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -63.9 -33.43 75.69 Favored 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.247 -0.908 . . . . 2.21 109.85 -179.849 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' C' C ' 347' ' ' ALA . . . . . 0.422 ' HB1' ' HB1' ' D' ' 347' ' ' ALA . . . -61.26 -60.1 4.27 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.225 -0.922 . . . . 0.18 110.285 -179.459 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' C' C ' 348' ' ' LEU . . . . . 0.543 HD22 ' N ' ' C' ' 348' ' ' LEU . 3.8 mm? -59.0 -44.45 91.67 Favored 'General case' 0 N--CA 1.488 1.472 0 O-C-N 121.154 -0.966 . . . . 0.32 109.814 -179.025 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' C' C ' 349' ' ' GLU . . . . . . . . . . . . . 20.2 mt-10 -58.61 -34.4 71.1 Favored 'General case' 0 N--CA 1.489 1.525 0 O-C-N 121.094 -1.004 . . . . 2.19 109.735 -179.751 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' C' C ' 350' ' ' LEU . . . . . 0.74 ' CD2' HD13 ' D' ' 350' ' ' LEU . 4.9 tt -64.07 -46.78 82.79 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.304 -0.872 . . . . 0.46 109.459 -179.713 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' C' C ' 351' ' ' LYS . . . . . 0.539 ' N ' HD23 ' C' ' 350' ' ' LEU . 3.5 tttt -61.16 -44.02 97.97 Favored 'General case' 0 C--N 1.301 -1.531 0 O-C-N 121.408 -0.807 . . . . 1.35 109.587 -179.79 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' C' C ' 352' ' ' ASP . . . . . . . . . . . . . 56.2 m-20 -55.76 -47.0 77.75 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.353 -0.842 . . . . 1.19 109.951 -179.696 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' C' C ' 353' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 1.667 0 O-C-N 121.309 -0.869 . . . . 0.57 109.709 -179.578 . . . . . . . . 0 0 . 1 . 030 nuclear nobuild core ' D' D ' 326' ' ' GLU . . . . . . . . . . . . . 5.7 mt-10 . . . . . 0 N--CA 1.489 1.501 0 N-CA-C 109.496 -0.557 . . . . 2.13 109.496 . . . . . . . . . 0 0 . 1 . 030 nuclear nobuild core ' D' D ' 327' ' ' TYR . . . . . . . . . . . . . 41.3 m-85 -148.35 109.13 4.22 Favored 'General case' 0 C--N 1.302 -1.484 0 O-C-N 121.072 -1.018 . . . . 0.47 109.407 179.949 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' D' D ' 328' ' ' PHE . . . . . . . . . . . . . 18.6 m-85 -113.9 -167.88 1.27 Allowed 'General case' 0 N--CA 1.489 1.49 0 O-C-N 121.158 -0.964 . . . . 0.3 109.125 -179.802 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' D' D ' 329' ' ' THR . . . . . 0.4 ' HA ' ' O ' ' B' ' 330' ' ' LEU . 15.2 p -153.58 169.35 23.44 Favored 'General case' 0 C--N 1.302 -1.49 0 O-C-N 121.373 -0.829 . . . . 0.22 108.855 -179.902 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' D' D ' 330' ' ' LEU . . . . . . . . . . . . . 20.7 tp -151.78 134.48 15.54 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.44 -0.788 . . . . 0.28 109.686 -179.909 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' D' D ' 331' ' ' GLN . . . . . . . . . . . . . 3.3 tp60 -87.19 114.54 23.89 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.526 -0.733 . . . . 0.93 109.583 179.714 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' D' D ' 332' ' ' ILE . . . . . 0.844 HG21 ' HA ' ' D' ' 338' ' ' PHE . 57.8 mt -103.25 101.68 12.54 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.475 0 O-C-N 121.348 -0.845 . . . . 0.25 109.079 179.85 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' D' D ' 333' ' ' ARG . . . . . . . . . . . . . 47.0 mtt180 -72.17 153.42 41.64 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.322 -0.861 . . . . 2.93 109.733 -179.72 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' D' D ' 334' ' ' GLY . . . . . . . . . . . . . . . 76.38 131.33 0.4 Allowed Glycine 0 N--CA 1.492 2.378 0 N-CA-C 109.588 -1.405 . . . . 0.41 109.588 179.672 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' D' D ' 335' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -75.31 -35.15 61.29 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.222 -1.164 . . . . 3.03 109.762 179.994 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' D' D ' 336' ' ' GLU . . . . . . . . . . . . . 9.7 mt-10 -58.46 -58.01 10.42 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.131 -0.981 . . . . 2.26 109.716 -179.937 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' D' D ' 337' ' ' ARG . . . . . . . . . . . . . 5.9 mmt180 -60.81 -35.46 76.57 Favored 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.099 -1.001 . . . . 2.92 109.865 179.927 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' D' D ' 338' ' ' PHE . . . . . 0.844 ' HA ' HG21 ' D' ' 332' ' ' ILE . 65.6 t80 -54.99 -59.47 4.7 Favored 'General case' 0 N--CA 1.487 1.376 0 O-C-N 121.082 -1.011 . . . . 0.37 109.364 179.998 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' D' D ' 339' ' ' GLU . . . . . . . . . . . . . 78.1 mt-10 -50.09 -36.5 29.7 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.592 -0.693 . . . . 1.99 110.485 -179.43 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' D' D ' 340' ' ' MET . . . . . . . . . . . . . 43.5 ttp -64.39 -50.49 67.45 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.078 -1.014 . . . . 0.31 110.278 -179.266 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' D' D ' 341' ' ' PHE . . . . . . . . . . . . . 53.9 m-85 -61.81 -45.53 93.43 Favored 'General case' 0 C--N 1.298 -1.631 0 O-C-N 120.925 -1.109 . . . . 0.18 110.249 -179.408 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' D' D ' 342' ' ' ARG . . . . . . . . . . . . . 11.6 ttp180 -48.12 -43.91 31.48 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.157 -0.964 . . . . 2.41 109.896 -179.656 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' D' D ' 343' ' ' GLU . . . . . . . . . . . . . 27.7 tt0 -58.24 -48.26 80.95 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.246 -0.909 . . . . 2.35 109.7 -179.539 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' D' D ' 344' ' ' LEU . . . . . . . . . . . . . 46.4 mt -61.47 -30.31 70.52 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.074 -1.016 . . . . 0.19 109.551 -179.872 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' D' D ' 345' ' ' ASN . . . . . . . . . . . . . 12.6 t-20 -57.82 -59.11 5.73 Favored 'General case' 0 C--N 1.305 -1.367 0 O-C-N 121.148 -0.97 . . . . 1.09 109.587 -179.931 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' D' D ' 346' ' ' GLU . . . . . . . . . . . . . 83.4 tt0 -60.52 -25.22 65.95 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.327 -0.858 . . . . 1.69 109.692 -179.755 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' D' D ' 347' ' ' ALA . . . . . 0.422 ' HB1' ' HB1' ' C' ' 347' ' ' ALA . . . -61.71 -60.89 2.99 Favored 'General case' 0 C--N 1.301 -1.515 0 O-C-N 121.171 -0.956 . . . . 0.18 109.773 -179.77 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' D' D ' 348' ' ' LEU . . . . . 0.627 HD22 ' N ' ' D' ' 348' ' ' LEU . 3.8 mm? -61.84 -46.33 89.92 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.35 -0.843 . . . . 0.31 109.716 -179.239 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' D' D ' 349' ' ' GLU . . . . . . . . . . . . . 21.1 mm-40 -56.85 -31.67 65.03 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.374 -0.829 . . . . 1.95 109.904 -179.516 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' D' D ' 350' ' ' LEU . . . . . 0.74 HD13 ' CD2' ' C' ' 350' ' ' LEU . 5.8 tt -64.75 -47.12 79.37 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.466 -0.771 . . . . 0.43 108.957 179.787 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' D' D ' 351' ' ' LYS . . . . . . . . . . . . . 6.1 tttt -57.71 -43.67 85.36 Favored 'General case' 0 N--CA 1.489 1.513 0 N-CA-C 109.047 -0.723 . . . . 1.4 109.047 179.755 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' D' D ' 352' ' ' ASP . . . . . . . . . . . . . 15.7 m-20 -55.05 -39.87 69.66 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.362 -0.836 . . . . 1.17 109.603 179.904 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' D' D ' 353' ' ' ALA . . . . . . . . . . . . . . . -69.0 -27.12 65.41 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.465 -0.772 . . . . 0.59 109.848 -179.927 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' D' D ' 354' ' ' GLN . . . . . . . . . . . . . 4.4 tt0 . . . . . 0 N--CA 1.488 1.468 0 O-C-N 120.946 -1.096 . . . . 1.44 109.997 -179.636 . . . . . . . . 0 0 . 1 . 031 nuclear nobuild core ' A' A ' 326' ' ' GLU . . . . . . . . . . . . . 2.6 mt-10 . . . . . 0 N--CA 1.488 1.47 0 N-CA-C 109.042 -0.725 . . . . 2.13 109.042 . . . . . . . . . 0 0 . 1 . 031 nuclear nobuild core ' A' A ' 327' ' ' TYR . . . . . 0.483 ' CE1' ' HG2' ' C' ' 333' ' ' ARG . 33.6 m-85 -148.5 112.42 5.14 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.212 -0.93 . . . . 0.48 109.722 179.901 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 328' ' ' PHE . . . . . 0.405 ' O ' HG23 ' A' ' 329' ' ' THR . 85.1 m-85 -114.78 -168.12 1.33 Allowed 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.452 -0.78 . . . . 0.31 109.45 179.972 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 329' ' ' THR . . . . . 0.405 HG23 ' O ' ' A' ' 328' ' ' PHE . 37.0 p -154.18 157.93 39.56 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.206 -0.934 . . . . 0.22 109.315 -179.971 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 330' ' ' LEU . . . . . 0.583 HD11 HD22 ' C' ' 345' ' ' ASN . 21.9 tp -150.73 128.81 11.85 Favored 'General case' 0 N--CA 1.488 1.465 0 O-C-N 121.213 -0.929 . . . . 0.28 109.888 -179.546 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 331' ' ' GLN . . . . . . . . . . . . . 1.3 tt0 -86.92 117.06 25.4 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.242 -0.911 . . . . 0.91 109.095 179.673 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 332' ' ' ILE . . . . . 0.585 HG21 ' HA ' ' A' ' 338' ' ' PHE . 96.2 mt -103.43 106.49 20.24 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.565 0 O-C-N 121.114 -0.991 . . . . 0.26 109.96 -179.576 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 333' ' ' ARG . . . . . 0.598 ' HG2' ' CE1' ' C' ' 327' ' ' TYR . 1.6 mtp180 -73.15 154.21 40.42 Favored 'General case' 0 C--N 1.303 -1.439 0 O-C-N 121.466 -0.771 . . . . 2.92 109.429 179.781 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 334' ' ' GLY . . . . . . . . . . . . . . . 79.62 129.67 0.73 Allowed Glycine 0 N--CA 1.492 2.397 0 N-CA-C 109.882 -1.287 . . . . 0.4 109.882 179.621 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 335' ' ' ARG . . . . . 0.529 ' NH1' ' HG2' ' A' ' 335' ' ' ARG . 21.6 ttt-85 -79.8 -38.24 33.46 Favored 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.355 -1.085 . . . . 3.01 109.229 179.627 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 336' ' ' GLU . . . . . . . . . . . . . 21.4 mt-10 -58.69 -59.14 5.88 Favored 'General case' 0 N--CA 1.488 1.436 0 O-C-N 121.399 -0.813 . . . . 2.29 109.59 -179.996 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 337' ' ' ARG . . . . . . . . . . . . . 2.5 mmt180 -60.17 -30.62 69.46 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.292 -0.88 . . . . 2.93 109.3 -179.981 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 338' ' ' PHE . . . . . 0.585 ' HA ' HG21 ' A' ' 332' ' ' ILE . 64.3 t80 -55.48 -58.1 9.14 Favored 'General case' 0 N--CA 1.488 1.474 0 O-C-N 121.171 -0.955 . . . . 0.38 109.278 179.826 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 339' ' ' GLU . . . . . . . . . . . . . 7.2 mt-10 -51.92 -30.95 26.58 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.139 -0.975 . . . . 1.97 109.99 -179.847 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 340' ' ' MET . . . . . . . . . . . . . 16.0 ttp -64.67 -54.4 32.34 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.166 -0.959 . . . . 0.31 109.885 -179.6 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 341' ' ' PHE . . . . . . . . . . . . . 35.7 m-85 -62.61 -52.77 62.08 Favored 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.3 -0.875 . . . . 0.18 110.024 -179.6 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 342' ' ' ARG . . . . . . . . . . . . . 12.9 ttp180 -47.93 -41.17 24.07 Favored 'General case' 0 N--CA 1.489 1.481 0 O-C-N 121.234 -0.916 . . . . 2.42 109.946 -179.576 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 343' ' ' GLU . . . . . . . . . . . . . 42.9 tt0 -59.17 -45.11 91.86 Favored 'General case' 0 N--CA 1.494 1.74 0 O-C-N 121.156 -0.965 . . . . 2.35 109.741 -179.859 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 344' ' ' LEU . . . . . 0.611 HD22 HD22 ' B' ' 344' ' ' LEU . 39.8 mt -62.81 -41.63 99.37 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.118 -0.989 . . . . 0.18 109.781 -179.864 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 345' ' ' ASN . . . . . 0.541 HD22 HD11 ' C' ' 330' ' ' LEU . 33.2 t-20 -56.16 -45.46 79.67 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.113 -0.992 . . . . 1.09 109.464 -179.826 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 346' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -60.88 -36.08 78.28 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.255 -0.903 . . . . 1.65 109.746 -179.949 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 347' ' ' ALA . . . . . 0.992 ' HB1' ' HB1' ' B' ' 347' ' ' ALA . . . -60.54 -52.32 65.7 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.164 -0.96 . . . . 0.18 110.27 -179.646 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 348' ' ' LEU . . . . . 0.59 HD22 ' N ' ' A' ' 348' ' ' LEU . 3.9 mm? -60.78 -49.74 76.28 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.196 -0.94 . . . . 0.3 109.888 -179.403 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 349' ' ' GLU . . . . . . . . . . . . . 53.3 mt-10 -57.49 -31.08 65.65 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.233 -0.917 . . . . 1.94 110.038 -179.332 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 350' ' ' LEU . . . . . 0.76 ' O ' HD23 ' A' ' 350' ' ' LEU . 4.7 tt -63.81 -41.28 97.92 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.075 -1.016 . . . . 0.46 109.054 179.92 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 351' ' ' LYS . . . . . . . . . . . . . 6.3 tttt -59.65 -44.94 93.34 Favored 'General case' 0 C--N 1.302 -1.497 0 O-C-N 121.342 -0.849 . . . . 1.4 109.647 179.94 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 352' ' ' ASP . . . . . . . . . . . . . 63.8 m-20 -54.48 -43.33 71.65 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.162 -0.962 . . . . 1.16 109.623 -179.917 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 353' ' ' ALA . . . . . . . . . . . . . . . -67.61 -28.91 68.15 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.194 -0.941 . . . . 0.63 109.599 -179.687 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 354' ' ' GLN . . . . . 0.683 ' NE2' HD11 ' B' ' 350' ' ' LEU . 0.4 OUTLIER . . . . . 0 N--CA 1.491 1.611 0 O-C-N 121.211 -0.93 . . . . 1.47 109.378 179.853 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' B' B ' 326' ' ' GLU . . . . . . . . . . . . . 2.6 mt-10 . . . . . 0 N--CA 1.488 1.471 0 N-CA-C 109.314 -0.624 . . . . 2.13 109.314 . . . . . . . . . 0 0 . 1 . 031 nuclear nobuild core ' B' B ' 327' ' ' TYR . . . . . 0.627 ' CE1' ' HG2' ' D' ' 333' ' ' ARG . 35.9 m-85 -148.57 112.44 5.13 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.42 -0.8 . . . . 0.48 109.671 179.74 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' B' B ' 328' ' ' PHE . . . . . 0.487 ' CE2' ' HA ' ' D' ' 335' ' ' ARG . 85.4 m-85 -114.94 -168.88 1.45 Allowed 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.429 -0.794 . . . . 0.32 109.287 179.756 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' B' B ' 329' ' ' THR . . . . . . . . . . . . . 37.9 p -153.53 158.53 41.41 Favored 'General case' 0 N--CA 1.489 1.495 0 O-C-N 121.243 -0.911 . . . . 0.23 109.262 179.989 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' B' B ' 330' ' ' LEU . . . . . . . . . . . . . 20.5 tp -151.11 129.61 12.16 Favored 'General case' 0 C--N 1.303 -1.429 0 O-C-N 121.275 -0.891 . . . . 0.28 109.628 -179.758 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' B' B ' 331' ' ' GLN . . . . . . . . . . . . . 1.4 tt0 -87.42 117.73 26.39 Favored 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.289 -0.882 . . . . 0.91 108.863 179.475 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' B' B ' 332' ' ' ILE . . . . . 0.561 HG21 ' HA ' ' B' ' 338' ' ' PHE . 95.4 mt -103.97 106.71 20.77 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.597 0 O-C-N 121.178 -0.951 . . . . 0.24 110.048 -179.724 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' B' B ' 333' ' ' ARG . . . . . 0.541 ' HG2' ' CE1' ' D' ' 327' ' ' TYR . 1.7 mtp180 -73.38 154.84 39.88 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.268 -0.895 . . . . 2.93 109.536 179.751 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' B' B ' 334' ' ' GLY . . . . . . . . . . . . . . . 77.99 128.63 0.46 Allowed Glycine 0 N--CA 1.491 2.303 0 N-CA-C 109.987 -1.245 . . . . 0.4 109.987 179.82 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' B' B ' 335' ' ' ARG . . . . . 0.538 ' HG2' ' NH1' ' B' ' 335' ' ' ARG . 23.1 ttt-85 -78.77 -38.72 37.88 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.285 -1.127 . . . . 3.01 109.293 179.787 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' B' B ' 336' ' ' GLU . . . . . . . . . . . . . 22.1 mt-10 -57.73 -59.1 5.72 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.317 -0.864 . . . . 2.28 109.563 179.935 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' B' B ' 337' ' ' ARG . . . . . . . . . . . . . 2.5 mmt180 -60.54 -30.43 69.76 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.207 -0.933 . . . . 2.93 109.34 -179.886 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' B' B ' 338' ' ' PHE . . . . . 0.561 ' HA ' HG21 ' B' ' 332' ' ' ILE . 65.8 t80 -55.52 -57.73 10.71 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.332 -0.855 . . . . 0.37 109.379 179.723 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' B' B ' 339' ' ' GLU . . . . . . . . . . . . . 7.9 mt-10 -52.38 -31.06 32.05 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.218 -0.926 . . . . 1.98 109.755 -179.848 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' B' B ' 340' ' ' MET . . . . . . . . . . . . . 17.5 ttp -64.3 -54.54 31.63 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.246 -0.909 . . . . 0.32 109.88 -179.5 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' B' B ' 341' ' ' PHE . . . . . . . . . . . . . 36.4 m-85 -62.73 -53.34 55.92 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.389 -0.819 . . . . 0.18 109.857 -179.579 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' B' B ' 342' ' ' ARG . . . . . . . . . . . . . 13.6 ttp180 -47.2 -41.37 18.04 Favored 'General case' 0 C--N 1.301 -1.511 0 O-C-N 121.274 -0.891 . . . . 2.42 109.99 -179.6 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' B' B ' 343' ' ' GLU . . . . . . . . . . . . . 41.0 tt0 -58.77 -45.61 89.37 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.013 -1.054 . . . . 2.35 109.704 -179.719 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' B' B ' 344' ' ' LEU . . . . . 0.611 HD22 HD22 ' A' ' 344' ' ' LEU . 41.1 mt -62.8 -40.93 98.86 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.237 -0.914 . . . . 0.18 110.078 -179.586 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' B' B ' 345' ' ' ASN . . . . . . . . . . . . . 33.9 t-20 -56.84 -44.99 82.64 Favored 'General case' 0 C--N 1.301 -1.522 0 O-C-N 121.242 -0.911 . . . . 1.09 109.449 -179.877 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' B' B ' 346' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -61.36 -35.43 77.43 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.191 -0.943 . . . . 1.66 109.73 -179.924 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' B' B ' 347' ' ' ALA . . . . . 0.992 ' HB1' ' HB1' ' A' ' 347' ' ' ALA . . . -61.3 -51.98 66.6 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.24 -0.913 . . . . 0.17 110.078 -179.48 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' B' B ' 348' ' ' LEU . . . . . 0.604 HD22 ' N ' ' B' ' 348' ' ' LEU . 3.9 mm? -61.0 -49.62 76.69 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.085 -1.009 . . . . 0.29 109.933 -179.494 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' B' B ' 349' ' ' GLU . . . . . . . . . . . . . 53.7 mt-10 -57.7 -31.61 66.56 Favored 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.243 -0.91 . . . . 1.95 109.897 -179.335 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' B' B ' 350' ' ' LEU . . . . . 0.765 ' O ' HD23 ' B' ' 350' ' ' LEU . 4.7 tt -62.98 -41.88 99.68 Favored 'General case' 0 N--CA 1.488 1.474 0 O-C-N 120.981 -1.074 . . . . 0.45 109.108 179.857 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' B' B ' 351' ' ' LYS . . . . . . . . . . . . . 6.3 tttt -59.0 -44.67 91.7 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.311 -0.868 . . . . 1.38 109.715 179.908 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' B' B ' 352' ' ' ASP . . . . . . . . . . . . . 65.4 m-20 -54.74 -43.59 72.82 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.195 -0.941 . . . . 1.16 109.776 -179.695 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' B' B ' 353' ' ' ALA . . . . . . . . . . . . . . . -67.49 -28.86 68.19 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.216 -0.927 . . . . 0.61 109.366 -179.955 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' B' B ' 354' ' ' GLN . . . . . 0.759 ' NE2' HD11 ' A' ' 350' ' ' LEU . 0.4 OUTLIER . . . . . 0 N--CA 1.49 1.536 0 O-C-N 121.287 -0.883 . . . . 1.45 109.661 179.862 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' C' C ' 326' ' ' GLU . . . . . . . . . . . . . 1.9 mm-40 . . . . . 0 N--CA 1.49 1.561 0 CA-C-O 121.407 0.622 . . . . 2.17 109.432 . . . . . . . . . 0 0 . 1 . 031 nuclear nobuild core ' C' C ' 327' ' ' TYR . . . . . 0.598 ' CE1' ' HG2' ' A' ' 333' ' ' ARG . 32.7 m-85 -148.2 101.34 3.26 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.193 -0.942 . . . . 0.48 109.629 179.864 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' C' C ' 328' ' ' PHE . . . . . 0.432 ' O ' HG23 ' C' ' 329' ' ' THR . 92.8 m-85 -108.17 -164.37 0.95 Allowed 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.258 -0.901 . . . . 0.33 109.414 179.878 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' C' C ' 329' ' ' THR . . . . . 0.432 HG23 ' O ' ' C' ' 328' ' ' PHE . 3.0 p -154.19 157.5 38.92 Favored 'General case' 0 C--N 1.303 -1.426 0 O-C-N 121.405 -0.809 . . . . 0.23 109.039 -179.968 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' C' C ' 330' ' ' LEU . . . . . 0.541 HD11 HD22 ' A' ' 345' ' ' ASN . 19.8 tp -148.38 127.27 12.68 Favored 'General case' 0 N--CA 1.489 1.48 0 O-C-N 121.234 -0.916 . . . . 0.28 109.687 -179.735 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' C' C ' 331' ' ' GLN . . . . . . . . . . . . . 1.1 tt0 -86.82 120.06 27.7 Favored 'General case' 0 N--CA 1.487 1.41 0 N-CA-C 108.587 -0.894 . . . . 1.48 108.587 179.286 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' C' C ' 332' ' ' ILE . . . . . 0.668 HG21 ' HA ' ' C' ' 338' ' ' PHE . 15.0 mt -102.84 103.11 14.58 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.588 0 O-C-N 121.178 -0.951 . . . . 0.24 109.845 -179.405 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' C' C ' 333' ' ' ARG . . . . . 0.483 ' HG2' ' CE1' ' A' ' 327' ' ' TYR . 1.6 mtt-85 -73.49 126.25 29.79 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.44 -0.787 . . . . 2.74 109.47 179.812 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' C' C ' 334' ' ' GLY . . . . . . . . . . . . . . . 104.68 125.76 5.65 Favored Glycine 0 N--CA 1.49 2.243 0 N-CA-C 109.473 -1.451 . . . . 0.35 109.473 -179.889 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' C' C ' 335' ' ' ARG . . . . . 0.469 ' O ' ' HB3' ' C' ' 338' ' ' PHE . 2.6 ttm180 -78.65 -36.21 44.21 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.305 -1.115 . . . . 2.53 109.612 -179.69 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' C' C ' 336' ' ' GLU . . . . . . . . . . . . . 3.0 mm-40 -58.57 -63.31 1.33 Allowed 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.182 -0.949 . . . . 2.62 109.598 -179.802 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' C' C ' 337' ' ' ARG . . . . . . . . . . . . . 14.9 mmt180 -59.12 -27.79 65.93 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.265 -0.897 . . . . 2.81 109.615 -179.995 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' C' C ' 338' ' ' PHE . . . . . 0.668 ' HA ' HG21 ' C' ' 332' ' ' ILE . 59.8 t80 -55.34 -58.28 8.39 Favored 'General case' 0 N--CA 1.489 1.489 0 O-C-N 121.25 -0.906 . . . . 0.4 109.731 179.969 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' C' C ' 339' ' ' GLU . . . . . . . . . . . . . 17.9 mt-10 -50.52 -32.95 19.76 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.097 -1.002 . . . . 2.05 110.087 -179.544 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' C' C ' 340' ' ' MET . . . . . . . . . . . . . 35.0 ttp -64.19 -55.27 22.89 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.13 -0.981 . . . . 0.32 110.116 -179.496 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' C' C ' 341' ' ' PHE . . . . . . . . . . . . . 49.6 m-85 -60.93 -53.64 54.79 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.126 -0.984 . . . . 0.18 109.999 -179.486 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' C' C ' 342' ' ' ARG . . . . . . . . . . . . . 16.6 ttt180 -46.98 -38.47 10.76 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.088 -1.008 . . . . 2.91 109.805 -179.581 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' C' C ' 343' ' ' GLU . . . . . . . . . . . . . 31.4 tt0 -60.18 -47.35 86.3 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.165 -0.96 . . . . 2.14 109.848 -179.858 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' C' C ' 344' ' ' LEU . . . . . 0.478 HD22 HD22 ' D' ' 344' ' ' LEU . 36.0 mt -62.55 -35.48 79.6 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.146 -0.971 . . . . 0.22 109.925 -179.507 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' C' C ' 345' ' ' ASN . . . . . 0.583 HD22 HD11 ' A' ' 330' ' ' LEU . 54.8 t-20 -56.37 -48.83 76.03 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.062 -1.024 . . . . 1.08 109.371 -179.991 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' C' C ' 346' ' ' GLU . . . . . . . . . . . . . 2.1 tp10 -62.47 -32.76 73.7 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.253 -0.904 . . . . 2.21 109.734 179.945 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' C' C ' 347' ' ' ALA . . . . . 0.977 ' HB1' ' HB1' ' D' ' 347' ' ' ALA . . . -62.11 -55.96 23.62 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.205 -0.935 . . . . 0.18 110.083 -179.718 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' C' C ' 348' ' ' LEU . . . . . 0.59 HD22 ' N ' ' C' ' 348' ' ' LEU . 3.9 mm? -60.97 -49.56 76.94 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.218 -0.926 . . . . 0.32 109.832 -179.403 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' C' C ' 349' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -56.43 -33.47 65.87 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.127 -0.983 . . . . 2.19 109.373 -179.704 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' C' C ' 350' ' ' LEU . . . . . 1.009 HD22 HD13 ' D' ' 350' ' ' LEU . 6.4 tt -62.53 -43.35 99.03 Favored 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.337 -0.852 . . . . 0.46 109.092 179.759 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' C' C ' 351' ' ' LYS . . . . . . . . . . . . . 36.3 tttt -58.15 -41.84 84.64 Favored 'General case' 0 C--N 1.301 -1.514 0 O-C-N 121.377 -0.827 . . . . 1.35 109.045 179.742 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' C' C ' 352' ' ' ASP . . . . . . . . . . . . . 50.5 m-20 -56.39 -49.2 75.16 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.241 -0.912 . . . . 1.19 109.455 179.668 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' C' C ' 353' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 1.628 0 O-C-N 121.434 -0.791 . . . . 0.57 109.303 179.943 . . . . . . . . 0 0 . 1 . 031 nuclear nobuild core ' D' D ' 326' ' ' GLU . . . . . . . . . . . . . 2.6 mt-10 . . . . . 0 N--CA 1.488 1.468 0 N-CA-C 109.074 -0.713 . . . . 2.13 109.074 . . . . . . . . . 0 0 . 1 . 031 nuclear nobuild core ' D' D ' 327' ' ' TYR . . . . . 0.541 ' CE1' ' HG2' ' B' ' 333' ' ' ARG . 34.8 m-85 -148.65 111.58 4.85 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.199 -0.938 . . . . 0.47 109.814 179.866 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' D' D ' 328' ' ' PHE . . . . . . . . . . . . . 85.6 m-85 -113.88 -168.4 1.34 Allowed 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.394 -0.816 . . . . 0.3 109.372 179.796 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' D' D ' 329' ' ' THR . . . . . . . . . . . . . 35.5 p -153.9 157.79 39.76 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.169 -0.957 . . . . 0.22 109.132 -179.771 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' D' D ' 330' ' ' LEU . . . . . . . . . . . . . 18.3 tp -150.81 129.44 12.27 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.216 -0.928 . . . . 0.28 109.864 -179.767 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' D' D ' 331' ' ' GLN . . . . . . . . . . . . . 1.7 tt0 -87.43 116.63 25.67 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.218 -0.926 . . . . 0.93 109.27 179.702 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' D' D ' 332' ' ' ILE . . . . . 0.584 HG21 ' HA ' ' D' ' 338' ' ' PHE . 95.0 mt -102.85 106.2 19.59 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.528 0 O-C-N 121.25 -0.906 . . . . 0.25 110.132 -179.572 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' D' D ' 333' ' ' ARG . . . . . 0.627 ' HG2' ' CE1' ' B' ' 327' ' ' TYR . 1.8 mtp180 -72.95 155.25 40.05 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.375 -0.828 . . . . 2.93 109.553 179.614 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' D' D ' 334' ' ' GLY . . . . . . . . . . . . . . . 78.09 128.91 0.48 Allowed Glycine 0 N--CA 1.491 2.337 0 N-CA-C 109.847 -1.301 . . . . 0.41 109.847 179.643 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' D' D ' 335' ' ' ARG . . . . . 0.521 ' HG2' ' NH1' ' D' ' 335' ' ' ARG . 22.0 ttt-85 -79.68 -37.72 35.17 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.246 -1.149 . . . . 3.03 109.235 179.734 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' D' D ' 336' ' ' GLU . . . . . . . . . . . . . 23.6 mt-10 -58.49 -59.54 5.21 Favored 'General case' 0 C--N 1.304 -1.383 0 O-C-N 121.261 -0.899 . . . . 2.26 109.483 179.922 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' D' D ' 337' ' ' ARG . . . . . . . . . . . . . 2.0 mmt180 -60.02 -30.18 68.99 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.313 -0.867 . . . . 2.92 109.438 -179.947 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' D' D ' 338' ' ' PHE . . . . . 0.584 ' HA ' HG21 ' D' ' 332' ' ' ILE . 65.6 t80 -55.37 -58.37 8.01 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.278 -0.889 . . . . 0.37 109.376 179.855 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' D' D ' 339' ' ' GLU . . . . . . . . . . . . . 8.0 mt-10 -51.9 -31.2 27.32 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.27 -0.894 . . . . 1.99 109.7 -179.939 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' D' D ' 340' ' ' MET . . . . . . . . . . . . . 17.6 ttp -64.21 -54.27 36.12 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.019 -1.051 . . . . 0.31 109.915 -179.627 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' D' D ' 341' ' ' PHE . . . . . . . . . . . . . 36.3 m-85 -62.72 -53.19 58.16 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.222 -0.924 . . . . 0.18 109.984 -179.539 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' D' D ' 342' ' ' ARG . . . . . . . . . . . . . 13.6 ttp180 -47.86 -40.29 21.07 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.357 -0.84 . . . . 2.41 109.943 -179.593 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' D' D ' 343' ' ' GLU . . . . . . . . . . . . . 40.2 tt0 -59.67 -45.4 92.17 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.042 -1.037 . . . . 2.35 109.723 -179.699 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' D' D ' 344' ' ' LEU . . . . . 0.478 HD22 HD22 ' C' ' 344' ' ' LEU . 41.9 mt -63.0 -40.76 98.74 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.27 -0.894 . . . . 0.19 109.998 -179.678 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' D' D ' 345' ' ' ASN . . . . . . . . . . . . . 33.5 t-20 -56.7 -44.93 82.03 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.34 -0.85 . . . . 1.09 109.454 -179.699 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' D' D ' 346' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -61.72 -35.86 79.26 Favored 'General case' 0 C--N 1.303 -1.447 0 O-C-N 121.476 -0.765 . . . . 1.69 109.746 -179.809 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' D' D ' 347' ' ' ALA . . . . . 0.977 ' HB1' ' HB1' ' C' ' 347' ' ' ALA . . . -60.58 -51.82 67.79 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.289 -0.882 . . . . 0.18 110.203 -179.614 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' D' D ' 348' ' ' LEU . . . . . 0.592 HD22 ' N ' ' D' ' 348' ' ' LEU . 3.9 mm? -61.16 -49.87 75.49 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.077 -1.014 . . . . 0.31 109.818 -179.315 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' D' D ' 349' ' ' GLU . . . . . . . . . . . . . 55.6 mt-10 -57.45 -31.29 65.77 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.168 -0.957 . . . . 1.95 110.062 -179.368 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' D' D ' 350' ' ' LEU . . . . . 1.009 HD13 HD22 ' C' ' 350' ' ' LEU . 4.7 tt -63.47 -41.47 98.6 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 120.972 -1.08 . . . . 0.43 109.11 179.83 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' D' D ' 351' ' ' LYS . . . . . . . . . . . . . 6.7 tttt -59.6 -44.29 93.43 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.377 -0.827 . . . . 1.4 109.517 -179.992 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' D' D ' 352' ' ' ASP . . . . . . . . . . . . . 66.6 m-20 -54.93 -43.5 73.4 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.201 -0.937 . . . . 1.17 109.747 -179.859 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' D' D ' 353' ' ' ALA . . . . . . . . . . . . . . . -67.87 -28.2 67.33 Favored 'General case' 0 N--CA 1.489 1.488 0 O-C-N 121.215 -0.928 . . . . 0.59 109.703 -179.739 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' D' D ' 354' ' ' GLN . . . . . 0.525 ' NE2' HD11 ' C' ' 350' ' ' LEU . 0.3 OUTLIER . . . . . 0 N--CA 1.491 1.618 0 O-C-N 121.41 -0.806 . . . . 1.44 109.515 179.883 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' A' A ' 326' ' ' GLU . . . . . 0.431 ' HB2' ' CE1' ' A' ' 328' ' ' PHE . 44.9 mt-10 . . . . . 0 N--CA 1.489 1.49 0 N-CA-C 109.369 -0.604 . . . . 2.13 109.369 . . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 327' ' ' TYR . . . . . . . . . . . . . 44.6 m-85 -149.49 109.27 4.05 Favored 'General case' 0 N--CA 1.488 1.452 0 O-C-N 121.337 -0.852 . . . . 0.48 109.267 179.993 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 328' ' ' PHE . . . . . 0.431 ' CE1' ' HB2' ' A' ' 326' ' ' GLU . 41.7 m-85 -113.58 -169.16 1.45 Allowed 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.288 -0.882 . . . . 0.31 109.473 -179.809 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' A' A ' 329' ' ' THR . . . . . 0.427 HG23 ' O ' ' A' ' 328' ' ' PHE . 6.4 p -153.6 168.39 26.34 Favored 'General case' 0 N--CA 1.488 1.456 0 O-C-N 121.294 -0.879 . . . . 0.22 109.216 -179.948 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' A' A ' 330' ' ' LEU . . . . . . . . . . . . . 20.6 tp -150.19 129.03 12.47 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.171 -0.956 . . . . 0.28 109.704 -179.783 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 331' ' ' GLN . . . . . . . . . . . . . 1.2 tp60 -87.7 113.35 23.29 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.441 -0.787 . . . . 0.91 109.393 179.739 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 332' ' ' ILE . . . . . 0.936 HG21 ' HA ' ' A' ' 338' ' ' PHE . 76.2 mt -103.57 105.06 17.66 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.573 0 O-C-N 121.193 -0.942 . . . . 0.26 109.431 -179.975 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' A' A ' 333' ' ' ARG . . . . . 0.457 ' NH1' ' HG2' ' A' ' 333' ' ' ARG . 0.0 OUTLIER -71.75 150.71 44.2 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.264 -0.898 . . . . 2.92 109.284 179.822 . . . . . . . . 3 3 . 1 . 032 nuclear nobuild core ' A' A ' 334' ' ' GLY . . . . . . . . . . . . . . . 76.43 126.73 0.25 Allowed Glycine 0 N--CA 1.49 2.267 0 N-CA-C 109.473 -1.451 . . . . 0.4 109.473 -179.982 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 335' ' ' ARG . . . . . 0.463 ' HB2' ' OE1' ' C' ' 326' ' ' GLU . 0.4 OUTLIER -74.02 -32.84 63.54 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.264 -1.139 . . . . 3.01 109.681 -179.879 . . . . . . . . 3 3 . 1 . 032 nuclear nobuild core ' A' A ' 336' ' ' GLU . . . . . . . . . . . . . 3.1 mt-10 -58.05 -61.5 2.5 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.282 -0.886 . . . . 2.29 109.796 -179.763 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 337' ' ' ARG . . . . . . . . . . . . . 22.4 mmm180 -59.78 -33.69 72.02 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.194 -0.941 . . . . 2.93 109.633 -179.704 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 338' ' ' PHE . . . . . 0.936 ' HA ' HG21 ' A' ' 332' ' ' ILE . 59.5 t80 -55.89 -55.12 36.37 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.159 -0.963 . . . . 0.38 109.964 -179.75 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' A' A ' 339' ' ' GLU . . . . . . . . . . . . . 45.4 mt-10 -50.86 -33.92 25.88 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.237 -0.914 . . . . 1.97 110.369 -179.354 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 340' ' ' MET . . . . . . . . . . . . . 24.2 ttp -64.08 -51.7 62.8 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 120.976 -1.077 . . . . 0.31 110.081 -179.457 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 341' ' ' PHE . . . . . . . . . . . . . 45.2 m-85 -61.98 -45.18 94.76 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.137 -0.977 . . . . 0.18 110.017 -179.437 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 342' ' ' ARG . . . . . 0.418 ' O ' ' HB3' ' A' ' 345' ' ' ASN . 40.5 ttt180 -50.77 -40.39 54.84 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.144 -0.973 . . . . 2.42 109.817 -179.75 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' A' A ' 343' ' ' GLU . . . . . . . . . . . . . 35.5 tp10 -58.43 -51.53 69.46 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.095 -1.003 . . . . 2.35 109.766 -179.624 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 344' ' ' LEU . . . . . 0.618 HD22 HD22 ' B' ' 344' ' ' LEU . 84.6 mt -61.08 -32.0 71.65 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.239 -0.913 . . . . 0.18 109.338 -179.895 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' A' A ' 345' ' ' ASN . . . . . 0.418 ' HB3' ' O ' ' A' ' 342' ' ' ARG . 8.7 t-20 -58.67 -55.0 40.7 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.254 -0.904 . . . . 1.09 109.325 179.861 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' A' A ' 346' ' ' GLU . . . . . . . . . . . . . 32.4 tp10 -61.62 -32.1 72.22 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.382 -0.824 . . . . 1.65 109.843 -179.736 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 347' ' ' ALA . . . . . 0.701 ' HB1' ' HB1' ' B' ' 347' ' ' ALA . . . -59.5 -57.04 14.69 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.187 -0.945 . . . . 0.18 109.787 -179.738 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' A' A ' 348' ' ' LEU . . . . . 0.555 HD22 ' N ' ' A' ' 348' ' ' LEU . 3.5 mm? -61.82 -38.73 89.25 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.171 -0.956 . . . . 0.3 109.645 -179.675 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' A' A ' 349' ' ' GLU . . . . . . . . . . . . . 1.8 mt-10 -58.86 -38.39 78.66 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.306 -0.871 . . . . 1.94 110.168 -179.443 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 350' ' ' LEU . . . . . 0.515 HD13 HD22 ' B' ' 350' ' ' LEU . 7.8 tt -63.76 -43.67 95.73 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.179 -0.951 . . . . 0.46 109.87 -179.576 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' A' A ' 351' ' ' LYS . . . . . . . . . . . . . 18.8 tttm -58.34 -42.02 85.94 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.311 -0.868 . . . . 1.4 109.549 -179.774 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 352' ' ' ASP . . . . . . . . . . . . . 48.0 m-20 -56.2 -41.52 75.72 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.252 -0.905 . . . . 1.16 109.522 -179.983 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 353' ' ' ALA . . . . . . . . . . . . . . . -67.97 -25.54 65.48 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.229 -0.92 . . . . 0.63 109.434 -179.936 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 354' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.491 1.594 0 O-C-N 121.261 -0.9 . . . . 1.47 109.508 179.968 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' B' B ' 326' ' ' GLU . . . . . 0.44 ' HB2' ' CE1' ' B' ' 328' ' ' PHE . 45.0 mt-10 . . . . . 0 N--CA 1.488 1.462 0 N-CA-C 109.348 -0.612 . . . . 2.13 109.348 . . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' B' B ' 327' ' ' TYR . . . . . . . . . . . . . 44.6 m-85 -149.6 109.22 4.02 Favored 'General case' 0 N--CA 1.488 1.447 0 O-C-N 121.259 -0.901 . . . . 0.48 109.291 179.914 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' B' B ' 328' ' ' PHE . . . . . 0.44 ' CE1' ' HB2' ' B' ' 326' ' ' GLU . 40.8 m-85 -113.63 -169.23 1.47 Allowed 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.255 -0.903 . . . . 0.32 109.496 -179.772 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' B' B ' 329' ' ' THR . . . . . 0.433 HG23 ' O ' ' B' ' 328' ' ' PHE . 6.4 p -153.52 168.64 25.46 Favored 'General case' 0 N--CA 1.488 1.458 0 O-C-N 121.247 -0.908 . . . . 0.23 109.267 -179.989 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' B' B ' 330' ' ' LEU . . . . . 0.477 HD21 HD22 ' D' ' 345' ' ' ASN . 20.0 tp -150.26 129.15 12.51 Favored 'General case' 0 N--CA 1.489 1.487 0 O-C-N 121.18 -0.95 . . . . 0.28 109.759 -179.88 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' B' B ' 331' ' ' GLN . . . . . . . . . . . . . 1.2 tp60 -87.83 113.27 23.33 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.355 -0.841 . . . . 0.91 109.383 179.739 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' B' B ' 332' ' ' ILE . . . . . 0.918 HG21 ' HA ' ' B' ' 338' ' ' PHE . 76.0 mt -103.59 105.01 17.57 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.554 0 O-C-N 121.29 -0.881 . . . . 0.24 109.444 -179.948 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' B' B ' 333' ' ' ARG . . . . . 0.459 ' HG2' ' NH1' ' B' ' 333' ' ' ARG . 0.0 OUTLIER -71.51 150.71 44.56 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.178 -0.952 . . . . 2.93 109.359 179.802 . . . . . . . . 3 3 . 1 . 032 nuclear nobuild core ' B' B ' 334' ' ' GLY . . . . . . . . . . . . . . . 76.24 126.78 0.24 Allowed Glycine 0 N--CA 1.49 2.276 0 N-CA-C 109.553 -1.419 . . . . 0.4 109.553 -179.933 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' B' B ' 335' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -74.04 -32.9 63.53 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.25 -1.147 . . . . 3.01 109.654 -179.855 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' B' B ' 336' ' ' GLU . . . . . . . . . . . . . 3.1 mt-10 -57.96 -61.42 2.55 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.132 -0.98 . . . . 2.28 109.781 -179.723 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' B' B ' 337' ' ' ARG . . . . . . . . . . . . . 22.2 mmm180 -59.94 -33.78 72.36 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.225 -0.922 . . . . 2.93 109.674 -179.716 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' B' B ' 338' ' ' PHE . . . . . 0.918 ' HA ' HG21 ' B' ' 332' ' ' ILE . 59.0 t80 -55.89 -55.11 36.48 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.16 -0.963 . . . . 0.37 109.873 -179.715 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' B' B ' 339' ' ' GLU . . . . . . . . . . . . . 45.0 mt-10 -50.65 -34.22 25.47 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.21 -0.931 . . . . 1.98 110.399 -179.435 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' B' B ' 340' ' ' MET . . . . . . . . . . . . . 23.9 ttp -64.01 -51.57 63.63 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.049 -1.032 . . . . 0.32 110.115 -179.375 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' B' B ' 341' ' ' PHE . . . . . . . . . . . . . 44.8 m-85 -61.9 -45.46 93.65 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.167 -0.958 . . . . 0.18 109.96 -179.451 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' B' B ' 342' ' ' ARG . . . . . 0.424 ' O ' ' HB3' ' B' ' 345' ' ' ASN . 41.1 ttt180 -50.62 -40.36 52.67 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.187 -0.946 . . . . 2.42 109.933 -179.796 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' B' B ' 343' ' ' GLU . . . . . . . . . . . . . 35.4 tp10 -58.46 -51.51 69.53 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.192 -0.943 . . . . 2.35 109.825 -179.604 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' B' B ' 344' ' ' LEU . . . . . 0.618 HD22 HD22 ' A' ' 344' ' ' LEU . 84.0 mt -61.01 -31.99 71.6 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.137 -0.977 . . . . 0.18 109.345 -179.949 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' B' B ' 345' ' ' ASN . . . . . 0.44 HD22 HD21 ' D' ' 330' ' ' LEU . 9.0 t-20 -58.65 -55.06 39.98 Favored 'General case' 0 N--CA 1.488 1.451 0 O-C-N 121.325 -0.859 . . . . 1.09 109.372 179.83 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' B' B ' 346' ' ' GLU . . . . . . . . . . . . . 32.4 tp10 -61.52 -32.21 72.25 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.478 -0.764 . . . . 1.66 109.815 -179.867 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' B' B ' 347' ' ' ALA . . . . . 0.701 ' HB1' ' HB1' ' A' ' 347' ' ' ALA . . . -59.59 -56.95 15.51 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.166 -0.959 . . . . 0.17 109.912 -179.756 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' B' B ' 348' ' ' LEU . . . . . 0.557 HD22 ' N ' ' B' ' 348' ' ' LEU . 3.5 mm? -61.92 -38.83 89.89 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.168 -0.957 . . . . 0.29 109.71 -179.734 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' B' B ' 349' ' ' GLU . . . . . . . . . . . . . 1.8 mt-10 -58.67 -38.36 78.02 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.298 -0.876 . . . . 1.95 110.184 -179.583 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' B' B ' 350' ' ' LEU . . . . . 0.515 HD22 HD13 ' A' ' 350' ' ' LEU . 7.8 tt -63.81 -43.58 95.84 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.089 -1.007 . . . . 0.45 109.827 -179.512 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' B' B ' 351' ' ' LYS . . . . . . . . . . . . . 18.7 tttm -58.39 -42.14 86.42 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.189 -0.944 . . . . 1.38 109.53 -179.744 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' B' B ' 352' ' ' ASP . . . . . . . . . . . . . 48.5 m-20 -55.91 -41.6 74.79 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.284 -0.885 . . . . 1.16 109.524 -179.996 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' B' B ' 353' ' ' ALA . . . . . . . . . . . . . . . -68.03 -25.6 65.46 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.19 -0.944 . . . . 0.61 109.494 -179.871 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' B' B ' 354' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.49 1.552 0 O-C-N 121.213 -0.929 . . . . 1.45 109.54 179.884 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' C' C ' 326' ' ' GLU . . . . . 0.463 ' OE1' ' HB2' ' A' ' 335' ' ' ARG . 95.0 mt-10 . . . . . 0 N--CA 1.49 1.527 0 N-CA-C 109.286 -0.635 . . . . 2.17 109.286 . . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' C' C ' 327' ' ' TYR . . . . . . . . . . . . . 59.0 m-85 -149.02 104.53 3.44 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.102 -0.999 . . . . 0.48 109.808 -179.744 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' C' C ' 328' ' ' PHE . . . . . 0.505 ' O ' HG23 ' C' ' 329' ' ' THR . 96.3 m-85 -106.03 -164.53 1.02 Allowed 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.297 -0.877 . . . . 0.33 109.303 179.654 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' C' C ' 329' ' ' THR . . . . . 0.505 HG23 ' O ' ' C' ' 328' ' ' PHE . 4.2 p -155.75 167.01 31.77 Favored 'General case' 0 N--CA 1.489 1.491 0 O-C-N 121.214 -0.929 . . . . 0.23 109.751 -179.982 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' C' C ' 330' ' ' LEU . . . . . . . . . . . . . 40.3 tp -150.94 125.57 9.62 Favored 'General case' 0 N--CA 1.488 1.471 0 O-C-N 121.321 -0.862 . . . . 0.28 109.174 179.802 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' C' C ' 331' ' ' GLN . . . . . . . . . . . . . 3.5 tp60 -87.45 113.06 22.81 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.164 -0.96 . . . . 1.48 109.732 -179.857 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' C' C ' 332' ' ' ILE . . . . . . . . . . . . . 31.7 mt -103.77 109.5 27.32 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.643 0 O-C-N 121.25 -0.906 . . . . 0.24 109.537 179.871 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' C' C ' 333' ' ' ARG . . . . . 0.475 ' HG3' ' NH1' ' C' ' 333' ' ' ARG . 16.0 mtm-85 -73.86 149.7 41.39 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.227 -0.921 . . . . 2.74 109.428 179.786 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' C' C ' 334' ' ' GLY . . . . . . . . . . . . . . . 76.72 132.16 0.47 Allowed Glycine 0 N--CA 1.49 2.289 0 N-CA-C 109.6 -1.4 . . . . 0.35 109.6 179.903 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' C' C ' 335' ' ' ARG . . . . . 0.425 ' O ' ' HB3' ' C' ' 338' ' ' PHE . 2.6 tmt_? -76.45 -30.74 57.47 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.309 -1.112 . . . . 2.53 109.647 179.943 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' C' C ' 336' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -55.81 -57.11 13.39 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.322 -0.861 . . . . 2.62 109.959 -179.603 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' C' C ' 337' ' ' ARG . . . . . 0.548 ' HG3' ' NH1' ' C' ' 337' ' ' ARG . 1.4 mtm-85 -60.82 -30.56 70.16 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.098 -1.002 . . . . 2.81 109.718 -179.839 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' C' C ' 338' ' ' PHE . . . . . 0.425 ' HB3' ' O ' ' C' ' 335' ' ' ARG . 75.9 t80 -54.0 -59.84 4.11 Favored 'General case' 0 N--CA 1.489 1.49 0 O-C-N 121.306 -0.871 . . . . 0.4 110.265 -179.257 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' C' C ' 339' ' ' GLU . . . . . . . . . . . . . 1.1 mt-10 -50.0 -37.75 34.07 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.024 -1.048 . . . . 2.05 110.58 -179.283 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' C' C ' 340' ' ' MET . . . . . . . . . . . . . 25.9 ttp -63.62 -54.8 30.16 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.034 -1.041 . . . . 0.32 110.426 -179.097 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' C' C ' 341' ' ' PHE . . . . . . . . . . . . . 59.5 m-85 -61.8 -58.49 7.77 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.117 -0.989 . . . . 0.18 110.006 -179.298 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' C' C ' 342' ' ' ARG . . . . . 0.455 ' CG ' ' NH1' ' C' ' 342' ' ' ARG . 0.0 OUTLIER -48.21 -32.5 7.2 Favored 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.186 -0.946 . . . . 2.91 109.813 -179.723 . . . . . . . . 3 3 . 1 . 032 nuclear nobuild core ' C' C ' 343' ' ' GLU . . . . . . . . . . . . . 10.0 tp10 -58.72 -55.52 33.97 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.149 -0.97 . . . . 2.14 109.458 -179.895 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' C' C ' 344' ' ' LEU . . . . . 1.118 HD22 HD22 ' D' ' 344' ' ' LEU . 43.3 mt -62.16 -28.7 69.84 Favored 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.241 -0.912 . . . . 0.22 109.361 179.833 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' C' C ' 345' ' ' ASN . . . . . . . . . . . . . 15.8 t-20 -56.33 -56.56 19.5 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.247 -0.908 . . . . 1.08 109.53 -179.996 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' C' C ' 346' ' ' GLU . . . . . . . . . . . . . 61.6 tt0 -61.17 -30.66 70.53 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.227 -0.92 . . . . 2.21 109.592 -179.831 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' C' C ' 347' ' ' ALA . . . . . 0.84 ' HB1' ' HB1' ' D' ' 347' ' ' ALA . . . -59.82 -54.73 42.79 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.284 -0.885 . . . . 0.18 109.94 -179.726 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' C' C ' 348' ' ' LEU . . . . . 0.565 HD22 ' N ' ' C' ' 348' ' ' LEU . 3.3 mm? -62.31 -43.58 98.5 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.257 -0.902 . . . . 0.32 109.768 -179.664 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' C' C ' 349' ' ' GLU . . . . . . . . . . . . . 67.6 mm-40 -59.26 -32.71 70.26 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.192 -0.943 . . . . 2.19 110.386 -179.242 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' C' C ' 350' ' ' LEU . . . . . 0.696 HD13 HD22 ' D' ' 350' ' ' LEU . 6.1 tt -62.67 -49.57 74.62 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 120.953 -1.092 . . . . 0.46 109.562 -179.702 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' C' C ' 351' ' ' LYS . . . . . . . . . . . . . 73.2 tttt -57.83 -44.03 86.17 Favored 'General case' 0 C--N 1.303 -1.437 0 O-C-N 121.176 -0.953 . . . . 1.35 109.393 -179.777 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' C' C ' 352' ' ' ASP . . . . . . . . . . . . . 42.4 m-20 -58.36 -39.79 80.5 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.333 -0.855 . . . . 1.19 110.015 179.918 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' C' C ' 353' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 1.598 0 O-C-N 121.177 -0.952 . . . . 0.57 110.27 -179.246 . . . . . . . . 0 0 . 1 . 032 nuclear nobuild core ' D' D ' 326' ' ' GLU . . . . . 0.439 ' HB2' ' CE1' ' D' ' 328' ' ' PHE . 45.0 mt-10 . . . . . 0 N--CA 1.49 1.526 0 N-CA-C 109.356 -0.609 . . . . 2.13 109.356 . . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' D' D ' 327' ' ' TYR . . . . . . . . . . . . . 44.7 m-85 -149.24 109.1 4.05 Favored 'General case' 0 N--CA 1.488 1.43 0 O-C-N 121.358 -0.839 . . . . 0.47 109.276 179.925 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' D' D ' 328' ' ' PHE . . . . . 0.439 ' CE1' ' HB2' ' D' ' 326' ' ' GLU . 40.4 m-85 -113.58 -169.36 1.49 Allowed 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.236 -0.915 . . . . 0.3 109.533 -179.775 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' D' D ' 329' ' ' THR . . . . . 0.425 ' HA ' ' O ' ' B' ' 330' ' ' LEU . 6.7 p -153.38 168.52 25.81 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.314 -0.866 . . . . 0.22 109.181 -179.979 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' D' D ' 330' ' ' LEU . . . . . 0.44 HD21 HD22 ' B' ' 345' ' ' ASN . 19.9 tp -150.02 129.13 12.71 Favored 'General case' 0 N--CA 1.489 1.491 0 O-C-N 121.14 -0.975 . . . . 0.28 109.686 -179.868 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' D' D ' 331' ' ' GLN . . . . . . . . . . . . . 1.2 tp60 -87.96 113.21 23.39 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.299 -0.875 . . . . 0.93 109.382 179.747 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' D' D ' 332' ' ' ILE . . . . . 0.927 HG21 ' HA ' ' D' ' 338' ' ' PHE . 74.7 mt -103.41 104.96 17.46 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.538 0 O-C-N 121.235 -0.915 . . . . 0.25 109.51 -179.985 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' D' D ' 333' ' ' ARG . . . . . 0.457 ' HG2' ' NH1' ' D' ' 333' ' ' ARG . 0.0 OUTLIER -71.47 150.78 44.55 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.246 -0.909 . . . . 2.93 109.246 179.84 . . . . . . . . 3 3 . 1 . 032 nuclear nobuild core ' D' D ' 334' ' ' GLY . . . . . . . . . . . . . . . 76.18 126.81 0.24 Allowed Glycine 0 N--CA 1.491 2.304 0 N-CA-C 109.475 -1.45 . . . . 0.41 109.475 -179.996 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' D' D ' 335' ' ' ARG . . . . . 0.401 ' HA ' ' CE1' ' B' ' 328' ' ' PHE . 0.4 OUTLIER -74.05 -32.78 63.46 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.31 -1.112 . . . . 3.03 109.63 -179.859 . . . . . . . . 3 3 . 1 . 032 nuclear nobuild core ' D' D ' 336' ' ' GLU . . . . . . . . . . . . . 3.2 mt-10 -58.06 -61.53 2.48 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.221 -0.925 . . . . 2.26 109.795 -179.762 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' D' D ' 337' ' ' ARG . . . . . . . . . . . . . 22.3 mmm180 -59.84 -33.61 71.99 Favored 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.319 -0.863 . . . . 2.92 109.651 -179.678 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' D' D ' 338' ' ' PHE . . . . . 0.927 ' HA ' HG21 ' D' ' 332' ' ' ILE . 58.6 t80 -55.99 -55.03 37.69 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.217 -0.927 . . . . 0.37 109.916 -179.697 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' D' D ' 339' ' ' GLU . . . . . . . . . . . . . 44.7 mt-10 -50.8 -34.12 26.25 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.262 -0.899 . . . . 1.99 110.41 -179.411 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' D' D ' 340' ' ' MET . . . . . . . . . . . . . 23.9 ttp -64.14 -51.41 64.03 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.045 -1.035 . . . . 0.31 110.132 -179.413 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' D' D ' 341' ' ' PHE . . . . . . . . . . . . . 44.7 m-85 -61.93 -45.5 93.42 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.179 -0.951 . . . . 0.18 109.972 -179.462 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' D' D ' 342' ' ' ARG . . . . . 0.423 ' O ' ' HB3' ' D' ' 345' ' ' ASN . 41.5 ttt180 -50.64 -40.31 52.79 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.141 -0.974 . . . . 2.41 109.876 -179.751 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' D' D ' 343' ' ' GLU . . . . . . . . . . . . . 36.0 tp10 -58.36 -51.67 68.82 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.183 -0.948 . . . . 2.35 109.77 -179.673 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' D' D ' 344' ' ' LEU . . . . . 1.118 HD22 HD22 ' C' ' 344' ' ' LEU . 84.7 mt -60.91 -32.0 71.5 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.221 -0.925 . . . . 0.19 109.425 -179.952 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' D' D ' 345' ' ' ASN . . . . . 0.477 HD22 HD21 ' B' ' 330' ' ' LEU . 9.1 t-20 -58.69 -55.2 38.09 Favored 'General case' 0 N--CA 1.489 1.487 0 O-C-N 121.351 -0.843 . . . . 1.09 109.303 179.867 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' D' D ' 346' ' ' GLU . . . . . . . . . . . . . 31.5 tp10 -61.4 -32.2 72.13 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.35 -0.844 . . . . 1.69 109.839 -179.85 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' D' D ' 347' ' ' ALA . . . . . 0.84 ' HB1' ' HB1' ' C' ' 347' ' ' ALA . . . -59.61 -56.94 15.63 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.128 -0.983 . . . . 0.18 109.78 -179.669 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' D' D ' 348' ' ' LEU . . . . . 0.555 HD22 ' N ' ' D' ' 348' ' ' LEU . 3.5 mm? -61.96 -38.79 89.84 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.195 -0.941 . . . . 0.31 109.625 -179.662 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' D' D ' 349' ' ' GLU . . . . . . . . . . . . . 1.8 mt-10 -58.83 -38.17 78.07 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.293 -0.879 . . . . 1.95 110.183 -179.514 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' D' D ' 350' ' ' LEU . . . . . 0.696 HD22 HD13 ' C' ' 350' ' ' LEU . 7.8 tt -63.96 -43.61 95.3 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.091 -1.006 . . . . 0.43 109.852 -179.505 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' D' D ' 351' ' ' LYS . . . . . . . . . . . . . 18.7 tttm -58.32 -42.03 85.85 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.305 -0.872 . . . . 1.4 109.561 -179.758 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' D' D ' 352' ' ' ASP . . . . . . . . . . . . . 49.0 m-20 -56.04 -41.57 75.22 Favored 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.203 -0.936 . . . . 1.17 109.579 179.972 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' D' D ' 353' ' ' ALA . . . . . . . . . . . . . . . -67.84 -25.72 65.69 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.204 -0.935 . . . . 0.59 109.513 -179.97 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' D' D ' 354' ' ' GLN . . . . . 0.536 ' NE2' HD11 ' C' ' 350' ' ' LEU . 0.1 OUTLIER . . . . . 0 N--CA 1.492 1.668 0 O-C-N 121.26 -0.9 . . . . 1.44 109.474 -179.971 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild core ' A' A ' 326' ' ' GLU . . . . . . . . . . . . . 33.9 mm-40 . . . . . 0 N--CA 1.489 1.489 0 CA-C-O 121.381 0.61 . . . . 2.13 109.603 . . . . . . . . . 0 0 . 1 . 033 nuclear nobuild core ' A' A ' 327' ' ' TYR . . . . . . . . . . . . . 39.4 m-85 -149.83 105.81 3.45 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.256 -0.903 . . . . 0.48 109.638 179.928 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 328' ' ' PHE . . . . . 0.566 ' CZ ' ' HB2' ' C' ' 335' ' ' ARG . 24.7 m-85 -113.29 -166.51 1.09 Allowed 'General case' 0 N--CA 1.488 1.443 0 O-C-N 121.357 -0.84 . . . . 0.31 109.192 179.799 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild core ' A' A ' 329' ' ' THR . . . . . . . . . . . . . 71.2 p -153.94 173.99 15.23 Favored 'General case' 0 N--CA 1.495 1.814 0 O-C-N 121.395 -0.815 . . . . 0.22 109.18 179.559 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 330' ' ' LEU . . . . . . . . . . . . . 17.2 tp -150.41 131.0 13.93 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.314 -0.866 . . . . 0.28 109.394 179.845 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 331' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -87.48 112.26 22.02 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.362 -0.837 . . . . 0.91 109.124 179.793 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild core ' A' A ' 332' ' ' ILE . . . . . 0.91 HG21 ' HA ' ' A' ' 338' ' ' PHE . 79.5 mt -103.47 105.79 18.98 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.477 0 O-C-N 121.075 -1.015 . . . . 0.26 109.736 -179.858 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild core ' A' A ' 333' ' ' ARG . . . . . 0.638 ' HG2' ' CE2' ' C' ' 327' ' ' TYR . 25.9 mtt180 -72.38 148.26 45.42 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.44 -0.787 . . . . 2.92 109.871 179.914 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild core ' A' A ' 334' ' ' GLY . . . . . . . . . . . . . . . 82.69 134.81 2.19 Favored Glycine 0 N--CA 1.491 2.322 0 N-CA-C 109.856 -1.297 . . . . 0.4 109.856 179.784 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 335' ' ' ARG . . . . . 0.455 ' HA ' ' CE1' ' C' ' 328' ' ' PHE . 0.0 OUTLIER -80.37 -39.75 27.89 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.338 -1.095 . . . . 3.01 109.653 179.997 . . . . . . . . 3 3 . 1 . 033 nuclear nobuild core ' A' A ' 336' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -58.82 -61.48 2.59 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.14 -0.975 . . . . 2.29 109.891 -179.657 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild core ' A' A ' 337' ' ' ARG . . . . . 0.46 ' CG ' HH11 ' A' ' 337' ' ' ARG . 0.0 OUTLIER -58.09 -30.92 66.62 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.19 -0.943 . . . . 2.93 109.529 -179.76 . . . . . . . . 3 3 . 1 . 033 nuclear nobuild core ' A' A ' 338' ' ' PHE . . . . . 0.91 ' HA ' HG21 ' A' ' 332' ' ' ILE . 50.4 t80 -55.78 -56.37 21.33 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.306 -0.871 . . . . 0.38 109.527 -179.872 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild core ' A' A ' 339' ' ' GLU . . . . . . . . . . . . . 48.9 mt-10 -50.88 -33.27 23.32 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.231 -0.918 . . . . 1.97 109.875 -179.965 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 340' ' ' MET . . . . . . . . . . . . . 18.7 ttp -62.22 -53.3 57.14 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.29 -0.881 . . . . 0.31 110.008 -179.416 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 341' ' ' PHE . . . . . 0.425 ' HB2' HD13 ' A' ' 332' ' ' ILE . 36.9 m-85 -61.2 -49.32 77.62 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.206 -0.934 . . . . 0.18 110.202 -179.616 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild core ' A' A ' 342' ' ' ARG . . . . . . . . . . . . . 4.2 ttt180 -47.43 -41.06 19.45 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.368 -0.832 . . . . 2.42 109.821 -179.972 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 343' ' ' GLU . . . . . . . . . . . . . 65.2 tt0 -59.26 -47.94 83.49 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.156 -0.965 . . . . 2.35 110.285 -179.586 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 344' ' ' LEU . . . . . . . . . . . . . 47.7 mt -63.16 -32.36 73.73 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.08 -1.013 . . . . 0.18 110.063 -179.431 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 345' ' ' ASN . . . . . 0.442 ' HB2' HD21 ' C' ' 330' ' ' LEU . 10.8 t-20 -57.96 -55.38 35.65 Favored 'General case' 0 N--CA 1.488 1.47 0 O-C-N 121.19 -0.944 . . . . 1.09 109.637 -179.756 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild core ' A' A ' 346' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -61.55 -29.74 70.2 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.211 -0.93 . . . . 1.65 109.977 -179.844 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild core ' A' A ' 347' ' ' ALA . . . . . 0.553 ' HB1' ' HB1' ' B' ' 347' ' ' ALA . . . -59.34 -58.93 6.47 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.278 -0.889 . . . . 0.18 110.237 -179.534 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild core ' A' A ' 348' ' ' LEU . . . . . 0.607 HD22 ' N ' ' A' ' 348' ' ' LEU . 4.1 mm? -61.2 -42.7 99.05 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.162 -0.961 . . . . 0.3 110.005 -179.365 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild core ' A' A ' 349' ' ' GLU . . . . . . . . . . . . . 16.2 mm-40 -57.87 -34.05 69.34 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.207 -0.933 . . . . 1.94 109.997 -179.493 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 350' ' ' LEU . . . . . 0.544 HD22 HD22 ' B' ' 350' ' ' LEU . 6.2 tt -64.43 -44.3 91.64 Favored 'General case' 0 N--CA 1.495 1.783 0 O-C-N 121.194 -0.941 . . . . 0.46 109.651 -179.592 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild core ' A' A ' 351' ' ' LYS . . . . . . . . . . . . . 43.8 tttt -60.46 -46.82 88.69 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.246 -0.909 . . . . 1.4 109.859 -179.694 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 352' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -54.86 -44.89 74.43 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.416 -0.803 . . . . 1.16 110.377 -179.288 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild core ' A' A ' 353' ' ' ALA . . . . . . . . . . . . . . . -66.68 -26.98 67.29 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 120.95 -1.093 . . . . 0.63 109.608 -179.804 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 354' ' ' GLN . . . . . . . . . . . . . 8.8 tt0 . . . . . 0 N--CA 1.488 1.475 0 O-C-N 121.001 -1.062 . . . . 1.47 109.825 -179.749 . . . . . . . . 0 0 . 1 . 033 nuclear nobuild core ' B' B ' 326' ' ' GLU . . . . . . . . . . . . . 35.1 mm-40 . . . . . 0 N--CA 1.489 1.504 0 CA-C-O 121.466 0.651 . . . . 2.13 109.791 . . . . . . . . . 0 0 . 1 . 033 nuclear nobuild core ' B' B ' 327' ' ' TYR . . . . . 0.627 ' CE1' ' HG2' ' D' ' 333' ' ' ARG . 39.2 m-85 -150.02 104.38 3.28 Favored 'General case' 0 N--CA 1.489 1.487 0 O-C-N 121.325 -0.859 . . . . 0.48 109.678 -179.957 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild core ' B' B ' 328' ' ' PHE . . . . . . . . . . . . . 18.4 m-85 -112.43 -163.86 0.88 Allowed 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.287 -0.883 . . . . 0.32 109.308 179.657 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' B' B ' 329' ' ' THR . . . . . 0.466 ' HA ' ' O ' ' D' ' 330' ' ' LEU . 67.1 p -154.76 176.3 12.63 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.28 -0.887 . . . . 0.23 109.36 179.452 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild core ' B' B ' 330' ' ' LEU . . . . . 0.501 HD21 ' HB2' ' D' ' 345' ' ' ASN . 18.3 tp -151.9 130.32 12.13 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.183 -0.948 . . . . 0.28 109.138 179.653 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild core ' B' B ' 331' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -87.38 111.95 21.62 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.221 -0.924 . . . . 0.91 109.144 179.72 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild core ' B' B ' 332' ' ' ILE . . . . . 0.85 HG21 ' HA ' ' B' ' 338' ' ' PHE . 72.0 mt -103.52 107.32 21.93 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.531 0 O-C-N 120.886 -1.134 . . . . 0.24 109.659 -179.815 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild core ' B' B ' 333' ' ' ARG . . . . . 0.63 ' HG2' ' CE1' ' D' ' 327' ' ' TYR . 27.2 mtt180 -73.9 147.96 42.69 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.356 -0.84 . . . . 2.93 109.824 -179.857 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild core ' B' B ' 334' ' ' GLY . . . . . . . . . . . . . . . 82.47 135.97 2.35 Favored Glycine 0 N--CA 1.488 2.118 0 N-CA-C 109.643 -1.383 . . . . 0.4 109.643 179.799 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' B' B ' 335' ' ' ARG . . . . . 0.414 HH11 ' HG3' ' B' ' 335' ' ' ARG . 0.0 OUTLIER -80.68 -40.35 25.6 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.303 -1.116 . . . . 3.01 109.96 -179.964 . . . . . . . . 3 3 . 1 . 033 nuclear nobuild core ' B' B ' 336' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -58.61 -59.98 4.53 Favored 'General case' 0 N--CA 1.495 1.811 0 O-C-N 121.102 -0.999 . . . . 2.28 109.989 -179.638 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild core ' B' B ' 337' ' ' ARG . . . . . 0.461 ' CG ' ' NH1' ' B' ' 337' ' ' ARG . 0.0 OUTLIER -59.23 -29.97 67.9 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.113 -0.992 . . . . 2.93 109.61 -179.674 . . . . . . . . 3 3 . 1 . 033 nuclear nobuild core ' B' B ' 338' ' ' PHE . . . . . 0.85 ' HA ' HG21 ' B' ' 332' ' ' ILE . 51.8 t80 -56.83 -57.06 14.14 Favored 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.509 -0.745 . . . . 0.37 109.402 179.837 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild core ' B' B ' 339' ' ' GLU . . . . . . . . . . . . . 48.3 mt-10 -50.91 -31.72 18.46 Favored 'General case' 0 N--CA 1.493 1.722 0 O-C-N 121.293 -0.879 . . . . 1.98 109.875 -179.774 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' B' B ' 340' ' ' MET . . . . . . . . . . . . . 18.8 ttp -63.88 -53.55 48.74 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.286 -0.884 . . . . 0.32 110.04 -179.57 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' B' B ' 341' ' ' PHE . . . . . . . . . . . . . 37.5 m-85 -61.33 -49.0 78.76 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.232 -0.917 . . . . 0.18 109.866 -179.481 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' B' B ' 342' ' ' ARG . . . . . . . . . . . . . 4.6 ttt180 -47.45 -40.91 19.34 Favored 'General case' 0 N--CA 1.493 1.717 0 O-C-N 121.171 -0.955 . . . . 2.42 109.928 -179.756 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' B' B ' 343' ' ' GLU . . . . . . . . . . . . . 62.5 tt0 -59.42 -48.04 83.18 Favored 'General case' 0 N--CA 1.495 1.811 0 O-C-N 121.365 -0.835 . . . . 2.35 110.302 -179.316 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' B' B ' 344' ' ' LEU . . . . . . . . . . . . . 37.6 mt -62.44 -33.26 74.47 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.192 -0.942 . . . . 0.18 109.949 -179.485 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' B' B ' 345' ' ' ASN . . . . . 0.497 ' HB2' HD21 ' D' ' 330' ' ' LEU . 13.2 t-20 -56.92 -56.46 21.31 Favored 'General case' 0 C--N 1.299 -1.596 0 O-C-N 121.282 -0.886 . . . . 1.09 109.862 -179.773 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild core ' B' B ' 346' ' ' GLU . . . . . . . . . . . . . 1.3 tt0 -61.0 -28.59 69.14 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.224 -0.923 . . . . 1.66 110.073 -179.627 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' B' B ' 347' ' ' ALA . . . . . 0.553 ' HB1' ' HB1' ' A' ' 347' ' ' ALA . . . -60.36 -57.69 11.68 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.118 -0.989 . . . . 0.17 110.111 -179.421 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild core ' B' B ' 348' ' ' LEU . . . . . 0.592 HD22 ' N ' ' B' ' 348' ' ' LEU . 4.1 mm? -62.05 -42.88 99.65 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.149 -0.97 . . . . 0.29 110.159 -179.476 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild core ' B' B ' 349' ' ' GLU . . . . . . . . . . . . . 13.7 mm-40 -57.91 -35.23 70.75 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.045 -1.034 . . . . 1.95 110.066 -179.488 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' B' B ' 350' ' ' LEU . . . . . 0.544 HD22 HD22 ' A' ' 350' ' ' LEU . 6.5 tt -62.74 -45.01 94.71 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.002 -1.061 . . . . 0.45 109.53 -179.652 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild core ' B' B ' 351' ' ' LYS . . . . . . . . . . . . . 37.8 tttt -59.87 -47.17 86.82 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.37 -0.831 . . . . 1.38 109.764 -179.769 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' B' B ' 352' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -54.14 -44.86 71.74 Favored 'General case' 0 N--CA 1.488 1.449 0 O-C-N 121.341 -0.849 . . . . 1.16 110.252 -179.441 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' B' B ' 353' ' ' ALA . . . . . . . . . . . . . . . -66.61 -29.43 69.47 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.026 -1.046 . . . . 0.61 109.46 -179.848 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' B' B ' 354' ' ' GLN . . . . . . . . . . . . . 7.7 tt0 . . . . . 0 N--CA 1.492 1.656 0 O-C-N 121.107 -0.996 . . . . 1.45 109.962 -179.622 . . . . . . . . 0 0 . 1 . 033 nuclear nobuild core ' C' C ' 326' ' ' GLU . . . . . . . . . . . . . 2.7 mp0 . . . . . 0 N--CA 1.491 1.607 0 N-CA-C 109.608 -0.516 . . . . 2.17 109.608 . . . . . . . . . 0 0 . 1 . 033 nuclear nobuild core ' C' C ' 327' ' ' TYR . . . . . 0.638 ' CE2' ' HG2' ' A' ' 333' ' ' ARG . 46.3 m-85 -147.21 104.74 3.69 Favored 'General case' 0 N--CA 1.487 1.413 0 O-C-N 121.263 -0.898 . . . . 0.48 109.204 -179.959 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild core ' C' C ' 328' ' ' PHE . . . . . 0.455 ' CE1' ' HA ' ' A' ' 335' ' ' ARG . 67.7 m-85 -106.87 -168.8 1.46 Allowed 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.287 -0.883 . . . . 0.33 109.147 -179.915 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild core ' C' C ' 329' ' ' THR . . . . . . . . . . . . . 18.0 p -150.97 167.03 28.85 Favored 'General case' 0 C--N 1.302 -1.498 0 O-C-N 121.472 -0.768 . . . . 0.23 108.978 -179.847 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' C' C ' 330' ' ' LEU . . . . . 0.442 HD21 ' HB2' ' A' ' 345' ' ' ASN . 47.0 tp -150.92 127.7 10.93 Favored 'General case' 0 C--N 1.302 -1.488 0 O-C-N 121.2 -0.937 . . . . 0.28 109.688 -179.491 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild core ' C' C ' 331' ' ' GLN . . . . . . . . . . . . . 5.4 tp60 -86.71 113.41 22.54 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.375 -0.828 . . . . 1.48 109.488 179.903 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' C' C ' 332' ' ' ILE . . . . . 0.809 HG21 ' HA ' ' C' ' 338' ' ' PHE . 30.3 mt -105.2 109.49 27.88 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.51 0 O-C-N 121.547 -0.721 . . . . 0.24 109.883 -179.853 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild core ' C' C ' 333' ' ' ARG . . . . . . . . . . . . . 79.3 mtt180 -74.23 147.65 42.27 Favored 'General case' 0 C--N 1.302 -1.472 0 O-C-N 121.306 -0.871 . . . . 2.74 109.635 179.781 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' C' C ' 334' ' ' GLY . . . . . . . . . . . . . . . 80.23 127.0 0.67 Allowed Glycine 0 N--CA 1.486 1.987 0 N-CA-C 109.361 -1.495 . . . . 0.35 109.361 -179.857 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' C' C ' 335' ' ' ARG . . . . . 0.566 ' HB2' ' CZ ' ' A' ' 328' ' ' PHE . 0.0 OUTLIER -78.35 -33.12 49.29 Favored 'General case' 0 N--CA 1.487 1.412 0 O-C-N 121.201 -1.176 . . . . 2.53 109.463 179.972 . . . . . . . . 3 3 . 1 . 033 nuclear nobuild core ' C' C ' 336' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -57.52 -62.56 1.7 Allowed 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.127 -0.983 . . . . 2.62 108.986 179.567 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild core ' C' C ' 337' ' ' ARG . . . . . 0.541 ' HG2' ' NH1' ' C' ' 337' ' ' ARG . 0.2 OUTLIER -59.52 -31.61 69.55 Favored 'General case' 0 N--CA 1.489 1.483 0 O-C-N 121.745 -0.597 . . . . 2.81 109.656 -179.886 . . . . . . . . 3 3 . 1 . 033 nuclear nobuild core ' C' C ' 338' ' ' PHE . . . . . 0.809 ' HA ' HG21 ' C' ' 332' ' ' ILE . 46.3 t80 -54.52 -59.42 4.72 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.171 -0.956 . . . . 0.4 109.755 -179.466 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild core ' C' C ' 339' ' ' GLU . . . . . . . . . . . . . 9.9 mm-40 -48.32 -32.65 7.71 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.434 -0.792 . . . . 2.05 110.247 -179.333 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' C' C ' 340' ' ' MET . . . . . . . . . . . . . 34.6 ttp -63.91 -50.88 66.96 Favored 'General case' 0 N--CA 1.494 1.742 0 O-C-N 121.251 -0.905 . . . . 0.32 109.818 -179.809 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' C' C ' 341' ' ' PHE . . . . . . . . . . . . . 49.7 m-85 -62.83 -52.91 61.3 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 120.959 -1.088 . . . . 0.18 109.762 -179.804 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' C' C ' 342' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -47.81 -39.96 19.76 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.442 -0.786 . . . . 2.91 110.005 -179.428 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild core ' C' C ' 343' ' ' GLU . . . . . . . . . . . . . 4.5 tp10 -60.8 -44.88 96.27 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 120.974 -1.079 . . . . 2.14 109.461 -179.998 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' C' C ' 344' ' ' LEU . . . . . 0.411 ' O ' ' HB3' ' C' ' 347' ' ' ALA . 27.0 mt -60.35 -41.02 92.8 Favored 'General case' 0 N--CA 1.487 1.395 0 O-C-N 121.294 -0.879 . . . . 0.22 109.593 -179.939 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild core ' C' C ' 345' ' ' ASN . . . . . . . . . . . . . 48.9 t-20 -54.61 -53.7 51.24 Favored 'General case' 0 N--CA 1.489 1.488 0 O-C-N 121.313 -0.867 . . . . 1.08 109.818 -179.664 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' C' C ' 346' ' ' GLU . . . . . . . . . . . . . 2.9 tp10 -58.58 -29.84 66.72 Favored 'General case' 0 C--N 1.303 -1.449 0 O-C-N 121.108 -0.995 . . . . 2.21 109.362 -179.872 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' C' C ' 347' ' ' ALA . . . . . 0.655 ' HB1' ' HB1' ' D' ' 347' ' ' ALA . . . -63.12 -51.82 65.0 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.16 -0.962 . . . . 0.18 109.766 179.943 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild core ' C' C ' 348' ' ' LEU . . . . . 0.619 HD22 ' N ' ' C' ' 348' ' ' LEU . 3.6 mm? -62.88 -43.6 98.35 Favored 'General case' 0 N--CA 1.494 1.743 0 O-C-N 121.04 -1.038 . . . . 0.32 109.773 -179.619 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild core ' C' C ' 349' ' ' GLU . . . . . . . . . . . . . 3.1 mm-40 -59.25 -36.82 76.19 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.284 -0.885 . . . . 2.19 110.085 -179.376 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' C' C ' 350' ' ' LEU . . . . . 0.614 HD13 HD22 ' D' ' 350' ' ' LEU . 5.5 tt -62.75 -48.91 77.13 Favored 'General case' 0 C--N 1.302 -1.466 0 O-C-N 121.12 -0.987 . . . . 0.46 109.29 -179.775 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild core ' C' C ' 351' ' ' LYS . . . . . . . . . . . . . 27.4 tttm -58.23 -39.66 79.67 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.198 -0.939 . . . . 1.35 109.06 179.662 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' C' C ' 352' ' ' ASP . . . . . . . . . . . . . 96.2 m-20 -54.44 -31.7 55.96 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.334 -0.853 . . . . 1.19 109.579 179.888 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' C' C ' 353' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 1.615 0 O-C-N 121.42 -0.8 . . . . 0.57 109.631 -179.626 . . . . . . . . 0 0 . 1 . 033 nuclear nobuild core ' D' D ' 326' ' ' GLU . . . . . . . . . . . . . 41.3 mm-40 . . . . . 0 N--CA 1.489 1.511 0 CA-C-O 121.407 0.622 . . . . 2.13 109.65 . . . . . . . . . 0 0 . 1 . 033 nuclear nobuild core ' D' D ' 327' ' ' TYR . . . . . 0.63 ' CE1' ' HG2' ' B' ' 333' ' ' ARG . 41.0 m-85 -148.78 105.49 3.56 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.281 -0.887 . . . . 0.47 109.7 179.989 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild core ' D' D ' 328' ' ' PHE . . . . . 0.404 ' C ' HG23 ' D' ' 329' ' ' THR . 22.1 m-85 -112.95 -165.44 0.99 Allowed 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.371 -0.83 . . . . 0.3 109.176 179.582 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild core ' D' D ' 329' ' ' THR . . . . . 0.47 ' HA ' ' O ' ' B' ' 330' ' ' LEU . 78.3 p -154.02 173.87 15.42 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.194 -0.941 . . . . 0.22 109.257 179.783 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild core ' D' D ' 330' ' ' LEU . . . . . 0.497 HD21 ' HB2' ' B' ' 345' ' ' ASN . 21.5 tp -150.58 129.81 12.78 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.265 -0.897 . . . . 0.28 109.212 179.639 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild core ' D' D ' 331' ' ' GLN . . . . . . . . . . . . . 1.1 tt0 -86.98 112.83 22.21 Favored 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.165 -0.959 . . . . 0.93 109.331 179.756 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' D' D ' 332' ' ' ILE . . . . . 0.847 HG21 ' HA ' ' D' ' 338' ' ' PHE . 73.5 mt -103.94 107.56 22.58 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.505 0 O-C-N 121.108 -0.995 . . . . 0.25 109.671 -179.784 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild core ' D' D ' 333' ' ' ARG . . . . . 0.627 ' HG2' ' CE1' ' B' ' 327' ' ' TYR . 32.2 mtt180 -74.1 148.27 41.99 Favored 'General case' 0 C--N 1.304 -1.37 0 O-C-N 121.413 -0.804 . . . . 2.93 109.672 -179.886 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild core ' D' D ' 334' ' ' GLY . . . . . . . . . . . . . . . 82.84 134.48 2.17 Favored Glycine 0 N--CA 1.486 1.978 0 N-CA-C 109.598 -1.401 . . . . 0.41 109.598 179.988 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' D' D ' 335' ' ' ARG . . . . . 0.403 ' HG3' HH11 ' D' ' 335' ' ' ARG . 0.0 OUTLIER -79.88 -40.8 27.54 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.4 -1.059 . . . . 3.03 109.69 -179.795 . . . . . . . . 3 3 . 1 . 033 nuclear nobuild core ' D' D ' 336' ' ' GLU . . . . . . . . . . . . . 1.7 mt-10 -58.66 -59.12 5.9 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.221 -0.924 . . . . 2.26 110.044 -179.717 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' D' D ' 337' ' ' ARG . . . . . 0.447 HH11 ' CG ' ' D' ' 337' ' ' ARG . 0.0 OUTLIER -59.53 -31.91 69.83 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.142 -0.974 . . . . 2.92 109.756 -179.657 . . . . . . . . 3 3 . 1 . 033 nuclear nobuild core ' D' D ' 338' ' ' PHE . . . . . 0.847 ' HA ' HG21 ' D' ' 332' ' ' ILE . 46.7 t80 -55.66 -56.7 17.27 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.259 -0.901 . . . . 0.37 109.783 -179.957 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild core ' D' D ' 339' ' ' GLU . . . . . . . . . . . . . 44.1 mt-10 -50.72 -32.75 20.45 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.059 -1.026 . . . . 1.99 109.735 -179.87 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' D' D ' 340' ' ' MET . . . . . . . . . . . . . 17.3 ttp -62.49 -52.66 62.61 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.187 -0.945 . . . . 0.31 109.99 -179.535 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' D' D ' 341' ' ' PHE . . . . . 0.406 ' HB2' HD13 ' D' ' 332' ' ' ILE . 40.2 m-85 -62.32 -51.14 68.85 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.184 -0.948 . . . . 0.18 109.773 -179.814 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild core ' D' D ' 342' ' ' ARG . . . . . . . . . . . . . 4.1 ttt180 -45.17 -39.51 6.22 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.284 -0.885 . . . . 2.41 109.92 -179.76 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' D' D ' 343' ' ' GLU . . . . . . . . . . . . . 60.1 tt0 -60.96 -48.48 81.64 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.136 -0.977 . . . . 2.35 110.213 -179.675 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' D' D ' 344' ' ' LEU . . . . . 0.411 HD22 ' CD2' ' C' ' 344' ' ' LEU . 49.7 mt -62.13 -33.06 73.77 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.052 -1.03 . . . . 0.19 109.878 -179.459 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild core ' D' D ' 345' ' ' ASN . . . . . 0.501 ' HB2' HD21 ' B' ' 330' ' ' LEU . 14.3 t-20 -56.96 -56.51 20.74 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.299 -0.875 . . . . 1.09 109.558 -179.582 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild core ' D' D ' 346' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -60.85 -29.1 69.32 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.192 -0.942 . . . . 1.69 110.133 -179.716 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild core ' D' D ' 347' ' ' ALA . . . . . 0.655 ' HB1' ' HB1' ' C' ' 347' ' ' ALA . . . -59.7 -58.53 8.17 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.152 -0.968 . . . . 0.18 110.254 -179.502 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild core ' D' D ' 348' ' ' LEU . . . . . 0.598 HD22 ' N ' ' D' ' 348' ' ' LEU . 4.1 mm? -62.02 -42.18 98.88 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.157 -0.964 . . . . 0.31 110.069 -179.256 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild core ' D' D ' 349' ' ' GLU . . . . . . . . . . . . . 9.1 mm-40 -58.6 -34.26 70.92 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.033 -1.042 . . . . 1.95 110.132 -179.349 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' D' D ' 350' ' ' LEU . . . . . 0.614 HD22 HD13 ' C' ' 350' ' ' LEU . 6.4 tt -64.0 -45.15 90.24 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.248 -0.907 . . . . 0.43 109.499 -179.633 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild core ' D' D ' 351' ' ' LYS . . . . . . . . . . . . . 48.2 tttt -59.5 -46.08 89.85 Favored 'General case' 0 N--CA 1.488 1.448 0 O-C-N 121.292 -0.88 . . . . 1.4 109.676 -179.825 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' D' D ' 352' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -55.27 -45.01 76.14 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.338 -0.851 . . . . 1.17 110.119 -179.419 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' D' D ' 353' ' ' ALA . . . . . . . . . . . . . . . -66.71 -29.41 69.39 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 120.794 -1.192 . . . . 0.59 109.576 -179.678 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' D' D ' 354' ' ' GLN . . . . . . . . . . . . . 8.0 tt0 . . . . . 0 N--CA 1.489 1.481 0 O-C-N 121.208 -0.933 . . . . 1.44 109.798 -179.769 . . . . . . . . 0 0 . 1 . 034 nuclear nobuild core ' A' A ' 326' ' ' GLU . . . . . . . . . . . . . 4.2 mt-10 . . . . . 0 N--CA 1.487 1.409 0 N-CA-C 109.404 -0.591 . . . . 2.13 109.404 . . . . . . . . . 0 0 . 1 . 034 nuclear nobuild core ' A' A ' 327' ' ' TYR . . . . . 0.55 ' CE1' ' HG3' ' C' ' 333' ' ' ARG . 39.0 m-85 -148.96 109.81 4.29 Favored 'General case' 0 N--CA 1.489 1.478 0 O-C-N 121.35 -0.844 . . . . 0.48 109.463 179.9 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild core ' A' A ' 328' ' ' PHE . . . . . 0.41 ' CE2' ' HA ' ' C' ' 335' ' ' ARG . 88.0 m-85 -113.64 -169.41 1.5 Allowed 'General case' 0 C--N 1.302 -1.464 0 O-C-N 121.353 -0.842 . . . . 0.31 108.934 179.772 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild core ' A' A ' 329' ' ' THR . . . . . . . . . . . . . 23.5 p -153.15 169.77 22.16 Favored 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.013 -1.055 . . . . 0.22 109.517 -179.97 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 330' ' ' LEU . . . . . 0.484 HD21 ' HB2' ' C' ' 345' ' ' ASN . 17.4 tp -150.83 127.2 10.68 Favored 'General case' 0 N--CA 1.488 1.46 0 O-C-N 121.288 -0.882 . . . . 0.28 109.529 -179.809 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild core ' A' A ' 331' ' ' GLN . . . . . 0.449 ' OE1' ' O ' ' C' ' 328' ' ' PHE . 3.7 tp-100 -87.77 119.91 28.57 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.19 -0.944 . . . . 0.91 109.401 179.846 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild core ' A' A ' 332' ' ' ILE . . . . . 0.619 HG21 ' HA ' ' A' ' 338' ' ' PHE . 97.9 mt -103.38 107.99 23.41 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.596 0 O-C-N 121.299 -0.875 . . . . 0.26 109.519 179.898 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild core ' A' A ' 333' ' ' ARG . . . . . 0.488 ' HG2' ' CE2' ' C' ' 327' ' ' TYR . 1.4 mtt-85 -72.18 131.54 42.91 Favored 'General case' 0 N--CA 1.488 1.463 0 O-C-N 121.206 -0.934 . . . . 2.92 109.569 -179.988 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild core ' A' A ' 334' ' ' GLY . . . . . . . . . . . . . . . 87.71 138.88 6.02 Favored Glycine 0 N--CA 1.49 2.298 0 N-CA-C 109.809 -1.316 . . . . 0.4 109.809 179.817 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 335' ' ' ARG . . . . . 0.429 ' O ' ' HB3' ' A' ' 338' ' ' PHE . 37.5 ttt180 -79.78 -29.04 40.27 Favored 'General case' 0 N--CA 1.489 1.488 0 O-C-N 121.316 -1.108 . . . . 3.01 109.676 -179.978 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild core ' A' A ' 336' ' ' GLU . . . . . . . . . . . . . 38.7 mt-10 -56.45 -61.95 2.06 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.211 -0.93 . . . . 2.29 109.843 -179.732 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 337' ' ' ARG . . . . . 0.487 ' CZ ' HD12 ' C' ' 348' ' ' LEU . 0.0 OUTLIER -60.52 -26.67 67.02 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.151 -0.968 . . . . 2.93 109.686 -179.776 . . . . . . . . 3 3 . 1 . 034 nuclear nobuild core ' A' A ' 338' ' ' PHE . . . . . 0.619 ' HA ' HG21 ' A' ' 332' ' ' ILE . 91.5 t80 -56.31 -53.58 55.57 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.163 -0.961 . . . . 0.38 110.01 -179.694 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild core ' A' A ' 339' ' ' GLU . . . . . . . . . . . . . 6.8 mt-10 -54.6 -39.52 67.95 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.019 -1.05 . . . . 1.97 110.533 -179.369 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 340' ' ' MET . . . . . . . . . . . . . 30.9 ttp -64.37 -53.4 49.15 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.044 -1.035 . . . . 0.31 110.877 -178.788 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 341' ' ' PHE . . . . . 0.551 ' CZ ' ' HA ' ' C' ' 345' ' ' ASN . 56.7 m-85 -60.57 -48.71 80.58 Favored 'General case' 0 N--CA 1.494 1.761 0 O-C-N 120.91 -1.119 . . . . 0.18 110.291 -179.018 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild core ' A' A ' 342' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -48.9 -44.4 40.09 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.075 -1.016 . . . . 2.42 110.136 -179.6 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild core ' A' A ' 343' ' ' GLU . . . . . . . . . . . . . 2.1 tp10 -57.81 -41.99 83.33 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.102 -0.999 . . . . 2.35 109.745 -179.585 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 344' ' ' LEU . . . . . . . . . . . . . 45.8 mt -63.63 -47.16 82.48 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.173 -0.955 . . . . 0.18 109.92 -179.828 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 345' ' ' ASN . . . . . 0.642 ' HB2' HD21 ' C' ' 330' ' ' LEU . 39.3 t-20 -54.83 -48.3 73.01 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.16 -0.962 . . . . 1.09 109.737 -179.616 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild core ' A' A ' 346' ' ' GLU . . . . . . . . . . . . . 56.5 tt0 -61.83 -35.88 79.53 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.194 -0.941 . . . . 1.65 109.749 -179.882 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 347' ' ' ALA . . . . . 0.689 ' HB1' ' HB1' ' B' ' 347' ' ' ALA . . . -59.94 -55.83 29.26 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.249 -0.907 . . . . 0.18 110.049 -179.623 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild core ' A' A ' 348' ' ' LEU . . . . . 0.587 HD22 ' N ' ' A' ' 348' ' ' LEU . 3.8 mm? -60.02 -41.72 92.79 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.199 -0.938 . . . . 0.3 109.655 -179.653 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild core ' A' A ' 349' ' ' GLU . . . . . . . . . . . . . 88.3 mt-10 -58.6 -33.48 70.04 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.254 -0.903 . . . . 1.94 109.785 -179.694 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 350' ' ' LEU . . . . . 0.623 ' O ' HD23 ' A' ' 350' ' ' LEU . 5.3 tt -63.16 -49.13 75.54 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.201 -0.937 . . . . 0.46 109.162 179.944 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild core ' A' A ' 351' ' ' LYS . . . . . . . . . . . . . 6.5 ttmm -58.49 -44.79 89.51 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.259 -0.901 . . . . 1.4 109.303 -179.989 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 352' ' ' ASP . . . . . . . . . . . . . 14.5 m-20 -57.04 -42.95 81.45 Favored 'General case' 0 N--CA 1.489 1.484 0 O-C-N 121.319 -0.863 . . . . 1.16 109.676 179.922 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 353' ' ' ALA . . . . . . . . . . . . . . . -67.35 -22.08 65.6 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.277 -0.889 . . . . 0.63 109.691 -179.787 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 354' ' ' GLN . . . . . 0.603 ' NE2' HD11 ' B' ' 350' ' ' LEU . 0.0 OUTLIER . . . . . 0 N--CA 1.488 1.475 0 O-C-N 121.237 -0.914 . . . . 1.47 109.274 179.944 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild core ' B' B ' 326' ' ' GLU . . . . . . . . . . . . . 4.4 mt-10 . . . . . 0 N--CA 1.489 1.482 0 CA-C-O 121.345 0.593 . . . . 2.13 109.497 . . . . . . . . . 0 0 . 1 . 034 nuclear nobuild core ' B' B ' 327' ' ' TYR . . . . . . . . . . . . . 39.3 m-85 -148.92 109.73 4.28 Favored 'General case' 0 N--CA 1.489 1.49 0 O-C-N 121.353 -0.842 . . . . 0.48 109.51 179.854 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' B' B ' 328' ' ' PHE . . . . . 0.403 ' O ' HG23 ' B' ' 329' ' ' THR . 87.8 m-85 -113.61 -169.25 1.47 Allowed 'General case' 0 C--N 1.301 -1.522 0 O-C-N 121.305 -0.872 . . . . 0.32 108.965 179.748 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild core ' B' B ' 329' ' ' THR . . . . . 0.403 HG23 ' O ' ' B' ' 328' ' ' PHE . 23.8 p -153.37 169.1 23.94 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.072 -1.017 . . . . 0.23 109.728 -179.776 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild core ' B' B ' 330' ' ' LEU . . . . . 0.606 HD11 HD22 ' D' ' 345' ' ' ASN . 17.2 tp -150.61 126.89 10.64 Favored 'General case' 0 N--CA 1.488 1.452 0 O-C-N 121.262 -0.899 . . . . 0.28 109.592 -179.768 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild core ' B' B ' 331' ' ' GLN . . . . . 0.439 ' OE1' ' O ' ' D' ' 328' ' ' PHE . 3.7 tp-100 -87.2 120.07 28.1 Favored 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.253 -0.904 . . . . 0.91 109.378 179.876 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild core ' B' B ' 332' ' ' ILE . . . . . 0.615 HG21 ' HA ' ' B' ' 338' ' ' PHE . 97.9 mt -103.56 107.92 23.31 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.564 0 O-C-N 121.136 -0.978 . . . . 0.24 109.433 179.867 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild core ' B' B ' 333' ' ' ARG . . . . . 0.454 ' CG ' HH11 ' B' ' 333' ' ' ARG . 1.4 mtt-85 -72.2 131.67 43.07 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.267 -0.896 . . . . 2.93 109.439 -179.979 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild core ' B' B ' 334' ' ' GLY . . . . . . . . . . . . . . . 88.18 138.58 6.17 Favored Glycine 0 N--CA 1.49 2.27 0 N-CA-C 109.749 -1.341 . . . . 0.4 109.749 179.704 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' B' B ' 335' ' ' ARG . . . . . 0.445 ' O ' ' HB3' ' B' ' 338' ' ' PHE . 39.1 ttt180 -79.88 -28.85 39.87 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.313 -1.11 . . . . 3.01 109.655 179.991 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild core ' B' B ' 336' ' ' GLU . . . . . . . . . . . . . 39.3 mt-10 -56.74 -61.77 2.2 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.309 -0.869 . . . . 2.28 109.811 -179.67 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' B' B ' 337' ' ' ARG . . . . . 0.497 ' HG2' ' NH1' ' B' ' 337' ' ' ARG . 0.0 OUTLIER -60.54 -27.06 67.36 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.314 -0.866 . . . . 2.93 109.602 -179.8 . . . . . . . . 3 3 . 1 . 034 nuclear nobuild core ' B' B ' 338' ' ' PHE . . . . . 0.615 ' HA ' HG21 ' B' ' 332' ' ' ILE . 91.4 t80 -56.11 -53.64 54.61 Favored 'General case' 0 C--N 1.303 -1.418 0 O-C-N 121.199 -0.938 . . . . 0.37 110.045 -179.623 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild core ' B' B ' 339' ' ' GLU . . . . . . . . . . . . . 7.0 mt-10 -54.75 -39.46 68.34 Favored 'General case' 0 N--CA 1.494 1.769 0 O-C-N 121.073 -1.017 . . . . 1.98 110.679 -179.459 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' B' B ' 340' ' ' MET . . . . . . . . . . . . . 30.5 ttp -64.12 -53.47 49.03 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 120.946 -1.096 . . . . 0.32 110.89 -178.845 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' B' B ' 341' ' ' PHE . . . . . 0.446 ' CZ ' ' HA ' ' D' ' 345' ' ' ASN . 56.2 m-85 -60.72 -48.15 83.1 Favored 'General case' 0 N--CA 1.494 1.725 0 O-C-N 120.96 -1.087 . . . . 0.18 110.412 -178.983 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild core ' B' B ' 342' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -49.58 -43.85 46.48 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.137 -0.977 . . . . 2.42 110.124 -179.579 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild core ' B' B ' 343' ' ' GLU . . . . . . . . . . . . . 2.1 tp10 -57.99 -42.46 85.19 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.178 -0.951 . . . . 2.35 109.607 -179.665 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' B' B ' 344' ' ' LEU . . . . . . . . . . . . . 46.5 mt -63.5 -47.06 83.27 Favored 'General case' 0 N--CA 1.488 1.473 0 O-C-N 121.306 -0.871 . . . . 0.18 109.931 -179.722 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' B' B ' 345' ' ' ASN . . . . . 0.582 ' HB2' HD21 ' D' ' 330' ' ' LEU . 40.2 t-20 -55.06 -47.95 74.14 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.123 -0.986 . . . . 1.09 109.679 -179.615 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild core ' B' B ' 346' ' ' GLU . . . . . . . . . . . . . 56.3 tt0 -61.99 -35.86 79.77 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.118 -0.989 . . . . 1.66 109.661 -179.863 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' B' B ' 347' ' ' ALA . . . . . 0.689 ' HB1' ' HB1' ' A' ' 347' ' ' ALA . . . -59.93 -55.37 34.88 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.293 -0.879 . . . . 0.17 110.184 -179.478 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild core ' B' B ' 348' ' ' LEU . . . . . 0.576 HD22 ' N ' ' B' ' 348' ' ' LEU . 3.8 mm? -60.72 -41.0 94.38 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.214 -0.929 . . . . 0.29 109.678 -179.595 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild core ' B' B ' 349' ' ' GLU . . . . . . . . . . . . . 86.8 mt-10 -59.05 -33.07 70.34 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.269 -0.894 . . . . 1.95 109.75 -179.729 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' B' B ' 350' ' ' LEU . . . . . 0.616 ' O ' HD23 ' B' ' 350' ' ' LEU . 5.3 tt -63.67 -48.97 75.02 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.192 -0.942 . . . . 0.45 109.286 179.882 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild core ' B' B ' 351' ' ' LYS . . . . . . . . . . . . . 6.2 ttmm -58.5 -44.76 89.56 Favored 'General case' 0 N--CA 1.489 1.483 0 O-C-N 121.309 -0.869 . . . . 1.38 109.254 179.894 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' B' B ' 352' ' ' ASP . . . . . . . . . . . . . 16.6 m-20 -57.18 -43.04 82.26 Favored 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.305 -0.872 . . . . 1.16 109.549 179.956 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' B' B ' 353' ' ' ALA . . . . . . . . . . . . . . . -67.32 -21.92 65.64 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.228 -0.92 . . . . 0.61 109.585 -179.776 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' B' B ' 354' ' ' GLN . . . . . 0.497 ' NE2' HD11 ' A' ' 350' ' ' LEU . 0.0 OUTLIER . . . . . 0 N--CA 1.488 1.471 0 O-C-N 121.246 -0.909 . . . . 1.45 109.52 179.913 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild core ' C' C ' 326' ' ' GLU . . . . . . . . . . . . . 10.3 mt-10 . . . . . 0 N--CA 1.49 1.559 0 CA-C-O 121.41 0.624 . . . . 2.17 110.134 . . . . . . . . . 0 0 . 1 . 034 nuclear nobuild core ' C' C ' 327' ' ' TYR . . . . . 0.488 ' CE2' ' HG2' ' A' ' 333' ' ' ARG . 40.3 m-85 -148.03 116.5 6.61 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.482 -0.761 . . . . 0.48 109.248 -179.945 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild core ' C' C ' 328' ' ' PHE . . . . . 0.449 ' O ' ' OE1' ' A' ' 331' ' ' GLN . 72.1 m-85 -113.29 -170.15 1.63 Allowed 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.176 -0.952 . . . . 0.33 109.49 -179.889 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild core ' C' C ' 329' ' ' THR . . . . . 0.428 ' HA ' ' O ' ' A' ' 330' ' ' LEU . 17.8 p -152.66 168.22 26.36 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.266 -0.896 . . . . 0.23 109.483 -179.913 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild core ' C' C ' 330' ' ' LEU . . . . . 0.642 HD21 ' HB2' ' A' ' 345' ' ' ASN . 16.5 tp -150.99 125.42 9.49 Favored 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.25 -0.906 . . . . 0.28 109.567 -179.677 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild core ' C' C ' 331' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -88.91 113.16 24.15 Favored 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.224 -0.923 . . . . 1.48 109.522 179.965 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild core ' C' C ' 332' ' ' ILE . . . . . 0.559 HD13 ' CD2' ' C' ' 341' ' ' PHE . 42.0 mt -104.12 113.9 42.29 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.631 0 O-C-N 121.171 -0.955 . . . . 0.24 109.589 179.73 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild core ' C' C ' 333' ' ' ARG . . . . . 0.55 ' HG3' ' CE1' ' A' ' 327' ' ' TYR . 0.1 OUTLIER -73.59 144.18 46.1 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.195 -0.941 . . . . 2.74 109.586 179.868 . . . . . . . . 3 3 . 1 . 034 nuclear nobuild core ' C' C ' 334' ' ' GLY . . . . . . . . . . . . . . . 88.11 135.74 5.07 Favored Glycine 0 N--CA 1.493 2.465 0 N-CA-C 110.033 -1.227 . . . . 0.35 110.033 179.629 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' C' C ' 335' ' ' ARG . . . . . 0.454 ' O ' ' HB3' ' C' ' 338' ' ' PHE . 13.2 ttm180 -80.44 -41.49 24.38 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.384 -1.068 . . . . 2.53 109.704 179.938 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild core ' C' C ' 336' ' ' GLU . . . . . . . . . . . . . 4.2 mt-10 -56.46 -53.7 54.38 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.245 -0.91 . . . . 2.62 109.5 -179.778 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' C' C ' 337' ' ' ARG . . . . . 0.426 HH11 ' HG3' ' C' ' 337' ' ' ARG . 0.1 OUTLIER -60.24 -33.61 72.52 Favored 'General case' 0 N--CA 1.489 1.499 0 O-C-N 121.149 -0.969 . . . . 2.81 109.128 179.782 . . . . . . . . 3 3 . 1 . 034 nuclear nobuild core ' C' C ' 338' ' ' PHE . . . . . 0.454 ' HB3' ' O ' ' C' ' 335' ' ' ARG . 86.6 t80 -56.33 -55.39 34.04 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.418 -0.801 . . . . 0.4 109.768 179.839 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild core ' C' C ' 339' ' ' GLU . . . . . . . . . . . . . 47.6 mt-10 -50.13 -35.99 28.07 Favored 'General case' 0 N--CA 1.494 1.748 0 O-C-N 121.255 -0.903 . . . . 2.05 110.131 -179.75 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' C' C ' 340' ' ' MET . . . . . . . . . . . . . 37.0 ttp -63.98 -52.41 59.75 Favored 'General case' 0 N--CA 1.493 1.717 0 O-C-N 121.199 -0.938 . . . . 0.32 110.608 -179.153 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' C' C ' 341' ' ' PHE . . . . . 0.559 ' CD2' HD13 ' C' ' 332' ' ' ILE . 50.3 m-85 -61.73 -44.38 97.02 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.216 -0.928 . . . . 0.18 110.509 -178.976 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild core ' C' C ' 342' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -50.39 -43.25 54.46 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 120.99 -1.069 . . . . 2.91 110.285 -179.491 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild core ' C' C ' 343' ' ' GLU . . . . . . . . . . . . . 80.1 tt0 -59.07 -45.55 90.54 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.121 -0.987 . . . . 2.14 110.057 -179.388 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' C' C ' 344' ' ' LEU . . . . . . . . . . . . . 65.2 mt -62.87 -43.97 97.38 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.155 -0.966 . . . . 0.22 110.125 -179.502 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' C' C ' 345' ' ' ASN . . . . . 0.551 ' HA ' ' CZ ' ' A' ' 341' ' ' PHE . 64.6 t-20 -57.03 -51.23 70.1 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.171 -0.956 . . . . 1.08 109.868 -179.518 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild core ' C' C ' 346' ' ' GLU . . . . . . . . . . . . . 10.8 tt0 -60.53 -30.52 69.8 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.089 -1.007 . . . . 2.21 109.431 -179.875 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' C' C ' 347' ' ' ALA . . . . . 0.824 ' HB1' ' HB1' ' D' ' 347' ' ' ALA . . . -60.23 -58.07 10.1 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.282 -0.886 . . . . 0.18 109.981 -179.946 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild core ' C' C ' 348' ' ' LEU . . . . . 0.634 HD22 ' N ' ' C' ' 348' ' ' LEU . 4.0 mm? -61.66 -40.86 96.44 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.21 -0.931 . . . . 0.32 109.659 -179.7 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild core ' C' C ' 349' ' ' GLU . . . . . . . . . . . . . 53.3 mm-40 -56.99 -36.11 70.0 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.223 -0.923 . . . . 2.19 109.552 -179.878 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' C' C ' 350' ' ' LEU . . . . . 0.783 HD13 HD22 ' D' ' 350' ' ' LEU . 4.5 tt -63.05 -47.1 84.43 Favored 'General case' 0 N--CA 1.488 1.46 0 O-C-N 121.236 -0.915 . . . . 0.46 109.227 179.996 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild core ' C' C ' 351' ' ' LYS . . . . . . . . . . . . . 16.8 tttm -59.66 -42.11 92.09 Favored 'General case' 0 N--CA 1.49 1.525 0 O-C-N 121.211 -0.93 . . . . 1.35 109.547 179.879 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' C' C ' 352' ' ' ASP . . . . . . . . . . . . . 86.2 m-20 -56.13 -38.34 70.68 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.272 -0.893 . . . . 1.19 109.655 -179.941 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' C' C ' 353' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 1.625 0 O-C-N 121.24 -0.912 . . . . 0.57 109.613 -179.645 . . . . . . . . 0 0 . 1 . 034 nuclear nobuild core ' D' D ' 326' ' ' GLU . . . . . . . . . . . . . 4.7 mt-10 . . . . . 0 N--CA 1.489 1.5 0 CA-C-O 121.339 0.59 . . . . 2.13 109.468 . . . . . . . . . 0 0 . 1 . 034 nuclear nobuild core ' D' D ' 327' ' ' TYR . . . . . . . . . . . . . 39.0 m-85 -148.75 109.66 4.29 Favored 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.406 -0.809 . . . . 0.47 109.612 179.919 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' D' D ' 328' ' ' PHE . . . . . 0.439 ' O ' ' OE1' ' B' ' 331' ' ' GLN . 88.1 m-85 -113.56 -169.77 1.57 Allowed 'General case' 0 N--CA 1.488 1.467 0 O-C-N 121.268 -0.895 . . . . 0.3 109.055 179.76 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild core ' D' D ' 329' ' ' THR . . . . . 0.441 ' HA ' ' O ' ' B' ' 330' ' ' LEU . 23.8 p -153.0 169.2 23.48 Favored 'General case' 0 N--CA 1.489 1.486 0 O-C-N 121.122 -0.986 . . . . 0.22 109.555 -179.845 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild core ' D' D ' 330' ' ' LEU . . . . . 0.582 HD21 ' HB2' ' B' ' 345' ' ' ASN . 17.4 tp -150.72 127.09 10.68 Favored 'General case' 0 N--CA 1.488 1.457 0 O-C-N 121.297 -0.877 . . . . 0.28 109.427 -179.737 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild core ' D' D ' 331' ' ' GLN . . . . . . . . . . . . . 3.6 tp-100 -87.42 120.12 28.39 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.266 -0.897 . . . . 0.93 109.377 179.862 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' D' D ' 332' ' ' ILE . . . . . 0.625 HG21 ' HA ' ' D' ' 338' ' ' PHE . 97.9 mt -103.36 108.59 24.79 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.566 0 O-C-N 121.184 -0.947 . . . . 0.25 109.354 179.814 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild core ' D' D ' 333' ' ' ARG . . . . . 0.441 HH11 ' CG ' ' D' ' 333' ' ' ARG . 1.5 mtt-85 -72.76 131.81 42.81 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.229 -0.919 . . . . 2.93 109.488 -179.953 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild core ' D' D ' 334' ' ' GLY . . . . . . . . . . . . . . . 88.05 138.9 6.23 Favored Glycine 0 N--CA 1.491 2.314 0 N-CA-C 109.648 -1.381 . . . . 0.41 109.648 179.741 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' D' D ' 335' ' ' ARG . . . . . 0.446 ' O ' ' HB3' ' D' ' 338' ' ' PHE . 40.7 ttt180 -80.12 -29.08 38.89 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.284 -1.127 . . . . 3.03 109.594 -179.906 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild core ' D' D ' 336' ' ' GLU . . . . . . . . . . . . . 41.1 mt-10 -56.41 -62.29 1.82 Allowed 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.306 -0.871 . . . . 2.26 109.78 -179.715 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' D' D ' 337' ' ' ARG . . . . . 0.465 ' NH1' ' HG2' ' D' ' 337' ' ' ARG . 0.0 OUTLIER -59.92 -27.23 66.59 Favored 'General case' 0 N--CA 1.489 1.501 0 O-C-N 121.238 -0.914 . . . . 2.92 109.68 -179.813 . . . . . . . . 3 3 . 1 . 034 nuclear nobuild core ' D' D ' 338' ' ' PHE . . . . . 0.625 ' HA ' HG21 ' D' ' 332' ' ' ILE . 91.5 t80 -55.81 -54.26 46.68 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.175 -0.953 . . . . 0.37 109.923 -179.749 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild core ' D' D ' 339' ' ' GLU . . . . . . . . . . . . . 6.9 mt-10 -54.04 -39.6 66.35 Favored 'General case' 0 N--CA 1.494 1.759 0 O-C-N 121.095 -1.003 . . . . 1.99 110.68 -179.345 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' D' D ' 340' ' ' MET . . . . . . . . . . . . . 30.0 ttp -64.43 -53.16 52.8 Favored 'General case' 0 N--CA 1.495 1.785 0 O-C-N 121.061 -1.025 . . . . 0.31 110.862 -178.703 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' D' D ' 341' ' ' PHE . . . . . 0.563 ' CZ ' ' HA ' ' B' ' 345' ' ' ASN . 56.8 m-85 -60.83 -48.43 81.82 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 120.958 -1.089 . . . . 0.18 110.364 -179.084 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild core ' D' D ' 342' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -49.28 -44.06 43.64 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.155 -0.965 . . . . 2.41 110.054 -179.58 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild core ' D' D ' 343' ' ' GLU . . . . . . . . . . . . . 2.1 tp10 -57.88 -42.5 84.72 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.101 -0.999 . . . . 2.35 109.652 -179.657 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' D' D ' 344' ' ' LEU . . . . . . . . . . . . . 46.4 mt -63.31 -46.97 84.23 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.199 -0.938 . . . . 0.19 109.984 -179.878 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' D' D ' 345' ' ' ASN . . . . . 0.606 HD22 HD11 ' B' ' 330' ' ' LEU . 40.5 t-20 -55.14 -48.31 73.87 Favored 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.174 -0.954 . . . . 1.09 109.672 -179.48 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild core ' D' D ' 346' ' ' GLU . . . . . . . . . . . . . 56.2 tt0 -61.69 -36.0 79.63 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.088 -1.007 . . . . 1.69 109.681 179.997 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' D' D ' 347' ' ' ALA . . . . . 0.824 ' HB1' ' HB1' ' C' ' 347' ' ' ALA . . . -59.84 -55.79 29.85 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.185 -0.947 . . . . 0.18 110.044 -179.499 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild core ' D' D ' 348' ' ' LEU . . . . . 0.569 HD22 ' N ' ' D' ' 348' ' ' LEU . 3.8 mm? -60.1 -41.24 92.11 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.304 -0.873 . . . . 0.31 109.69 -179.645 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild core ' D' D ' 349' ' ' GLU . . . . . . . . . . . . . 84.6 mt-10 -59.07 -32.99 70.28 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.178 -0.952 . . . . 1.95 109.877 -179.652 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' D' D ' 350' ' ' LEU . . . . . 0.783 HD22 HD13 ' C' ' 350' ' ' LEU . 5.2 tt -63.69 -48.86 75.42 Favored 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.148 -0.97 . . . . 0.43 109.184 179.875 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild core ' D' D ' 351' ' ' LYS . . . . . . . . . . . . . 6.0 ttmm -58.67 -44.67 90.25 Favored 'General case' 0 N--CA 1.488 1.431 0 O-C-N 121.347 -0.846 . . . . 1.4 109.378 179.881 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' D' D ' 352' ' ' ASP . . . . . . . . . . . . . 20.0 m-20 -57.26 -42.81 82.26 Favored 'General case' 0 N--CA 1.488 1.438 0 O-C-N 121.293 -0.88 . . . . 1.17 109.566 179.859 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' D' D ' 353' ' ' ALA . . . . . . . . . . . . . . . -67.58 -21.49 65.43 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.28 -0.888 . . . . 0.59 109.768 -179.739 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' D' D ' 354' ' ' GLN . . . . . 0.521 ' NE2' HD11 ' C' ' 350' ' ' LEU . 0.0 OUTLIER . . . . . 0 N--CA 1.49 1.553 0 O-C-N 121.229 -0.919 . . . . 1.44 109.31 179.961 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild core ' A' A ' 326' ' ' GLU . . . . . . . . . . . . . 2.1 mt-10 . . . . . 0 N--CA 1.489 1.5 0 N-CA-C 109.424 -0.584 . . . . 2.13 109.424 . . . . . . . . . 0 0 . 1 . 035 nuclear nobuild core ' A' A ' 327' ' ' TYR . . . . . . . . . . . . . 48.1 m-85 -148.87 109.06 4.11 Favored 'General case' 0 C--N 1.303 -1.415 0 O-C-N 121.259 -0.901 . . . . 0.48 109.413 179.989 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 328' ' ' PHE . . . . . 0.519 ' CZ ' ' HG3' ' C' ' 335' ' ' ARG . 88.4 m-85 -113.83 -169.01 1.43 Allowed 'General case' 0 N--CA 1.489 1.492 0 O-C-N 121.353 -0.842 . . . . 0.31 109.04 179.873 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild core ' A' A ' 329' ' ' THR . . . . . . . . . . . . . 32.4 p -152.57 168.16 26.5 Favored 'General case' 0 C--N 1.302 -1.49 0 O-C-N 121.142 -0.973 . . . . 0.22 109.311 -179.925 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 330' ' ' LEU . . . . . . . . . . . . . 41.9 tp -149.72 127.69 11.89 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.196 -0.94 . . . . 0.28 109.694 -179.688 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 331' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -88.3 114.65 25.13 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.23 -0.919 . . . . 0.91 109.206 179.661 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild core ' A' A ' 332' ' ' ILE . . . . . 0.651 HD12 ' HD1' ' A' ' 338' ' ' PHE . 23.0 mt -103.32 112.74 37.9 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.57 0 O-C-N 121.194 -0.941 . . . . 0.26 109.524 179.957 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild core ' A' A ' 333' ' ' ARG . . . . . 0.44 ' HG2' ' CE1' ' C' ' 327' ' ' TYR . 2.4 mtt180 -72.5 145.24 47.65 Favored 'General case' 0 N--CA 1.488 1.459 0 O-C-N 121.332 -0.855 . . . . 2.92 109.31 179.918 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild core ' A' A ' 334' ' ' GLY . . . . . . . . . . . . . . . 83.11 127.72 1.23 Allowed Glycine 0 N--CA 1.492 2.387 0 N-CA-C 109.567 -1.413 . . . . 0.4 109.567 179.936 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 335' ' ' ARG . . . . . 0.443 ' CG ' HH11 ' A' ' 335' ' ' ARG . 0.4 OUTLIER -75.01 -35.12 61.99 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.233 -1.157 . . . . 3.01 109.345 -179.965 . . . . . . . . 3 3 . 1 . 035 nuclear nobuild core ' A' A ' 336' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -58.06 -59.29 5.5 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.319 -0.863 . . . . 2.29 109.451 179.98 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild core ' A' A ' 337' ' ' ARG . . . . . 0.668 ' NH2' HD12 ' C' ' 348' ' ' LEU . 6.0 mmt180 -60.72 -31.61 70.9 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.33 -0.856 . . . . 2.93 109.466 179.981 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild core ' A' A ' 338' ' ' PHE . . . . . 0.651 ' HD1' HD12 ' A' ' 332' ' ' ILE . 52.5 t80 -55.43 -55.78 27.72 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.195 -0.94 . . . . 0.38 109.411 179.968 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild core ' A' A ' 339' ' ' GLU . . . . . . . . . . . . . 4.9 mt-10 -52.07 -32.96 37.0 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.318 -0.864 . . . . 1.97 109.952 -179.812 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 340' ' ' MET . . . . . . . . . . . . . 21.8 ttp -63.52 -52.69 60.1 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.242 -0.911 . . . . 0.31 110.041 -179.519 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 341' ' ' PHE . . . . . 0.453 ' HB2' HD13 ' A' ' 332' ' ' ILE . 56.7 m-85 -62.22 -43.11 99.56 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.112 -0.993 . . . . 0.18 110.012 -179.384 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild core ' A' A ' 342' ' ' ARG . . . . . 0.449 ' CG ' HH11 ' A' ' 342' ' ' ARG . 0.0 OUTLIER -50.8 -46.45 59.7 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.299 -0.876 . . . . 2.42 110.023 -179.655 . . . . . . . . 3 3 . 1 . 035 nuclear nobuild core ' A' A ' 343' ' ' GLU . . . . . . . . . . . . . 4.9 tt0 -59.29 -43.55 92.57 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.167 -0.958 . . . . 2.35 109.928 -179.562 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 344' ' ' LEU . . . . . . . . . . . . . 53.2 mt -62.19 -36.61 82.44 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.202 -0.936 . . . . 0.18 109.715 -179.793 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 345' ' ' ASN . . . . . 0.518 ' HB2' HD21 ' C' ' 330' ' ' LEU . 56.7 t-20 -58.47 -55.59 33.1 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.284 -0.885 . . . . 1.09 109.612 -179.787 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild core ' A' A ' 346' ' ' GLU . . . . . . . . . . . . . 3.5 tt0 -60.41 -29.42 68.97 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.281 -0.887 . . . . 1.65 109.575 -179.803 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 347' ' ' ALA . . . . . . . . . . . . . . . -60.77 -59.08 5.95 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.243 -0.911 . . . . 0.18 109.954 179.96 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 348' ' ' LEU . . . . . 0.57 HD22 ' N ' ' A' ' 348' ' ' LEU . 4.0 mm? -61.47 -45.44 94.26 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.265 -0.897 . . . . 0.3 110.026 -179.565 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild core ' A' A ' 349' ' ' GLU . . . . . . . . . . . . . 3.8 mm-40 -55.78 -34.21 65.08 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.166 -0.959 . . . . 1.94 109.439 -179.623 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 350' ' ' LEU . . . . . 0.608 HD11 ' NE2' ' B' ' 354' ' ' GLN . 6.0 tt -63.36 -45.69 90.0 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.223 -0.923 . . . . 0.46 109.086 179.667 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild core ' A' A ' 351' ' ' LYS . . . . . . . . . . . . . 30.4 tttt -59.72 -45.88 90.81 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.382 -0.824 . . . . 1.4 109.692 -179.943 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 352' ' ' ASP . . . . . . . . . . . . . 7.8 m-20 -54.81 -49.85 69.97 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.248 -0.908 . . . . 1.16 109.889 -179.717 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 353' ' ' ALA . . . . . . . . . . . . . . . -67.12 -23.85 65.86 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.192 -0.943 . . . . 0.63 109.681 -179.715 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 354' ' ' GLN . . . . . 0.629 ' NE2' HD11 ' B' ' 350' ' ' LEU . 1.2 tt0 . . . . . 0 N--CA 1.492 1.628 0 O-C-N 121.278 -0.889 . . . . 1.47 109.797 -179.932 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' B' B ' 326' ' ' GLU . . . . . . . . . . . . . 2.1 mt-10 . . . . . 0 N--CA 1.489 1.512 0 N-CA-C 109.366 -0.605 . . . . 2.13 109.366 . . . . . . . . . 0 0 . 1 . 035 nuclear nobuild core ' B' B ' 327' ' ' TYR . . . . . . . . . . . . . 47.9 m-85 -148.62 108.97 4.13 Favored 'General case' 0 N--CA 1.489 1.481 0 O-C-N 121.199 -0.938 . . . . 0.48 109.427 -179.974 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' B' B ' 328' ' ' PHE . . . . . 0.49 ' CZ ' ' HG3' ' D' ' 335' ' ' ARG . 88.5 m-85 -113.62 -169.07 1.43 Allowed 'General case' 0 N--CA 1.487 1.419 0 O-C-N 121.254 -0.904 . . . . 0.32 109.044 179.897 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild core ' B' B ' 329' ' ' THR . . . . . . . . . . . . . 30.3 p -152.45 168.11 26.56 Favored 'General case' 0 N--CA 1.489 1.494 0 O-C-N 121.217 -0.927 . . . . 0.23 109.325 -179.965 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' B' B ' 330' ' ' LEU . . . . . 0.695 HD11 HD22 ' D' ' 345' ' ' ASN . 39.9 tp -149.78 127.7 11.84 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.24 -0.913 . . . . 0.28 109.656 -179.742 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild core ' B' B ' 331' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -88.43 114.58 25.2 Favored 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.35 -0.844 . . . . 0.91 109.299 179.708 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild core ' B' B ' 332' ' ' ILE . . . . . 0.662 HD12 ' HD1' ' B' ' 338' ' ' PHE . 22.2 mt -103.18 112.57 37.13 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.542 0 O-C-N 121.107 -0.995 . . . . 0.24 109.563 -179.923 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild core ' B' B ' 333' ' ' ARG . . . . . 0.473 ' HG2' ' CE1' ' D' ' 327' ' ' TYR . 2.3 mtt180 -72.19 145.15 48.22 Favored 'General case' 0 N--CA 1.489 1.49 0 O-C-N 121.306 -0.871 . . . . 2.93 109.312 179.86 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild core ' B' B ' 334' ' ' GLY . . . . . . . . . . . . . . . 83.08 127.87 1.24 Allowed Glycine 0 N--CA 1.49 2.269 0 N-CA-C 109.646 -1.382 . . . . 0.4 109.646 -179.999 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' B' B ' 335' ' ' ARG . . . . . 0.437 HH11 ' CG ' ' B' ' 335' ' ' ARG . 0.3 OUTLIER -75.16 -35.38 61.63 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.338 -1.095 . . . . 3.01 109.34 179.935 . . . . . . . . 3 3 . 1 . 035 nuclear nobuild core ' B' B ' 336' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -57.93 -59.15 5.69 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.296 -0.877 . . . . 2.28 109.403 179.941 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild core ' B' B ' 337' ' ' ARG . . . . . 0.58 ' NH2' HD12 ' D' ' 348' ' ' LEU . 6.2 mmt180 -60.86 -31.86 71.3 Favored 'General case' 0 N--CA 1.489 1.495 0 O-C-N 121.337 -0.852 . . . . 2.93 109.434 -179.944 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild core ' B' B ' 338' ' ' PHE . . . . . 0.662 ' HD1' HD12 ' B' ' 332' ' ' ILE . 52.7 t80 -55.14 -55.88 26.17 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.297 -0.877 . . . . 0.37 109.495 179.909 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild core ' B' B ' 339' ' ' GLU . . . . . . . . . . . . . 4.9 mt-10 -51.77 -33.18 34.04 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.316 -0.865 . . . . 1.98 110.019 -179.865 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' B' B ' 340' ' ' MET . . . . . . . . . . . . . 20.9 ttp -63.45 -52.63 60.63 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.198 -0.939 . . . . 0.32 110.113 -179.428 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' B' B ' 341' ' ' PHE . . . . . 0.46 ' CZ ' ' HA ' ' D' ' 345' ' ' ASN . 56.2 m-85 -62.42 -42.99 99.86 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.171 -0.956 . . . . 0.18 109.988 -179.466 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild core ' B' B ' 342' ' ' ARG . . . . . 0.448 ' NH1' ' CG ' ' B' ' 342' ' ' ARG . 0.0 OUTLIER -50.97 -46.51 61.24 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.315 -0.866 . . . . 2.42 110.049 -179.647 . . . . . . . . 3 3 . 1 . 035 nuclear nobuild core ' B' B ' 343' ' ' GLU . . . . . . . . . . . . . 5.1 tt0 -59.23 -43.39 92.35 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.121 -0.987 . . . . 2.35 109.953 -179.696 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' B' B ' 344' ' ' LEU . . . . . . . . . . . . . 55.7 mt -62.31 -36.56 82.51 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.184 -0.948 . . . . 0.18 109.75 -179.774 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' B' B ' 345' ' ' ASN . . . . . 0.601 HD22 HD11 ' D' ' 330' ' ' LEU . 56.9 t-20 -58.61 -55.02 40.4 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.239 -0.913 . . . . 1.09 109.689 -179.838 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild core ' B' B ' 346' ' ' GLU . . . . . . . . . . . . . 3.4 tt0 -60.77 -29.49 69.45 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.354 -0.841 . . . . 1.66 109.574 -179.815 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' B' B ' 347' ' ' ALA . . . . . . . . . . . . . . . -60.88 -58.91 6.43 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.292 -0.88 . . . . 0.17 109.924 -179.896 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' B' B ' 348' ' ' LEU . . . . . 0.761 HD12 ' NH2' ' D' ' 337' ' ' ARG . 4.0 mm? -61.45 -45.93 92.22 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.196 -0.94 . . . . 0.29 109.887 -179.622 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild core ' B' B ' 349' ' ' GLU . . . . . . . . . . . . . 3.9 mm-40 -55.38 -34.23 64.14 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.17 -0.957 . . . . 1.95 109.534 -179.705 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' B' B ' 350' ' ' LEU . . . . . 0.629 HD11 ' NE2' ' A' ' 354' ' ' GLN . 6.1 tt -63.32 -45.77 89.78 Favored 'General case' 0 N--CA 1.488 1.457 0 O-C-N 121.205 -0.934 . . . . 0.45 109.173 179.69 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild core ' B' B ' 351' ' ' LYS . . . . . . . . . . . . . 30.5 tttt -59.79 -45.87 90.98 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.442 -0.786 . . . . 1.38 109.713 -179.967 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' B' B ' 352' ' ' ASP . . . . . . . . . . . . . 7.8 m-20 -54.88 -49.58 70.84 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.22 -0.925 . . . . 1.16 109.84 -179.735 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' B' B ' 353' ' ' ALA . . . . . . . . . . . . . . . -67.32 -24.03 65.7 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.19 -0.943 . . . . 0.61 109.601 -179.749 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' B' B ' 354' ' ' GLN . . . . . 0.608 ' NE2' HD11 ' A' ' 350' ' ' LEU . 1.2 tt0 . . . . . 0 N--CA 1.491 1.592 0 O-C-N 121.233 -0.917 . . . . 1.45 109.779 -179.883 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' C' C ' 326' ' ' GLU . . . . . 0.49 ' HB3' ' CE1' ' C' ' 328' ' ' PHE . 60.7 mm-40 . . . . . 0 N--CA 1.488 1.451 0 N-CA-C 109.204 -0.665 . . . . 2.17 109.204 . . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' C' C ' 327' ' ' TYR . . . . . 0.44 ' CE1' ' HG2' ' A' ' 333' ' ' ARG . 37.0 m-85 -149.22 109.59 4.18 Favored 'General case' 0 C--N 1.302 -1.462 0 O-C-N 121.354 -0.841 . . . . 0.48 109.41 179.94 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild core ' C' C ' 328' ' ' PHE . . . . . 0.49 ' CE1' ' HB3' ' C' ' 326' ' ' GLU . 65.2 m-85 -113.58 -167.72 1.24 Allowed 'General case' 0 N--CA 1.489 1.477 0 O-C-N 121.431 -0.793 . . . . 0.33 109.393 179.969 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild core ' C' C ' 329' ' ' THR . . . . . . . . . . . . . 14.6 p -151.86 168.66 24.43 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.242 -0.911 . . . . 0.23 109.342 -179.865 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' C' C ' 330' ' ' LEU . . . . . 0.518 HD21 ' HB2' ' A' ' 345' ' ' ASN . 30.6 tp -149.48 127.02 11.58 Favored 'General case' 0 C--N 1.303 -1.453 0 O-C-N 121.201 -0.937 . . . . 0.28 109.505 -179.741 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild core ' C' C ' 331' ' ' GLN . . . . . 0.536 ' CG ' ' NH2' ' C' ' 333' ' ' ARG . 6.9 tp-100 -87.23 114.22 23.65 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.312 -0.868 . . . . 1.48 109.46 179.941 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild core ' C' C ' 332' ' ' ILE . . . . . 0.612 HG21 ' HA ' ' C' ' 338' ' ' PHE . 84.7 mt -103.7 110.99 31.7 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.548 0 O-C-N 121.297 -0.877 . . . . 0.24 109.687 179.925 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild core ' C' C ' 333' ' ' ARG . . . . . 0.536 ' NH2' ' CG ' ' C' ' 331' ' ' GLN . 0.0 OUTLIER -72.92 147.3 45.42 Favored 'General case' 0 N--CA 1.488 1.439 0 O-C-N 121.156 -0.965 . . . . 2.74 109.277 179.711 . . . . . . . . 3 3 . 1 . 035 nuclear nobuild core ' C' C ' 334' ' ' GLY . . . . . . . . . . . . . . . 76.65 131.73 0.45 Allowed Glycine 0 N--CA 1.492 2.388 0 N-CA-C 109.632 -1.387 . . . . 0.35 109.632 179.815 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' C' C ' 335' ' ' ARG . . . . . 0.519 ' HG3' ' CZ ' ' A' ' 328' ' ' PHE . 1.1 tmt_? -76.84 -30.51 56.35 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.327 -1.102 . . . . 2.53 109.61 -179.994 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild core ' C' C ' 336' ' ' GLU . . . . . . . . . . . . . 21.2 mt-10 -57.62 -60.08 4.21 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.345 -0.847 . . . . 2.62 109.729 -179.725 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' C' C ' 337' ' ' ARG . . . . . 0.495 ' HD2' ' N ' ' C' ' 337' ' ' ARG . 11.4 mmm180 -59.85 -31.52 69.83 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.305 -0.872 . . . . 2.81 109.609 -179.592 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild core ' C' C ' 338' ' ' PHE . . . . . 0.612 ' HA ' HG21 ' C' ' 332' ' ' ILE . 61.3 t80 -56.12 -56.74 17.21 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.365 -0.834 . . . . 0.4 109.858 -179.724 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild core ' C' C ' 339' ' ' GLU . . . . . . . . . . . . . 3.8 mt-10 -49.45 -38.38 29.45 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.254 -0.904 . . . . 2.05 110.302 -179.462 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' C' C ' 340' ' ' MET . . . . . . . . . . . . . 35.1 ttp -64.61 -47.15 79.68 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.11 -0.994 . . . . 0.32 110.279 -179.396 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' C' C ' 341' ' ' PHE . . . . . 0.458 ' CZ ' ' HA ' ' A' ' 345' ' ' ASN . 38.0 m-85 -62.47 -52.87 61.82 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.173 -0.954 . . . . 0.18 110.139 -179.352 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild core ' C' C ' 342' ' ' ARG . . . . . . . . . . . . . 7.4 tmm_? -46.51 -40.08 11.95 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.267 -0.896 . . . . 2.91 109.718 -179.751 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' C' C ' 343' ' ' GLU . . . . . . . . . . . . . 6.4 tp10 -59.06 -50.2 74.98 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.236 -0.915 . . . . 2.14 109.721 -179.956 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' C' C ' 344' ' ' LEU . . . . . . . . . . . . . 41.0 mt -61.91 -28.36 69.47 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.263 -0.898 . . . . 0.22 109.419 179.992 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' C' C ' 345' ' ' ASN . . . . . 0.5 ' ND2' ' OE2' ' C' ' 349' ' ' GLU . 13.9 t-20 -57.8 -59.64 4.91 Favored 'General case' 0 N--CA 1.489 1.484 0 O-C-N 121.243 -0.911 . . . . 1.08 109.45 179.929 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild core ' C' C ' 346' ' ' GLU . . . . . . . . . . . . . 1.3 tt0 -61.74 -24.23 66.67 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.431 -0.793 . . . . 2.21 109.655 -179.954 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' C' C ' 347' ' ' ALA . . . . . 0.496 ' HB1' ' HB1' ' D' ' 347' ' ' ALA . . . -61.71 -62.8 1.55 Allowed 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.204 -0.935 . . . . 0.18 110.025 -179.76 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild core ' C' C ' 348' ' ' LEU . . . . . 0.668 HD12 ' NH2' ' A' ' 337' ' ' ARG . 3.6 mm? -61.9 -45.0 95.64 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.19 -0.944 . . . . 0.32 110.018 -179.405 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild core ' C' C ' 349' ' ' GLU . . . . . 0.5 ' OE2' ' ND2' ' C' ' 345' ' ' ASN . 3.6 mt-10 -56.37 -34.16 66.4 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.153 -0.967 . . . . 2.19 109.525 -179.629 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild core ' C' C ' 350' ' ' LEU . . . . . 0.637 HD22 HD13 ' D' ' 350' ' ' LEU . 7.4 tt -65.0 -41.29 95.51 Favored 'General case' 0 N--CA 1.489 1.483 0 O-C-N 121.217 -0.927 . . . . 0.46 109.188 179.674 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild core ' C' C ' 351' ' ' LYS . . . . . . . . . . . . . 13.7 tttt -60.3 -48.9 79.78 Favored 'General case' 0 N--CA 1.489 1.501 0 O-C-N 121.353 -0.842 . . . . 1.35 109.621 -179.919 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' C' C ' 352' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -57.23 -44.24 83.58 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.244 -0.91 . . . . 1.19 109.774 -179.902 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' C' C ' 353' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 1.606 0 O-C-N 121.296 -0.877 . . . . 0.57 109.764 -179.825 . . . . . . . . 0 0 . 1 . 035 nuclear nobuild core ' D' D ' 326' ' ' GLU . . . . . . . . . . . . . 2.1 mt-10 . . . . . 0 N--CA 1.489 1.515 0 N-CA-C 109.355 -0.609 . . . . 2.13 109.355 . . . . . . . . . 0 0 . 1 . 035 nuclear nobuild core ' D' D ' 327' ' ' TYR . . . . . 0.473 ' CE1' ' HG2' ' B' ' 333' ' ' ARG . 47.0 m-85 -148.91 108.65 4.02 Favored 'General case' 0 N--CA 1.488 1.444 0 O-C-N 121.318 -0.864 . . . . 0.47 109.453 -179.934 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild core ' D' D ' 328' ' ' PHE . . . . . 0.415 ' CZ ' ' HG3' ' B' ' 335' ' ' ARG . 88.7 m-85 -113.47 -169.02 1.42 Allowed 'General case' 0 N--CA 1.489 1.481 0 O-C-N 121.356 -0.84 . . . . 0.3 109.103 179.936 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild core ' D' D ' 329' ' ' THR . . . . . . . . . . . . . 31.1 p -152.44 168.18 26.32 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.208 -0.932 . . . . 0.22 109.336 -179.968 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' D' D ' 330' ' ' LEU . . . . . 0.601 HD11 HD22 ' B' ' 345' ' ' ASN . 38.5 tp -149.96 127.2 11.34 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.197 -0.94 . . . . 0.28 109.642 -179.667 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild core ' D' D ' 331' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -87.83 114.56 24.55 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.312 -0.868 . . . . 0.93 109.299 179.604 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild core ' D' D ' 332' ' ' ILE . . . . . 0.666 HD12 ' HD1' ' D' ' 338' ' ' PHE . 21.9 mt -103.29 112.88 38.41 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.55 0 O-C-N 121.121 -0.987 . . . . 0.25 109.493 179.925 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild core ' D' D ' 333' ' ' ARG . . . . . . . . . . . . . 2.3 mtt180 -72.43 145.23 47.77 Favored 'General case' 0 N--CA 1.488 1.445 0 O-C-N 121.141 -0.974 . . . . 2.93 109.365 179.938 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' D' D ' 334' ' ' GLY . . . . . . . . . . . . . . . 83.08 127.57 1.2 Allowed Glycine 0 N--CA 1.49 2.271 0 N-CA-C 109.608 -1.397 . . . . 0.41 109.608 179.861 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' D' D ' 335' ' ' ARG . . . . . 0.49 ' HG3' ' CZ ' ' B' ' 328' ' ' PHE . 0.4 OUTLIER -74.75 -35.23 62.62 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.225 -1.162 . . . . 3.03 109.466 179.953 . . . . . . . . 3 3 . 1 . 035 nuclear nobuild core ' D' D ' 336' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -58.02 -59.29 5.5 Favored 'General case' 0 N--CA 1.489 1.484 0 O-C-N 121.253 -0.904 . . . . 2.26 109.522 179.956 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild core ' D' D ' 337' ' ' ARG . . . . . 0.761 ' NH2' HD12 ' B' ' 348' ' ' LEU . 6.2 mmt180 -60.73 -31.77 71.06 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.317 -0.865 . . . . 2.92 109.426 -179.97 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild core ' D' D ' 338' ' ' PHE . . . . . 0.666 ' HD1' HD12 ' D' ' 332' ' ' ILE . 52.9 t80 -55.19 -55.9 26.05 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.234 -0.916 . . . . 0.37 109.517 179.927 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild core ' D' D ' 339' ' ' GLU . . . . . . . . . . . . . 5.0 mt-10 -51.94 -33.06 35.78 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.261 -0.899 . . . . 1.99 109.893 -179.755 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' D' D ' 340' ' ' MET . . . . . . . . . . . . . 21.1 ttp -63.53 -52.51 60.86 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.262 -0.898 . . . . 0.31 110.12 -179.422 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' D' D ' 341' ' ' PHE . . . . . 0.569 ' CZ ' ' HA ' ' B' ' 345' ' ' ASN . 57.0 m-85 -62.38 -43.17 99.45 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.137 -0.977 . . . . 0.18 110.016 -179.515 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild core ' D' D ' 342' ' ' ARG . . . . . 0.447 ' NH1' ' CG ' ' D' ' 342' ' ' ARG . 0.0 OUTLIER -50.77 -46.47 59.49 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.229 -0.92 . . . . 2.41 110.017 -179.657 . . . . . . . . 3 3 . 1 . 035 nuclear nobuild core ' D' D ' 343' ' ' GLU . . . . . . . . . . . . . 4.7 tt0 -59.12 -43.71 91.96 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.181 -0.949 . . . . 2.35 109.887 -179.636 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' D' D ' 344' ' ' LEU . . . . . . . . . . . . . 54.4 mt -62.18 -36.54 82.19 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.175 -0.953 . . . . 0.19 109.783 -179.79 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' D' D ' 345' ' ' ASN . . . . . 0.695 HD22 HD11 ' B' ' 330' ' ' LEU . 56.5 t-20 -58.61 -55.43 35.17 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.243 -0.911 . . . . 1.09 109.664 -179.824 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild core ' D' D ' 346' ' ' GLU . . . . . . . . . . . . . 3.3 tt0 -60.52 -29.44 69.11 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.193 -0.942 . . . . 1.69 109.534 -179.777 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' D' D ' 347' ' ' ALA . . . . . 0.496 ' HB1' ' HB1' ' C' ' 347' ' ' ALA . . . -60.91 -58.84 6.74 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.154 -0.966 . . . . 0.18 109.885 -179.943 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild core ' D' D ' 348' ' ' LEU . . . . . 0.58 HD12 ' NH2' ' B' ' 337' ' ' ARG . 4.0 mm? -61.53 -45.82 92.55 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.212 -0.93 . . . . 0.31 109.9 -179.557 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild core ' D' D ' 349' ' ' GLU . . . . . . . . . . . . . 3.9 mm-40 -55.51 -34.17 64.41 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.273 -0.892 . . . . 1.95 109.607 -179.622 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' D' D ' 350' ' ' LEU . . . . . 0.637 HD13 HD22 ' C' ' 350' ' ' LEU . 6.1 tt -63.44 -45.79 89.31 Favored 'General case' 0 N--CA 1.489 1.484 0 O-C-N 121.273 -0.892 . . . . 0.43 109.069 179.701 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild core ' D' D ' 351' ' ' LYS . . . . . . . . . . . . . 30.2 tttt -59.77 -45.74 91.34 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.402 -0.811 . . . . 1.4 109.664 -179.942 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' D' D ' 352' ' ' ASP . . . . . . . . . . . . . 7.6 m-20 -54.91 -49.85 70.25 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.293 -0.879 . . . . 1.17 109.845 -179.766 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' D' D ' 353' ' ' ALA . . . . . . . . . . . . . . . -67.22 -23.88 65.77 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.198 -0.939 . . . . 0.59 109.651 -179.731 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' D' D ' 354' ' ' GLN . . . . . 0.478 ' NE2' HD11 ' C' ' 350' ' ' LEU . 1.2 tt0 . . . . . 0 N--CA 1.49 1.572 0 O-C-N 121.249 -0.907 . . . . 1.44 109.728 -179.889 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 319' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.49 1.533 0 CA-C-O 121.334 0.587 . . . . 7.55 109.504 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 320' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER 54.96 -94.51 0.04 OUTLIER 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.183 -0.948 . . . . 6.43 109.556 -179.942 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 321' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -158.35 132.26 5.0 Favored Pre-proline 0 N--CA 1.49 1.546 0 O-C-N 121.129 -0.982 . . . . 6.13 109.419 179.91 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 322' ' ' PRO . . . . . . . . . . . . . 1.1 Cg_endo -64.13 -81.78 0.01 OUTLIER 'Trans proline' 0 C--N 1.312 -1.382 0 C-N-CA 122.045 1.83 . . . . 2.83 110.348 -179.868 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 323' ' ' LEU . . . . . . . . . . . . . 73.1 mt -81.99 114.92 20.9 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.155 -0.965 . . . . 2.83 109.622 -179.893 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 324' ' ' ASP . . . . . 0.484 ' N ' ' OD1' ' A' ' 324' ' ' ASP . 1.8 m-20 -79.67 142.75 35.25 Favored 'General case' 0 N--CA 1.488 1.455 0 O-C-N 121.299 -0.876 . . . . 1.53 108.955 179.631 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 325' ' ' GLY . . . . . . . . . . . . . . . -67.39 179.21 16.09 Favored Glycine 0 N--CA 1.488 2.129 0 N-CA-C 109.259 -1.537 . . . . 0.61 109.259 -179.884 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 326' ' ' GLU . . . . . . . . . . . . . 4.2 mm-40 -56.89 -179.75 0.04 OUTLIER 'General case' 0 N--CA 1.487 1.424 0 O-C-N 121.177 -1.19 . . . . 2.13 109.235 -179.878 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 327' ' ' TYR . . . . . . . . . . . . . 42.2 m-85 -147.31 96.28 2.68 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.248 -0.908 . . . . 0.48 109.437 -179.974 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 328' ' ' PHE . . . . . 0.564 ' CE2' ' HG3' ' C' ' 335' ' ' ARG . 56.8 m-85 -103.46 -160.34 0.77 Allowed 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.319 -0.863 . . . . 0.31 109.588 -179.759 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 329' ' ' THR . . . . . 0.455 ' HA ' ' O ' ' C' ' 330' ' ' LEU . 34.8 p -154.11 169.22 24.07 Favored 'General case' 0 N--CA 1.489 1.49 0 O-C-N 121.455 -0.778 . . . . 0.22 108.922 179.894 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 330' ' ' LEU . . . . . 0.478 ' O ' ' HA ' ' C' ' 329' ' ' THR . 24.4 tp -151.42 132.97 14.76 Favored 'General case' 0 N--CA 1.488 1.474 0 O-C-N 121.071 -1.018 . . . . 0.28 109.768 -179.717 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 331' ' ' GLN . . . . . . . . . . . . . 7.1 tp-100 -85.66 115.94 23.64 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.343 -0.848 . . . . 0.91 108.946 179.695 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 332' ' ' ILE . . . . . 0.794 HG21 ' HA ' ' A' ' 338' ' ' PHE . 75.0 mt -103.17 104.25 16.34 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.555 0 O-C-N 121.261 -0.899 . . . . 0.26 109.819 -179.714 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 333' ' ' ARG . . . . . 0.554 ' CG ' ' CE1' ' C' ' 327' ' ' TYR . 1.9 mpt_? -72.74 138.86 46.78 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.376 -0.828 . . . . 2.92 109.35 179.744 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 334' ' ' GLY . . . . . . . . . . . . . . . 91.25 130.21 4.69 Favored Glycine 0 N--CA 1.491 2.367 0 N-CA-C 109.573 -1.411 . . . . 0.4 109.573 179.868 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 335' ' ' ARG . . . . . 0.424 ' O ' ' HB3' ' A' ' 338' ' ' PHE . 57.5 ttt180 -79.36 -37.8 36.55 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.34 -1.094 . . . . 3.01 109.653 179.919 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 336' ' ' GLU . . . . . . . . . . . . . 5.0 mt-10 -58.0 -60.87 3.07 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.187 -0.946 . . . . 2.29 109.671 -179.863 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 337' ' ' ARG . . . . . . . . . . . . . 4.0 mtt180 -59.98 -28.58 67.8 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.232 -0.918 . . . . 2.93 109.603 -179.831 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 338' ' ' PHE . . . . . 0.794 ' HA ' HG21 ' A' ' 332' ' ' ILE . 59.1 t80 -54.51 -60.24 3.62 Favored 'General case' 0 N--CA 1.489 1.494 0 O-C-N 121.175 -0.953 . . . . 0.38 109.477 -179.996 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 339' ' ' GLU . . . . . . . . . . . . . 5.8 mt-10 -51.36 -31.29 21.65 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.291 -0.881 . . . . 1.97 109.771 -179.917 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 340' ' ' MET . . . . . . . . . . . . . 27.7 ttp -64.19 -52.61 58.11 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.128 -0.982 . . . . 0.31 109.881 -179.703 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 341' ' ' PHE . . . . . . . . . . . . . 39.2 m-85 -61.79 -47.84 83.31 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.205 -0.935 . . . . 0.18 109.766 -179.623 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 342' ' ' ARG . . . . . . . . . . . . . 9.7 ttt180 -49.67 -40.21 39.16 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.21 -0.931 . . . . 2.42 109.779 -179.811 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 343' ' ' GLU . . . . . . . . . . . . . 4.3 tt0 -59.29 -49.7 76.84 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.196 -0.94 . . . . 2.35 109.8 -179.762 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 344' ' ' LEU . . . . . 0.548 ' CD2' HD22 ' B' ' 344' ' ' LEU . 45.4 mt -61.84 -31.47 71.73 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.148 -0.97 . . . . 0.18 109.569 -179.805 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 345' ' ' ASN . . . . . . . . . . . . . 15.9 t-20 -57.87 -57.87 10.87 Favored 'General case' 0 N--CA 1.489 1.477 0 O-C-N 121.229 -0.919 . . . . 1.09 109.53 -179.965 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 346' ' ' GLU . . . . . . . . . . . . . 37.3 tt0 -60.98 -29.06 69.46 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.296 -0.878 . . . . 1.65 109.628 -179.848 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 347' ' ' ALA . . . . . 0.4 ' HB1' ' HB1' ' B' ' 347' ' ' ALA . . . -59.45 -58.43 8.65 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.195 -0.941 . . . . 0.18 109.843 -179.83 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 348' ' ' LEU . . . . . 0.608 HD22 ' N ' ' A' ' 348' ' ' LEU . 4.2 mm? -61.52 -38.73 88.45 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.282 -0.887 . . . . 0.3 109.71 -179.671 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 349' ' ' GLU . . . . . . . . . . . . . 9.2 mt-10 -57.83 -38.31 75.41 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.337 -0.852 . . . . 1.94 110.063 -179.57 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 350' ' ' LEU . . . . . 0.664 HD22 HD13 ' B' ' 350' ' ' LEU . 6.1 tt -62.75 -48.74 77.88 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.165 -0.96 . . . . 0.46 109.73 -179.755 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 351' ' ' LYS . . . . . . . . . . . . . 5.8 tttt -59.33 -36.92 76.55 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.221 -0.924 . . . . 1.4 109.471 -179.808 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 352' ' ' ASP . . . . . 0.403 ' OD1' ' CZ ' ' C' ' 337' ' ' ARG . 55.3 m-20 -56.36 -42.3 77.57 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.254 -0.904 . . . . 1.16 109.709 -179.974 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 353' ' ' ALA . . . . . . . . . . . . . . . -67.62 -23.02 65.32 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.271 -0.893 . . . . 0.63 109.93 -179.573 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 354' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -83.48 -10.61 58.24 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.185 -0.947 . . . . 1.47 109.746 -179.736 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 355' ' ' ALA . . . . . . . . . . . . . . . -72.35 -2.41 19.1 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.173 -0.955 . . . . 1.01 109.813 179.945 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 356' ' ' GLY . . . . . . . . . . . . . . . -72.93 -60.83 3.73 Favored Glycine 0 N--CA 1.492 2.372 0 N-CA-C 109.878 -1.289 . . . . 1.3 109.878 -179.803 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 357' ' ' LYS . . . . . . . . . . . . . 25.3 mttt -84.87 143.05 29.29 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.212 -1.17 . . . . 4.1 109.696 -179.68 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 358' ' ' GLU . . . . . . . . . . . . . 5.3 mt-10 -50.04 159.77 0.75 Allowed Pre-proline 0 N--CA 1.49 1.54 0 O-C-N 121.249 -0.907 . . . . 5.75 109.503 179.926 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 359' ' ' PRO . . . . . . . . . . . . . 2.5 Cg_endo -62.46 134.87 50.28 Favored 'Trans proline' 0 C--N 1.309 -1.543 0 C-N-CA 122.277 1.984 . . . . 5.0 110.182 179.918 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 360' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.309 0 CA-C-O 117.988 -1.451 . . . . 6.97 109.544 179.953 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' B' B ' 319' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.489 1.495 0 N-CA-C 109.48 -0.563 . . . . 7.55 109.48 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 320' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER 55.04 -94.45 0.04 OUTLIER 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.293 -0.879 . . . . 6.44 109.464 -179.983 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 321' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -158.43 132.24 4.96 Favored Pre-proline 0 N--CA 1.49 1.552 0 O-C-N 121.05 -1.031 . . . . 6.13 109.438 179.989 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 322' ' ' PRO . . . . . . . . . . . . . 1.1 Cg_endo -64.19 -81.83 0.01 OUTLIER 'Trans proline' 0 C--N 1.311 -1.414 0 C-N-CA 122.048 1.832 . . . . 2.82 110.272 -179.845 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 323' ' ' LEU . . . . . . . . . . . . . 73.0 mt -81.94 115.07 20.94 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.267 -0.895 . . . . 2.84 109.669 -179.872 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 324' ' ' ASP . . . . . 0.481 ' N ' ' OD1' ' B' ' 324' ' ' ASP . 1.8 m-20 -80.17 141.3 35.81 Favored 'General case' 0 N--CA 1.489 1.497 0 O-C-N 121.23 -0.919 . . . . 1.53 109.163 179.764 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 325' ' ' GLY . . . . . . . . . . . . . . . -65.26 179.17 9.27 Favored Glycine 0 N--CA 1.489 2.197 0 N-CA-C 109.374 -1.49 . . . . 0.59 109.374 179.968 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 326' ' ' GLU . . . . . . . . . . . . . 4.1 mm-40 -57.27 -179.34 0.04 OUTLIER 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.23 -1.159 . . . . 2.13 109.208 179.971 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 327' ' ' TYR . . . . . 0.606 ' CE2' ' HG2' ' D' ' 333' ' ' ARG . 42.3 m-85 -147.55 96.1 2.63 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.322 -0.861 . . . . 0.48 109.426 179.986 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 328' ' ' PHE . . . . . . . . . . . . . 58.1 m-85 -103.27 -160.2 0.76 Allowed 'General case' 0 N--CA 1.489 1.482 0 O-C-N 121.323 -0.861 . . . . 0.32 109.57 -179.841 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 329' ' ' THR . . . . . . . . . . . . . 35.4 p -154.18 169.2 24.17 Favored 'General case' 0 N--CA 1.489 1.482 0 O-C-N 121.354 -0.841 . . . . 0.23 108.987 179.825 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 330' ' ' LEU . . . . . . . . . . . . . 25.0 tp -151.34 133.04 14.89 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.084 -1.01 . . . . 0.28 109.735 -179.765 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 331' ' ' GLN . . . . . . . . . . . . . 7.1 tp-100 -85.65 116.1 23.73 Favored 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.283 -0.885 . . . . 0.91 108.999 179.546 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 332' ' ' ILE . . . . . 0.783 HG21 ' HA ' ' B' ' 338' ' ' PHE . 75.3 mt -103.44 104.3 16.46 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.523 0 O-C-N 121.258 -0.901 . . . . 0.24 109.761 -179.669 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 333' ' ' ARG . . . . . 0.527 ' CG ' ' CE2' ' D' ' 327' ' ' TYR . 1.9 mpt_? -72.87 139.05 46.66 Favored 'General case' 0 N--CA 1.489 1.493 0 O-C-N 121.271 -0.893 . . . . 2.93 109.352 179.737 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 334' ' ' GLY . . . . . . . . . . . . . . . 91.24 129.89 4.58 Favored Glycine 0 N--CA 1.489 2.206 0 N-CA-C 109.679 -1.369 . . . . 0.4 109.679 179.906 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 335' ' ' ARG . . . . . 0.421 ' O ' ' HB3' ' B' ' 338' ' ' PHE . 57.5 ttt180 -79.15 -37.88 37.37 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.34 -1.094 . . . . 3.01 109.581 -179.955 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 336' ' ' GLU . . . . . . . . . . . . . 5.0 mt-10 -57.95 -60.81 3.14 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.348 -0.845 . . . . 2.28 109.719 -179.823 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 337' ' ' ARG . . . . . 0.511 ' CZ ' ' OD1' ' D' ' 352' ' ' ASP . 4.0 mtt180 -60.02 -28.53 67.81 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.188 -0.945 . . . . 2.93 109.641 -179.806 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 338' ' ' PHE . . . . . 0.783 ' HA ' HG21 ' B' ' 332' ' ' ILE . 59.4 t80 -54.42 -60.41 3.38 Favored 'General case' 0 N--CA 1.488 1.458 0 O-C-N 121.184 -0.948 . . . . 0.37 109.397 179.969 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 339' ' ' GLU . . . . . . . . . . . . . 5.7 mt-10 -51.31 -31.23 20.88 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.248 -0.907 . . . . 1.98 109.781 -179.88 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 340' ' ' MET . . . . . . . . . . . . . 27.5 ttp -64.19 -52.64 57.92 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.221 -0.924 . . . . 0.32 109.982 -179.711 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 341' ' ' PHE . . . . . . . . . . . . . 39.1 m-85 -61.72 -47.87 83.3 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.103 -0.998 . . . . 0.18 109.78 -179.694 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 342' ' ' ARG . . . . . . . . . . . . . 9.8 ttt180 -49.62 -40.16 38.28 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.294 -0.879 . . . . 2.42 109.828 -179.846 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 343' ' ' GLU . . . . . . . . . . . . . 4.2 tt0 -59.36 -49.64 77.04 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.227 -0.92 . . . . 2.35 109.742 -179.745 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 344' ' ' LEU . . . . . 0.548 HD22 ' CD2' ' A' ' 344' ' ' LEU . 45.4 mt -61.88 -31.56 71.85 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.234 -0.916 . . . . 0.18 109.597 -179.788 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 345' ' ' ASN . . . . . . . . . . . . . 16.7 t-20 -57.64 -58.0 10.26 Favored 'General case' 0 N--CA 1.489 1.483 0 O-C-N 121.235 -0.916 . . . . 1.09 109.571 179.956 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 346' ' ' GLU . . . . . . . . . . . . . 36.8 tt0 -60.84 -29.35 69.45 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.354 -0.841 . . . . 1.66 109.658 -179.901 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 347' ' ' ALA . . . . . 0.4 ' HB1' ' HB1' ' A' ' 347' ' ' ALA . . . -59.29 -58.41 8.76 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.24 -0.912 . . . . 0.17 109.891 -179.774 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 348' ' ' LEU . . . . . 0.609 HD22 ' N ' ' B' ' 348' ' ' LEU . 4.1 mm? -61.5 -38.68 88.22 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.19 -0.944 . . . . 0.29 109.737 -179.737 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 349' ' ' GLU . . . . . . . . . . . . . 9.3 mt-10 -57.86 -38.42 75.67 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.247 -0.908 . . . . 1.95 110.074 -179.539 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 350' ' ' LEU . . . . . 0.664 HD13 HD22 ' A' ' 350' ' ' LEU . 6.1 tt -62.69 -48.82 77.64 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.197 -0.94 . . . . 0.45 109.659 -179.705 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 351' ' ' LYS . . . . . . . . . . . . . 5.8 tttt -59.26 -36.92 76.38 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.115 -0.99 . . . . 1.38 109.525 -179.847 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 352' ' ' ASP . . . . . . . . . . . . . 55.4 m-20 -56.33 -42.34 77.53 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.26 -0.9 . . . . 1.16 109.668 -179.96 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 353' ' ' ALA . . . . . . . . . . . . . . . -67.6 -23.22 65.36 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.217 -0.927 . . . . 0.61 109.868 -179.504 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 354' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -83.24 -10.67 58.43 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.194 -0.941 . . . . 1.45 109.812 -179.86 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 355' ' ' ALA . . . . . . . . . . . . . . . -72.25 -2.23 18.16 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.156 -0.965 . . . . 0.98 109.771 179.924 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 356' ' ' GLY . . . . . . . . . . . . . . . -73.22 -60.88 3.63 Favored Glycine 0 N--CA 1.491 2.331 0 N-CA-C 109.797 -1.321 . . . . 1.29 109.797 -179.725 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 357' ' ' LYS . . . . . . . . . . . . . 25.5 mttt -84.82 143.2 29.24 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.199 -1.177 . . . . 4.09 109.73 -179.757 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 358' ' ' GLU . . . . . . . . . . . . . 5.2 mt-10 -50.18 159.69 0.78 Allowed Pre-proline 0 N--CA 1.49 1.538 0 O-C-N 121.324 -0.86 . . . . 5.72 109.417 179.997 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 359' ' ' PRO . . . . . . . . . . . . . 2.5 Cg_endo -62.42 135.0 51.11 Favored 'Trans proline' 0 C--N 1.31 -1.48 0 C-N-CA 122.132 1.888 . . . . 4.98 110.185 -179.997 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 360' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.318 0 CA-C-O 117.984 -1.453 . . . . 6.98 109.597 179.929 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' C' C ' 319' ' ' LYS . . . . . 0.458 ' O ' ' HB2' ' C' ' 320' ' ' LYS . 0.0 OUTLIER . . . . . 0 N--CA 1.489 1.514 0 N-CA-C 109.528 -0.545 . . . . 6.82 109.528 . . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 320' ' ' LYS . . . . . 0.458 ' HB2' ' O ' ' C' ' 319' ' ' LYS . 16.8 mtpp 61.08 100.65 0.03 OUTLIER 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.291 -0.881 . . . . 6.49 109.802 179.799 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 321' ' ' LYS . . . . . . . . . . . . . 8.9 mttm -82.96 153.24 66.84 Favored Pre-proline 0 N--CA 1.491 1.583 0 O-C-N 121.244 -0.91 . . . . 6.4 109.297 179.684 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 322' ' ' PRO . . . . . . . . . . . . . 2.0 Cg_endo -62.36 172.12 4.65 Favored 'Trans proline' 0 C--N 1.311 -1.439 0 C-N-CA 122.298 1.999 . . . . 3.42 110.702 -179.746 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 323' ' ' LEU . . . . . . . . . . . . . 28.7 mt -80.44 110.09 15.56 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.353 -0.842 . . . . 3.95 109.167 179.705 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 324' ' ' ASP . . . . . . . . . . . . . 23.0 m-20 -80.78 -151.97 0.08 Allowed 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.216 -0.928 . . . . 1.63 109.813 -179.667 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 325' ' ' GLY . . . . . . . . . . . . . . . -69.24 -168.23 5.69 Favored Glycine 0 N--CA 1.492 2.421 0 N-CA-C 109.781 -1.328 . . . . 0.73 109.781 -179.677 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 326' ' ' GLU . . . . . . . . . . . . . 3.2 mm-40 -57.48 -171.81 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.319 -1.106 . . . . 2.17 109.47 -179.975 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 327' ' ' TYR . . . . . 0.554 ' CE1' ' CG ' ' A' ' 333' ' ' ARG . 49.3 m-85 -149.05 101.71 3.18 Favored 'General case' 0 N--CA 1.488 1.46 0 O-C-N 121.333 -0.854 . . . . 0.48 109.505 179.891 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 328' ' ' PHE . . . . . . . . . . . . . 63.9 m-85 -103.15 -165.85 1.21 Allowed 'General case' 0 N--CA 1.488 1.472 0 O-C-N 121.381 -0.824 . . . . 0.33 109.129 179.985 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 329' ' ' THR . . . . . 0.478 ' HA ' ' O ' ' A' ' 330' ' ' LEU . 43.1 p -150.71 167.04 28.57 Favored 'General case' 0 N--CA 1.488 1.468 0 O-C-N 121.204 -0.935 . . . . 0.23 109.353 -179.952 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 330' ' ' LEU . . . . . 0.455 ' O ' ' HA ' ' A' ' 329' ' ' THR . 17.7 tp -150.67 125.94 10.03 Favored 'General case' 0 C--N 1.303 -1.451 0 O-C-N 121.184 -0.948 . . . . 0.28 109.939 -179.585 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 331' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -87.0 110.29 19.96 Favored 'General case' 0 N--CA 1.488 1.433 0 N-CA-C 108.554 -0.906 . . . . 1.48 108.554 179.236 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 332' ' ' ILE . . . . . 0.482 HG21 ' HA ' ' C' ' 338' ' ' PHE . 51.5 mt -100.87 111.44 30.56 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.521 0 O-C-N 121.232 -0.917 . . . . 0.24 109.622 -179.382 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 333' ' ' ARG . . . . . 0.476 ' NH1' ' HG2' ' C' ' 333' ' ' ARG . 0.0 OUTLIER -72.71 153.07 41.34 Favored 'General case' 0 C--N 1.304 -1.374 0 O-C-N 121.395 -0.815 . . . . 2.74 109.421 179.848 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' C' C ' 334' ' ' GLY . . . . . . . . . . . . . . . 73.97 118.67 0.08 OUTLIER Glycine 0 N--CA 1.491 2.323 0 N-CA-C 109.464 -1.455 . . . . 0.35 109.464 -179.933 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 335' ' ' ARG . . . . . 0.564 ' HG3' ' CE2' ' A' ' 328' ' ' PHE . 4.6 ttt-85 -69.76 -30.39 67.96 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.251 -1.147 . . . . 2.53 109.611 -179.826 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 336' ' ' GLU . . . . . . . . . . . . . 4.2 tt0 -57.89 -62.92 1.46 Allowed 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.134 -0.979 . . . . 2.62 109.552 -179.828 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 337' ' ' ARG . . . . . 0.403 ' CZ ' ' OD1' ' A' ' 352' ' ' ASP . 2.3 mpt_? -60.5 -27.1 67.32 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.217 -0.927 . . . . 2.81 109.588 -179.918 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 338' ' ' PHE . . . . . 0.482 ' HA ' HG21 ' C' ' 332' ' ' ILE . 61.2 t80 -54.58 -59.33 4.84 Favored 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.259 -0.901 . . . . 0.4 109.536 -179.903 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 339' ' ' GLU . . . . . . . . . . . . . 1.5 mt-10 -52.56 -34.13 48.91 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.326 -0.859 . . . . 2.05 109.884 -179.917 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 340' ' ' MET . . . . . . . . . . . . . 38.5 ttp -62.85 -49.98 72.76 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.194 -0.942 . . . . 0.32 109.901 -179.558 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 341' ' ' PHE . . . . . 0.403 ' CD2' HD13 ' C' ' 332' ' ' ILE . 41.6 m-85 -62.59 -41.81 99.19 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.191 -0.943 . . . . 0.18 109.724 -179.826 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 342' ' ' ARG . . . . . 0.449 ' NH1' ' HG3' ' C' ' 342' ' ' ARG . 0.0 OUTLIER -50.94 -43.68 60.23 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.323 -0.861 . . . . 2.91 109.922 -179.83 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' C' C ' 343' ' ' GLU . . . . . . . . . . . . . 3.3 tp10 -58.53 -45.72 88.27 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.166 -0.959 . . . . 2.14 109.725 -179.599 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 344' ' ' LEU . . . . . 0.465 HD22 ' CD2' ' D' ' 344' ' ' LEU . 81.0 mt -61.76 -37.63 85.01 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.18 -0.95 . . . . 0.22 109.499 -179.809 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 345' ' ' ASN . . . . . 0.436 ' O ' ' HG3' ' C' ' 349' ' ' GLU . 16.9 t-20 -58.74 -54.18 50.01 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.232 -0.917 . . . . 1.08 109.567 179.929 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 346' ' ' GLU . . . . . . . . . . . . . 1.3 tm-20 -60.3 -32.12 70.91 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.283 -0.886 . . . . 2.21 109.792 -179.661 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 347' ' ' ALA . . . . . 0.703 ' HB1' ' HB1' ' D' ' 347' ' ' ALA . . . -59.44 -60.55 3.68 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.142 -0.974 . . . . 0.18 109.828 -179.856 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 348' ' ' LEU . . . . . 0.637 HD22 ' N ' ' C' ' 348' ' ' LEU . 4.0 mm? -61.05 -31.57 71.22 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.2 -0.938 . . . . 0.32 109.453 -179.836 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 349' ' ' GLU . . . . . 0.436 ' HG3' ' O ' ' C' ' 345' ' ' ASN . 7.6 mt-10 -59.46 -48.4 81.8 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.247 -0.908 . . . . 2.19 110.013 -179.644 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 350' ' ' LEU . . . . . 0.66 HD13 HD22 ' D' ' 350' ' ' LEU . 6.6 tt -62.83 -38.56 91.25 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.069 -1.019 . . . . 0.46 109.73 -179.623 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 351' ' ' LYS . . . . . . . . . . . . . 20.8 ttmt -58.08 -46.7 85.04 Favored 'General case' 0 N--CA 1.487 1.42 0 O-C-N 121.138 -0.976 . . . . 1.35 109.204 179.921 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 352' ' ' ASP . . . . . . . . . . . . . 3.4 m-20 -56.71 -41.21 77.01 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.261 -0.899 . . . . 1.19 109.576 179.863 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 353' ' ' ALA . . . . . . . . . . . . . . . -67.43 -25.26 65.83 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.29 -0.881 . . . . 0.57 109.805 -179.647 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 354' ' ' GLN . . . . . . . . . . . . . 10.2 tt0 -81.52 -8.83 59.77 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.166 -0.959 . . . . 1.47 109.357 179.94 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 355' ' ' ALA . . . . . . . . . . . . . . . -70.77 -39.7 73.07 Favored 'General case' 0 N--CA 1.488 1.465 0 O-C-N 121.223 -0.923 . . . . 0.93 109.014 179.673 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 356' ' ' GLY . . . . . . . . . . . . . . . -80.23 1.82 79.14 Favored Glycine 0 N--CA 1.49 2.245 0 N-CA-C 109.663 -1.375 . . . . 1.33 109.663 179.82 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 357' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -84.74 170.36 13.32 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.146 -1.208 . . . . 4.01 109.501 -179.907 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 358' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -49.49 160.19 0.6 Allowed Pre-proline 0 N--CA 1.49 1.567 0 O-C-N 121.263 -0.898 . . . . 5.75 109.453 -179.903 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 359' ' ' PRO . . . . . . . . . . . . . 1.0 OUTLIER -65.8 -6.38 13.95 Favored 'Trans proline' 0 C--N 1.31 -1.457 0 C-N-CA 122.194 1.929 . . . . 4.94 110.406 179.904 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 360' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.302 0 N-CA-C 109.465 -1.454 . . . . 6.5 109.465 179.907 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' D' D ' 319' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.49 1.556 0 N-CA-C 109.5 -0.555 . . . . 7.53 109.5 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' D' D ' 320' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER 55.07 -94.46 0.04 OUTLIER 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.281 -0.887 . . . . 6.41 109.488 -179.904 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' D' D ' 321' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -158.46 132.22 4.94 Favored Pre-proline 0 N--CA 1.491 1.579 0 O-C-N 121.161 -0.962 . . . . 6.11 109.392 179.939 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' D' D ' 322' ' ' PRO . . . . . . . . . . . . . 1.1 Cg_endo -64.15 -81.72 0.01 OUTLIER 'Trans proline' 0 C--N 1.312 -1.354 0 C-N-CA 121.984 1.789 . . . . 2.82 110.33 -179.87 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' D' D ' 323' ' ' LEU . . . . . . . . . . . . . 72.9 mt -82.01 115.01 20.97 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.202 -0.936 . . . . 2.83 109.625 -179.878 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' D' D ' 324' ' ' ASP . . . . . 0.47 ' OD1' ' N ' ' D' ' 324' ' ' ASP . 1.8 m-20 -79.81 142.33 35.42 Favored 'General case' 0 N--CA 1.488 1.452 0 O-C-N 121.262 -0.899 . . . . 1.54 109.049 179.659 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' D' D ' 325' ' ' GLY . . . . . . . . . . . . . . . -66.74 179.16 13.44 Favored Glycine 0 N--CA 1.489 2.22 0 N-CA-C 109.241 -1.544 . . . . 0.59 109.241 -179.948 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' D' D ' 326' ' ' GLU . . . . . . . . . . . . . 4.2 mm-40 -56.98 -179.6 0.04 OUTLIER 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.155 -1.203 . . . . 2.13 109.214 -179.961 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' D' D ' 327' ' ' TYR . . . . . 0.527 ' CE2' ' CG ' ' B' ' 333' ' ' ARG . 42.1 m-85 -147.38 96.04 2.64 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.299 -0.875 . . . . 0.47 109.396 -179.967 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' D' D ' 328' ' ' PHE . . . . . . . . . . . . . 58.1 m-85 -103.27 -160.35 0.77 Allowed 'General case' 0 N--CA 1.489 1.48 0 O-C-N 121.395 -0.816 . . . . 0.3 109.639 -179.842 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' D' D ' 329' ' ' THR . . . . . . . . . . . . . 35.7 p -154.1 169.24 24.02 Favored 'General case' 0 N--CA 1.489 1.477 0 O-C-N 121.355 -0.841 . . . . 0.22 108.95 179.869 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' D' D ' 330' ' ' LEU . . . . . . . . . . . . . 24.9 tp -151.4 133.09 14.87 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.206 -0.934 . . . . 0.28 109.796 -179.692 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' D' D ' 331' ' ' GLN . . . . . . . . . . . . . 7.1 tp-100 -85.82 115.96 23.78 Favored 'General case' 0 N--CA 1.489 1.494 0 O-C-N 121.325 -0.859 . . . . 0.93 109.037 179.646 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' D' D ' 332' ' ' ILE . . . . . 0.78 HG21 ' HA ' ' D' ' 338' ' ' PHE . 75.3 mt -103.35 104.42 16.62 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.558 0 O-C-N 121.166 -0.959 . . . . 0.25 109.8 -179.603 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' D' D ' 333' ' ' ARG . . . . . 0.606 ' HG2' ' CE2' ' B' ' 327' ' ' TYR . 2.0 mpt_? -72.73 138.82 46.78 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.294 -0.879 . . . . 2.93 109.36 179.738 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' D' D ' 334' ' ' GLY . . . . . . . . . . . . . . . 91.31 129.9 4.61 Favored Glycine 0 N--CA 1.491 2.313 0 N-CA-C 109.645 -1.382 . . . . 0.41 109.645 179.838 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' D' D ' 335' ' ' ARG . . . . . 0.415 ' O ' ' HB3' ' D' ' 338' ' ' PHE . 57.6 ttt180 -79.12 -37.9 37.48 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.36 -1.082 . . . . 3.03 109.57 -179.957 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' D' D ' 336' ' ' GLU . . . . . . . . . . . . . 5.1 mt-10 -57.9 -60.94 2.95 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.292 -0.88 . . . . 2.26 109.774 -179.86 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' D' D ' 337' ' ' ARG . . . . . . . . . . . . . 4.0 mtt180 -59.96 -28.43 67.64 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.15 -0.968 . . . . 2.92 109.693 -179.908 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' D' D ' 338' ' ' PHE . . . . . 0.78 ' HA ' HG21 ' D' ' 332' ' ' ILE . 59.5 t80 -54.56 -60.19 3.69 Favored 'General case' 0 N--CA 1.488 1.464 0 O-C-N 121.244 -0.91 . . . . 0.37 109.486 179.991 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' D' D ' 339' ' ' GLU . . . . . . . . . . . . . 5.7 mt-10 -51.35 -31.27 21.46 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.191 -0.943 . . . . 1.99 109.76 -179.951 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' D' D ' 340' ' ' MET . . . . . . . . . . . . . 27.4 ttp -64.18 -52.69 57.72 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.286 -0.884 . . . . 0.31 109.964 -179.715 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' D' D ' 341' ' ' PHE . . . . . . . . . . . . . 38.9 m-85 -61.83 -47.72 83.8 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.138 -0.976 . . . . 0.18 109.794 -179.638 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' D' D ' 342' ' ' ARG . . . . . . . . . . . . . 9.8 ttt180 -49.7 -40.12 39.23 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.21 -0.931 . . . . 2.41 109.85 -179.864 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' D' D ' 343' ' ' GLU . . . . . . . . . . . . . 4.2 tt0 -59.32 -49.81 76.41 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.147 -0.971 . . . . 2.35 109.742 -179.76 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' D' D ' 344' ' ' LEU . . . . . 0.465 ' CD2' HD22 ' C' ' 344' ' ' LEU . 45.2 mt -61.85 -31.34 71.59 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.276 -0.89 . . . . 0.19 109.616 -179.787 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' D' D ' 345' ' ' ASN . . . . . . . . . . . . . 16.3 t-20 -57.88 -57.81 11.14 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.279 -0.888 . . . . 1.09 109.526 -179.978 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' D' D ' 346' ' ' GLU . . . . . . . . . . . . . 36.6 tt0 -61.03 -29.2 69.58 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.43 -0.794 . . . . 1.69 109.682 -179.878 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' D' D ' 347' ' ' ALA . . . . . 0.703 ' HB1' ' HB1' ' C' ' 347' ' ' ALA . . . -59.36 -58.35 9.0 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.239 -0.913 . . . . 0.18 109.827 -179.827 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' D' D ' 348' ' ' LEU . . . . . 0.608 HD22 ' N ' ' D' ' 348' ' ' LEU . 4.1 mm? -61.65 -38.55 88.13 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.271 -0.893 . . . . 0.31 109.772 -179.656 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' D' D ' 349' ' ' GLU . . . . . . . . . . . . . 9.3 mt-10 -58.02 -38.33 76.0 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.228 -0.92 . . . . 1.95 110.013 -179.588 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' D' D ' 350' ' ' LEU . . . . . 0.66 HD22 HD13 ' C' ' 350' ' ' LEU . 6.1 tt -62.7 -48.83 77.57 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.11 -0.994 . . . . 0.43 109.697 -179.757 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' D' D ' 351' ' ' LYS . . . . . . . . . . . . . 5.9 tttt -59.21 -36.86 76.14 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.14 -0.975 . . . . 1.4 109.6 -179.895 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' D' D ' 352' ' ' ASP . . . . . 0.511 ' OD1' ' CZ ' ' B' ' 337' ' ' ARG . 55.5 m-20 -56.47 -42.33 78.05 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.332 -0.855 . . . . 1.17 109.664 -179.972 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' D' D ' 353' ' ' ALA . . . . . . . . . . . . . . . -67.59 -23.07 65.35 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.219 -0.925 . . . . 0.59 109.913 -179.598 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' D' D ' 354' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -83.29 -10.76 58.33 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.048 -1.033 . . . . 1.44 109.762 -179.844 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' D' D ' 355' ' ' ALA . . . . . . . . . . . . . . . -72.23 -2.41 18.78 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.262 -0.898 . . . . 0.98 109.913 179.959 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' D' D ' 356' ' ' GLY . . . . . . . . . . . . . . . -73.16 -60.67 3.73 Favored Glycine 0 N--CA 1.491 2.354 0 N-CA-C 109.825 -1.31 . . . . 1.28 109.825 -179.73 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' D' D ' 357' ' ' LYS . . . . . . . . . . . . . 25.8 mttt -84.91 143.13 29.2 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.154 -1.204 . . . . 4.09 109.663 -179.731 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' D' D ' 358' ' ' GLU . . . . . . . . . . . . . 5.2 mt-10 -50.16 159.67 0.78 Allowed Pre-proline 0 N--CA 1.491 1.587 0 O-C-N 121.298 -0.876 . . . . 5.71 109.423 179.941 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' D' D ' 359' ' ' PRO . . . . . . . . . . . . . 2.5 Cg_endo -62.47 134.89 50.34 Favored 'Trans proline' 0 C--N 1.31 -1.474 0 C-N-CA 122.233 1.955 . . . . 4.97 110.126 -179.981 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' D' D ' 360' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.323 0 N-CA-C 109.538 -1.425 . . . . 6.97 109.538 -179.988 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 319' ' ' LYS . . . . . . . . . . . . . 6.6 mttt . . . . . 0 N--CA 1.491 1.594 0 N-CA-C 109.268 -0.642 . . . . 7.55 109.268 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 320' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 61.54 84.88 0.13 Allowed 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.256 -0.903 . . . . 6.43 109.58 179.936 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 321' ' ' LYS . . . . . . . . . . . . . 13.2 mtpt -157.5 98.36 1.94 Allowed Pre-proline 0 N--CA 1.491 1.587 0 O-C-N 121.399 -0.813 . . . . 6.13 109.339 -179.954 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 322' ' ' PRO . . . . . . . . . . . . . 3.0 Cg_exo -61.22 -81.99 0.01 OUTLIER 'Trans proline' 0 C--N 1.311 -1.428 0 C-N-CA 122.021 1.814 . . . . 2.83 109.889 -179.881 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 323' ' ' LEU . . . . . . . . . . . . . 30.5 mt -81.47 111.86 18.19 Favored 'General case' 0 N--CA 1.488 1.467 0 O-C-N 121.264 -0.897 . . . . 2.83 109.307 179.634 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 324' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -80.03 -126.15 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.276 -0.89 . . . . 1.53 109.432 -179.784 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 325' ' ' GLY . . . . . 0.45 ' O ' ' CE1' ' A' ' 327' ' ' TYR . . . -69.18 -165.93 4.46 Favored Glycine 0 N--CA 1.491 2.35 0 N-CA-C 109.554 -1.418 . . . . 0.61 109.554 -179.99 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 326' ' ' GLU . . . . . 0.427 ' O ' ' CD1' ' A' ' 327' ' ' TYR . 70.0 mm-40 -59.14 -179.61 0.08 Allowed 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.413 -1.051 . . . . 2.13 109.579 179.785 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 327' ' ' TYR . . . . . 0.604 ' CE2' ' HG2' ' C' ' 333' ' ' ARG . 46.6 m-85 -149.54 110.15 4.26 Favored 'General case' 0 N--CA 1.487 1.42 0 O-C-N 121.484 -0.76 . . . . 0.48 109.0 179.573 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 328' ' ' PHE . . . . . 0.424 ' CE1' ' HB3' ' A' ' 326' ' ' GLU . 54.8 m-85 -112.22 -167.99 1.26 Allowed 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.185 -0.947 . . . . 0.31 109.602 -179.696 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 329' ' ' THR . . . . . . . . . . . . . 53.3 p -152.06 164.81 36.46 Favored 'General case' 0 N--CA 1.488 1.457 0 O-C-N 121.416 -0.802 . . . . 0.22 108.973 -179.878 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 330' ' ' LEU . . . . . 0.435 ' O ' ' HA ' ' C' ' 329' ' ' THR . 19.1 tp -151.2 131.22 13.41 Favored 'General case' 0 C--N 1.301 -1.507 0 O-C-N 121.127 -0.983 . . . . 0.28 109.769 -179.606 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 331' ' ' GLN . . . . . . . . . . . . . 1.4 tt0 -85.37 116.49 23.73 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.223 -0.923 . . . . 0.91 108.989 179.524 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 332' ' ' ILE . . . . . 0.797 HG21 ' HA ' ' A' ' 338' ' ' PHE . 86.3 mt -101.52 103.44 14.91 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.53 0 O-C-N 121.281 -0.887 . . . . 0.26 109.742 -179.619 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 333' ' ' ARG . . . . . 0.601 ' HG3' ' CD1' ' C' ' 327' ' ' TYR . 3.7 mpt_? -70.27 149.42 47.44 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.238 -0.914 . . . . 2.92 109.199 179.632 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 334' ' ' GLY . . . . . . . . . . . . . . . 78.29 125.37 0.37 Allowed Glycine 0 N--CA 1.49 2.294 0 N-CA-C 109.6 -1.4 . . . . 0.4 109.6 -179.799 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 335' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -74.62 -36.02 62.93 Favored 'General case' 0 N--CA 1.489 1.494 0 O-C-N 121.36 -1.082 . . . . 3.01 109.546 179.956 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 336' ' ' GLU . . . . . . . . . . . . . 27.8 mt-10 -57.77 -58.95 6.1 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.149 -0.969 . . . . 2.29 109.739 -179.562 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 337' ' ' ARG . . . . . 0.644 ' NH1' HD12 ' C' ' 348' ' ' LEU . 15.8 mmt180 -60.77 -28.92 69.1 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.222 -0.924 . . . . 2.93 110.178 -179.573 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 338' ' ' PHE . . . . . 0.797 ' HA ' HG21 ' A' ' 332' ' ' ILE . 41.8 t80 -57.31 -58.88 6.33 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.087 -1.008 . . . . 0.38 110.126 -179.655 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 339' ' ' GLU . . . . . . . . . . . . . 3.5 mt-10 -52.07 -33.91 41.35 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.132 -0.98 . . . . 1.97 110.165 -179.399 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 340' ' ' MET . . . . . . . . . . . . . 32.8 ttp -63.72 -49.94 71.1 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.21 -0.931 . . . . 0.31 109.965 -179.577 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 341' ' ' PHE . . . . . 0.519 ' CZ ' ' HA ' ' C' ' 345' ' ' ASN . 35.6 m-85 -62.14 -44.1 97.37 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.117 -0.99 . . . . 0.18 110.038 -179.646 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 342' ' ' ARG . . . . . 0.479 ' HG2' ' NH1' ' A' ' 342' ' ' ARG . 0.1 OUTLIER -48.98 -45.48 42.29 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.236 -0.915 . . . . 2.42 110.118 -179.537 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 343' ' ' GLU . . . . . . . . . . . . . 5.4 tt0 -57.83 -47.9 81.3 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.28 -0.888 . . . . 2.35 109.977 -179.606 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 344' ' ' LEU . . . . . 0.413 ' O ' ' HB3' ' A' ' 347' ' ' ALA . 50.0 mt -61.36 -32.05 71.95 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.055 -1.028 . . . . 0.18 109.734 -179.715 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 345' ' ' ASN . . . . . 0.464 ' HA ' ' CZ ' ' C' ' 341' ' ' PHE . 17.0 t-20 -56.81 -60.73 3.13 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.326 -0.858 . . . . 1.09 109.752 -179.783 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 346' ' ' GLU . . . . . . . . . . . . . 4.3 tt0 -61.19 -24.41 66.3 Favored 'General case' 0 N--CA 1.488 1.438 0 O-C-N 121.269 -0.895 . . . . 1.65 109.785 -179.801 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 347' ' ' ALA . . . . . 0.496 ' HB1' ' HB1' ' B' ' 347' ' ' ALA . . . -60.34 -61.76 2.37 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.213 -0.929 . . . . 0.18 110.097 -179.728 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 348' ' ' LEU . . . . . 0.806 HD12 ' NH1' ' C' ' 337' ' ' ARG . 3.5 mm? -61.52 -47.43 85.63 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.165 -0.96 . . . . 0.3 109.857 -179.455 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 349' ' ' GLU . . . . . . . . . . . . . 3.3 mm-40 -56.21 -30.6 62.53 Favored 'General case' 0 C--N 1.301 -1.539 0 O-C-N 121.17 -0.956 . . . . 1.94 109.87 -179.307 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 350' ' ' LEU . . . . . 0.803 ' O ' HD23 ' A' ' 350' ' ' LEU . 4.0 tt -65.1 -45.1 86.58 Favored 'General case' 0 N--CA 1.488 1.463 0 O-C-N 121.217 -0.927 . . . . 0.46 109.621 -179.743 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 351' ' ' LYS . . . . . . . . . . . . . 28.5 tttt -59.94 -50.72 72.64 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.263 -0.898 . . . . 1.4 109.587 -179.836 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 352' ' ' ASP . . . . . . . . . . . . . 66.0 m-20 -55.8 -37.56 68.77 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.153 -0.967 . . . . 1.16 109.689 -179.848 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 353' ' ' ALA . . . . . . . . . . . . . . . -65.36 -35.65 81.6 Favored 'General case' 0 N--CA 1.488 1.467 0 O-C-N 121.269 -0.894 . . . . 0.63 109.492 -179.834 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 354' ' ' GLN . . . . . . . . . . . . . 3.7 tt0 -82.92 -11.19 58.38 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.287 -0.883 . . . . 1.47 109.353 179.839 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 355' ' ' ALA . . . . . . . . . . . . . . . -72.78 -30.72 64.33 Favored 'General case' 0 N--CA 1.488 1.474 0 O-C-N 121.153 -0.967 . . . . 1.01 109.429 179.936 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 356' ' ' GLY . . . . . . . . . . . . . . . -79.78 -6.84 88.91 Favored Glycine 0 N--CA 1.489 2.211 0 N-CA-C 109.562 -1.415 . . . . 1.3 109.562 -179.902 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 357' ' ' LYS . . . . . . . . . . . . . 28.8 mtpt -92.13 -11.76 34.78 Favored 'General case' 0 N--CA 1.488 1.443 0 O-C-N 121.22 -1.165 . . . . 4.1 109.201 179.691 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 358' ' ' GLU . . . . . 0.428 ' HG2' ' HD2' ' A' ' 359' ' ' PRO . 0.3 OUTLIER -54.78 128.16 62.42 Favored Pre-proline 0 N--CA 1.49 1.569 0 O-C-N 121.309 -0.87 . . . . 5.75 109.636 -179.814 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 359' ' ' PRO . . . . . 0.428 ' HD2' ' HG2' ' A' ' 358' ' ' GLU . 1.9 Cg_endo -64.51 110.55 1.44 Allowed 'Trans proline' 0 C--N 1.313 -1.326 0 C-N-CA 121.802 1.668 . . . . 5.0 109.637 179.478 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 360' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.196 0 N-CA-C 109.49 -1.444 . . . . 6.97 109.49 -179.987 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' B' B ' 319' ' ' LYS . . . . . . . . . . . . . 7.2 mttt . . . . . 0 N--CA 1.491 1.614 0 CA-C-O 121.218 0.532 . . . . 7.55 109.604 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' B' B ' 320' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 61.95 85.18 0.13 Allowed 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.276 -0.89 . . . . 6.44 109.41 179.89 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 321' ' ' LYS . . . . . . . . . . . . . 10.7 mtpt -157.94 98.03 1.86 Allowed Pre-proline 0 N--CA 1.489 1.522 0 O-C-N 121.215 -0.928 . . . . 6.13 109.225 179.953 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 322' ' ' PRO . . . . . . . . . . . . . 2.6 Cg_endo -61.69 -81.1 0.01 OUTLIER 'Trans proline' 0 C--N 1.312 -1.348 0 C-N-CA 121.997 1.798 . . . . 2.82 110.005 -179.92 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 323' ' ' LEU . . . . . . . . . . . . . 27.8 mt -81.96 112.24 18.87 Favored 'General case' 0 C--N 1.303 -1.437 0 O-C-N 121.008 -1.058 . . . . 2.84 109.145 179.674 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 324' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -80.2 -126.03 0.02 OUTLIER 'General case' 0 C--N 1.304 -1.408 0 O-C-N 121.179 -0.951 . . . . 1.53 109.3 -179.882 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 325' ' ' GLY . . . . . 0.45 ' O ' ' CE1' ' B' ' 327' ' ' TYR . . . -69.54 -166.15 4.98 Favored Glycine 0 N--CA 1.49 2.285 0 N-CA-C 109.877 -1.289 . . . . 0.59 109.877 -179.841 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 326' ' ' GLU . . . . . 0.425 ' HB3' ' CE1' ' B' ' 328' ' ' PHE . 70.8 mm-40 -59.19 -179.39 0.07 Allowed 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.255 -1.144 . . . . 2.13 109.535 -179.868 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 327' ' ' TYR . . . . . 0.59 ' CE2' ' HG3' ' D' ' 333' ' ' ARG . 45.8 m-85 -150.15 109.46 3.96 Favored 'General case' 0 N--CA 1.487 1.421 0 O-C-N 121.274 -0.891 . . . . 0.48 108.851 179.769 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 328' ' ' PHE . . . . . 0.442 ' HB2' ' CD1' ' D' ' 338' ' ' PHE . 53.0 m-85 -111.84 -167.44 1.18 Allowed 'General case' 0 N--CA 1.488 1.473 0 O-C-N 121.326 -0.859 . . . . 0.32 109.666 -179.635 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 329' ' ' THR . . . . . . . . . . . . . 59.1 p -152.28 163.64 39.04 Favored 'General case' 0 C--N 1.302 -1.477 0 O-C-N 121.389 -0.82 . . . . 0.23 109.144 -179.889 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 330' ' ' LEU . . . . . . . . . . . . . 17.3 tp -150.12 131.68 14.84 Favored 'General case' 0 N--CA 1.488 1.46 0 O-C-N 121.166 -0.958 . . . . 0.28 109.743 -179.84 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 331' ' ' GLN . . . . . . . . . . . . . 1.4 tt0 -85.77 116.78 24.24 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.373 -0.829 . . . . 0.91 108.906 179.587 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 332' ' ' ILE . . . . . 0.79 HG21 ' HA ' ' B' ' 338' ' ' PHE . 85.1 mt -101.97 104.04 15.83 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.489 0 O-C-N 121.207 -0.933 . . . . 0.24 109.513 -179.573 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 333' ' ' ARG . . . . . 0.518 ' HG3' ' CE2' ' D' ' 327' ' ' TYR . 4.1 mpt_? -71.21 150.48 45.27 Favored 'General case' 0 C--N 1.305 -1.365 0 O-C-N 121.255 -0.903 . . . . 2.93 109.011 179.746 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 334' ' ' GLY . . . . . . . . . . . . . . . 77.58 126.17 0.33 Allowed Glycine 0 N--CA 1.489 2.175 0 N-CA-C 109.388 -1.485 . . . . 0.4 109.388 -179.986 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 335' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -75.22 -36.91 61.32 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.413 -1.051 . . . . 3.01 109.608 -179.727 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 336' ' ' GLU . . . . . . . . . . . . . 38.7 mt-10 -56.96 -57.49 12.29 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.39 -0.819 . . . . 2.28 110.069 -179.593 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 337' ' ' ARG . . . . . . . . . . . . . 17.0 mmt180 -62.38 -29.24 70.34 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.229 -0.919 . . . . 2.93 109.877 -179.635 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 338' ' ' PHE . . . . . 0.79 ' HA ' HG21 ' B' ' 332' ' ' ILE . 44.5 t80 -56.57 -59.94 4.27 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.26 -0.9 . . . . 0.37 110.121 -179.692 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 339' ' ' GLU . . . . . . . . . . . . . 4.2 mt-10 -51.98 -33.44 38.0 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.238 -0.914 . . . . 1.98 110.102 -179.347 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 340' ' ' MET . . . . . . . . . . . . . 31.8 ttp -63.89 -49.68 71.74 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.066 -1.021 . . . . 0.32 109.822 -179.578 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 341' ' ' PHE . . . . . . . . . . . . . 35.4 m-85 -62.31 -44.28 96.87 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.163 -0.961 . . . . 0.18 110.04 -179.54 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 342' ' ' ARG . . . . . 0.474 ' NH1' ' HG2' ' B' ' 342' ' ' ARG . 0.1 OUTLIER -49.33 -44.62 44.58 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.283 -0.886 . . . . 2.42 110.096 -179.576 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 343' ' ' GLU . . . . . . . . . . . . . 4.6 tt0 -58.18 -47.27 83.92 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.196 -0.94 . . . . 2.35 109.914 -179.393 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 344' ' ' LEU . . . . . . . . . . . . . 50.3 mt -62.11 -31.68 72.16 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.309 -0.87 . . . . 0.18 109.954 -179.825 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 345' ' ' ASN . . . . . 0.49 ' HA ' ' CZ ' ' D' ' 341' ' ' PHE . 17.0 t-20 -57.43 -60.48 3.58 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.232 -0.918 . . . . 1.09 109.849 -179.683 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 346' ' ' GLU . . . . . . . . . . . . . 4.0 tt0 -61.1 -24.61 66.37 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.304 -0.872 . . . . 1.66 109.791 -179.655 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 347' ' ' ALA . . . . . 0.496 ' HB1' ' HB1' ' A' ' 347' ' ' ALA . . . -60.18 -61.86 2.29 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.147 -0.971 . . . . 0.17 110.016 -179.7 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 348' ' ' LEU . . . . . 0.589 HD22 ' N ' ' B' ' 348' ' ' LEU . 3.5 mm? -61.3 -47.73 84.61 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.234 -0.916 . . . . 0.29 109.917 -179.418 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 349' ' ' GLU . . . . . . . . . . . . . 3.6 mm-40 -56.25 -30.3 62.21 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.174 -0.954 . . . . 1.95 109.825 -179.383 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 350' ' ' LEU . . . . . 0.756 ' O ' HD23 ' B' ' 350' ' ' LEU . 4.2 tt -65.17 -45.95 82.79 Favored 'General case' 0 N--CA 1.489 1.492 0 O-C-N 121.116 -0.99 . . . . 0.45 109.328 179.912 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 351' ' ' LYS . . . . . . . . . . . . . 29.3 tttt -59.33 -51.5 69.69 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.233 -0.917 . . . . 1.38 109.646 -179.898 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 352' ' ' ASP . . . . . . . . . . . . . 67.3 m-20 -55.35 -37.62 67.72 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.236 -0.915 . . . . 1.16 109.748 -179.757 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 353' ' ' ALA . . . . . . . . . . . . . . . -65.68 -34.94 79.37 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.377 -0.827 . . . . 0.61 109.403 -179.581 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 354' ' ' GLN . . . . . . . . . . . . . 4.1 tt0 -83.46 -11.79 57.1 Favored 'General case' 0 N--CA 1.487 1.421 0 O-C-N 121.201 -0.937 . . . . 1.45 109.225 179.775 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 355' ' ' ALA . . . . . . . . . . . . . . . -72.03 -31.28 66.02 Favored 'General case' 0 N--CA 1.488 1.467 0 O-C-N 121.07 -1.019 . . . . 0.98 109.419 179.999 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 356' ' ' GLY . . . . . . . . . . . . . . . -79.22 -6.88 88.78 Favored Glycine 0 N--CA 1.49 2.263 0 N-CA-C 109.504 -1.438 . . . . 1.29 109.504 -179.97 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 357' ' ' LYS . . . . . . . . . . . . . 27.6 mtpt -90.66 -12.52 36.53 Favored 'General case' 0 N--CA 1.489 1.482 0 O-C-N 121.137 -1.213 . . . . 4.09 109.134 179.578 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 358' ' ' GLU . . . . . 0.435 ' HG2' ' HD2' ' B' ' 359' ' ' PRO . 0.3 OUTLIER -54.19 127.5 55.86 Favored Pre-proline 0 N--CA 1.49 1.556 0 O-C-N 121.372 -0.83 . . . . 5.72 109.787 -179.842 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 359' ' ' PRO . . . . . 0.435 ' HD2' ' HG2' ' B' ' 358' ' ' GLU . 1.7 Cg_endo -64.83 110.79 1.54 Allowed 'Trans proline' 0 C--N 1.312 -1.395 0 C-N-CA 122.123 1.882 . . . . 4.98 109.649 179.37 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 360' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.272 0 CA-C-O 117.873 -1.515 . . . . 6.98 109.571 -179.954 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' C' C ' 319' ' ' LYS . . . . . . . . . . . . . 6.4 mttm . . . . . 0 N--CA 1.493 1.677 0 N-CA-C 109.354 -0.61 . . . . 6.82 109.354 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' C' C ' 320' ' ' LYS . . . . . . . . . . . . . 1.5 tttt 67.72 94.62 0.07 Allowed 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.206 -0.934 . . . . 6.49 109.934 179.399 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 321' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -161.98 93.03 1.34 Allowed Pre-proline 0 N--CA 1.49 1.565 0 O-C-N 121.271 -0.893 . . . . 6.4 109.462 179.787 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' C' C ' 322' ' ' PRO . . . . . . . . . . . . . 3.5 Cg_exo -60.06 111.0 0.86 Allowed 'Trans proline' 0 C--N 1.309 -1.543 0 C-N-CA 122.034 1.823 . . . . 3.42 110.271 179.731 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 323' ' ' LEU . . . . . . . . . . . . . 45.1 mt -80.86 119.91 24.03 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.401 -0.812 . . . . 3.95 109.08 179.966 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 324' ' ' ASP . . . . . . . . . . . . . 15.6 m-20 -83.94 31.26 0.49 Allowed 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.196 -0.94 . . . . 1.63 110.034 -179.949 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 325' ' ' GLY . . . . . 0.579 ' O ' ' CD2' ' C' ' 327' ' ' TYR . . . -67.1 167.36 39.41 Favored Glycine 0 N--CA 1.487 2.074 0 N-CA-C 108.427 -1.869 . . . . 0.73 108.427 179.634 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' C' C ' 326' ' ' GLU . . . . . 0.424 ' HB3' ' CE1' ' C' ' 328' ' ' PHE . 3.0 mm-40 -56.71 162.17 2.44 Favored 'General case' 0 C--N 1.302 -1.488 0 O-C-N 120.885 -1.362 . . . . 2.17 108.972 -179.729 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' C' C ' 327' ' ' TYR . . . . . 0.601 ' CD1' ' HG3' ' A' ' 333' ' ' ARG . 42.2 m-85 -146.82 100.54 3.33 Favored 'General case' 0 C--N 1.302 -1.5 0 O-C-N 121.238 -0.914 . . . . 0.48 108.973 -179.885 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' C' C ' 328' ' ' PHE . . . . . 0.424 ' CE1' ' HB3' ' C' ' 326' ' ' GLU . 87.6 m-85 -103.2 -166.41 1.27 Allowed 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.278 -0.889 . . . . 0.33 109.711 -179.449 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' C' C ' 329' ' ' THR . . . . . 0.435 ' HA ' ' O ' ' A' ' 330' ' ' LEU . 24.7 p -152.97 161.44 42.53 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.413 -0.804 . . . . 0.23 109.014 -179.865 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' C' C ' 330' ' ' LEU . . . . . . . . . . . . . 17.2 tp -149.95 133.42 16.57 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.158 -0.963 . . . . 0.28 109.508 -179.525 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 331' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -87.72 116.22 25.7 Favored 'General case' 0 N--CA 1.488 1.47 0 O-C-N 121.352 -0.843 . . . . 1.48 109.36 179.802 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' C' C ' 332' ' ' ILE . . . . . 0.806 HG21 ' HA ' ' C' ' 338' ' ' PHE . 15.1 mt -104.24 104.76 17.3 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.68 0 O-C-N 121.247 -0.908 . . . . 0.24 109.607 179.961 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' C' C ' 333' ' ' ARG . . . . . 0.604 ' HG2' ' CE2' ' A' ' 327' ' ' TYR . 0.7 OUTLIER -73.04 143.38 47.52 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.392 -0.817 . . . . 2.74 109.423 179.582 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' C' C ' 334' ' ' GLY . . . . . . . . . . . . . . . 80.63 131.61 1.06 Allowed Glycine 0 N--CA 1.495 2.623 0 N-CA-C 109.722 -1.351 . . . . 0.35 109.722 179.848 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 335' ' ' ARG . . . . . 0.522 ' HG2' ' NH1' ' C' ' 335' ' ' ARG . 0.0 OUTLIER -79.48 -32.75 42.58 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.241 -1.152 . . . . 2.53 109.725 179.975 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' C' C ' 336' ' ' GLU . . . . . . . . . . . . . 49.2 mt-10 -55.55 -61.97 2.0 Allowed 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.238 -0.914 . . . . 2.62 109.208 -179.737 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 337' ' ' ARG . . . . . 0.806 ' NH1' HD12 ' A' ' 348' ' ' LEU . 30.5 mmt180 -61.98 -28.56 69.65 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.192 -0.942 . . . . 2.81 109.493 179.737 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' C' C ' 338' ' ' PHE . . . . . 0.806 ' HA ' HG21 ' C' ' 332' ' ' ILE . 86.4 t80 -54.94 -61.22 2.46 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.361 -0.837 . . . . 0.4 110.135 -179.552 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' C' C ' 339' ' ' GLU . . . . . . . . . . . . . 50.1 mt-10 -51.2 -34.2 30.86 Favored 'General case' 0 N--CA 1.495 1.787 0 O-C-N 121.257 -0.902 . . . . 2.05 109.777 -179.836 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 340' ' ' MET . . . . . . . . . . . . . 33.0 ttp -62.66 -50.77 69.89 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.316 -0.865 . . . . 0.32 109.791 -179.492 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 341' ' ' PHE . . . . . 0.464 ' CZ ' ' HA ' ' A' ' 345' ' ' ASN . 50.7 m-85 -61.11 -42.52 98.67 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.025 -1.047 . . . . 0.18 109.89 -179.772 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' C' C ' 342' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -52.35 -46.11 65.99 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.025 -1.047 . . . . 2.91 109.782 179.984 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' C' C ' 343' ' ' GLU . . . . . . . . . . . . . 9.4 tt0 -57.12 -49.14 76.81 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.225 -0.922 . . . . 2.14 109.835 -179.528 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 344' ' ' LEU . . . . . . . . . . . . . 85.4 mt -62.25 -28.06 69.44 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.292 -0.88 . . . . 0.22 109.552 179.945 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 345' ' ' ASN . . . . . 0.519 ' HA ' ' CZ ' ' A' ' 341' ' ' PHE . 24.8 t-20 -58.74 -63.21 1.37 Allowed 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.425 -0.797 . . . . 1.08 110.303 -179.422 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' C' C ' 346' ' ' GLU . . . . . 0.44 ' O ' ' HB2' ' C' ' 350' ' ' LEU . 17.9 tt0 -61.66 -21.77 64.71 Favored 'General case' 0 C--N 1.301 -1.509 0 O-C-N 121.3 -0.875 . . . . 2.21 109.948 -179.444 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' C' C ' 347' ' ' ALA . . . . . 0.454 ' HB1' ' HB1' ' D' ' 347' ' ' ALA . . . -61.67 -58.43 8.08 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.004 -1.06 . . . . 0.18 110.214 -179.617 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' C' C ' 348' ' ' LEU . . . . . 0.644 HD12 ' NH1' ' A' ' 337' ' ' ARG . 3.4 mm? -63.47 -53.94 44.26 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.071 -1.018 . . . . 0.32 110.344 -179.214 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' C' C ' 349' ' ' GLU . . . . . . . . . . . . . 1.9 mp0 -57.22 -26.84 61.37 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.002 -1.061 . . . . 2.19 109.735 -179.472 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 350' ' ' LEU . . . . . 0.99 ' CD2' HD13 ' D' ' 350' ' ' LEU . 7.7 tt -65.12 -46.7 79.92 Favored 'General case' 0 N--CA 1.488 1.453 0 O-C-N 121.015 -1.053 . . . . 0.46 109.165 179.666 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' C' C ' 351' ' ' LYS . . . . . 0.414 ' N ' HD23 ' C' ' 350' ' ' LEU . 42.1 tttt -61.19 -43.63 98.58 Favored 'General case' 0 N--CA 1.488 1.438 0 O-C-N 121.385 -0.822 . . . . 1.35 109.473 179.924 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' C' C ' 352' ' ' ASP . . . . . . . . . . . . . 2.9 m-20 -56.28 -47.79 77.9 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.264 -0.898 . . . . 1.19 109.655 -179.95 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 353' ' ' ALA . . . . . . . . . . . . . . . -67.6 -19.17 65.2 Favored 'General case' 0 N--CA 1.489 1.499 0 O-C-N 121.189 -0.944 . . . . 0.57 109.424 -179.934 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 354' ' ' GLN . . . . . 0.575 ' NE2' HD11 ' D' ' 350' ' ' LEU . 1.5 tt0 -83.26 -12.91 56.26 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.199 -0.938 . . . . 1.47 109.525 179.988 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' C' C ' 355' ' ' ALA . . . . . . . . . . . . . . . -71.38 -46.34 60.58 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.334 -0.854 . . . . 0.93 109.199 179.808 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 356' ' ' GLY . . . . . . . . . . . . . . . -80.99 -10.73 84.63 Favored Glycine 0 N--CA 1.486 2.011 0 N-CA-C 109.612 -1.395 . . . . 1.33 109.612 -179.895 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 357' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -87.93 87.57 7.39 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.178 -1.189 . . . . 4.01 108.834 179.668 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' C' C ' 358' ' ' GLU . . . . . . . . . . . . . 94.5 mt-10 -54.84 154.3 9.81 Favored Pre-proline 0 N--CA 1.487 1.387 0 O-C-N 121.503 -0.748 . . . . 5.75 109.786 -179.767 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 359' ' ' PRO . . . . . . . . . . . . . 2.1 Cg_endo -63.01 126.83 18.82 Favored 'Trans proline' 0 C--N 1.308 -1.596 0 C-N-CA 122.034 1.822 . . . . 4.94 110.037 179.65 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 360' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.223 0 CA-C-O 118.031 -1.427 . . . . 6.5 109.629 179.954 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' D' D ' 319' ' ' LYS . . . . . . . . . . . . . 7.8 mttt . . . . . 0 N--CA 1.491 1.604 0 CA-C-O 121.378 0.609 . . . . 7.53 109.422 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' D' D ' 320' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 60.43 85.44 0.11 Allowed 'General case' 0 N--CA 1.488 1.47 0 O-C-N 121.373 -0.83 . . . . 6.41 109.737 179.879 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' D' D ' 321' ' ' LYS . . . . . . . . . . . . . 8.5 mtpt -157.48 97.65 1.97 Allowed Pre-proline 0 N--CA 1.492 1.629 0 O-C-N 121.298 -0.876 . . . . 6.11 109.332 179.994 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' D' D ' 322' ' ' PRO . . . . . . . . . . . . . 2.5 Cg_endo -61.35 -81.59 0.01 OUTLIER 'Trans proline' 0 C--N 1.311 -1.436 0 C-N-CA 121.841 1.694 . . . . 2.82 109.877 -179.936 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' D' D ' 323' ' ' LEU . . . . . . . . . . . . . 28.0 mt -81.57 111.64 18.05 Favored 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.184 -0.947 . . . . 2.83 109.501 179.681 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' D' D ' 324' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -79.54 -126.89 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.32 -0.862 . . . . 1.54 109.652 -179.849 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' D' D ' 325' ' ' GLY . . . . . 0.451 ' O ' ' CE1' ' D' ' 327' ' ' TYR . . . -69.44 -166.47 5.03 Favored Glycine 0 N--CA 1.49 2.272 0 N-CA-C 109.648 -1.381 . . . . 0.59 109.648 -179.846 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' D' D ' 326' ' ' GLU . . . . . 0.433 ' O ' ' CD1' ' D' ' 327' ' ' TYR . 71.8 mm-40 -58.95 -179.45 0.07 Allowed 'General case' 0 N--CA 1.488 1.437 0 O-C-N 121.372 -1.076 . . . . 2.13 109.617 -179.863 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' D' D ' 327' ' ' TYR . . . . . 0.518 ' CE2' ' HG3' ' B' ' 333' ' ' ARG . 47.4 m-85 -150.12 109.49 3.98 Favored 'General case' 0 C--N 1.302 -1.5 0 O-C-N 121.276 -0.89 . . . . 0.47 109.082 179.817 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' D' D ' 328' ' ' PHE . . . . . 0.417 ' CE1' ' HB3' ' D' ' 326' ' ' GLU . 52.0 m-85 -111.35 -166.71 1.1 Allowed 'General case' 0 N--CA 1.488 1.472 0 O-C-N 121.398 -0.814 . . . . 0.3 109.623 -179.674 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' D' D ' 329' ' ' THR . . . . . . . . . . . . . 66.4 p -152.56 163.33 39.8 Favored 'General case' 0 N--CA 1.488 1.425 0 O-C-N 121.34 -0.85 . . . . 0.22 108.843 179.991 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' D' D ' 330' ' ' LEU . . . . . . . . . . . . . 17.7 tp -149.85 131.35 14.8 Favored 'General case' 0 C--N 1.301 -1.507 0 O-C-N 121.158 -0.964 . . . . 0.28 109.655 -179.702 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' D' D ' 331' ' ' GLN . . . . . . . . . . . . . 1.5 tt0 -86.0 116.66 24.36 Favored 'General case' 0 C--N 1.303 -1.433 0 O-C-N 121.347 -0.846 . . . . 0.93 108.804 179.593 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' D' D ' 332' ' ' ILE . . . . . 0.774 HG21 ' HA ' ' D' ' 338' ' ' PHE . 80.4 mt -102.4 103.68 15.36 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.452 0 O-C-N 121.344 -0.848 . . . . 0.25 109.572 -179.545 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' D' D ' 333' ' ' ARG . . . . . 0.59 ' HG3' ' CE2' ' B' ' 327' ' ' TYR . 4.5 mpt_? -70.64 151.22 45.2 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.282 -0.886 . . . . 2.93 109.294 179.731 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' D' D ' 334' ' ' GLY . . . . . . . . . . . . . . . 77.07 126.77 0.29 Allowed Glycine 0 N--CA 1.489 2.199 0 N-CA-C 109.389 -1.485 . . . . 0.41 109.389 -179.953 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' D' D ' 335' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -75.68 -36.83 59.96 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.426 -1.043 . . . . 3.03 109.56 -179.815 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' D' D ' 336' ' ' GLU . . . . . . . . . . . . . 43.8 mt-10 -56.8 -58.77 6.67 Favored 'General case' 0 C--N 1.301 -1.505 0 O-C-N 121.281 -0.887 . . . . 2.26 109.778 -179.633 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' D' D ' 337' ' ' ARG . . . . . 0.475 ' CZ ' HD12 ' B' ' 348' ' ' LEU . 16.9 mmt180 -60.94 -28.94 69.33 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.195 -0.941 . . . . 2.92 110.196 -179.578 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' D' D ' 338' ' ' PHE . . . . . 0.774 ' HA ' HG21 ' D' ' 332' ' ' ILE . 40.5 t80 -57.22 -60.29 3.83 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.261 -0.899 . . . . 0.37 110.081 -179.45 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' D' D ' 339' ' ' GLU . . . . . . . . . . . . . 5.3 mt-10 -51.89 -33.0 34.8 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.328 -0.858 . . . . 1.99 110.218 -179.203 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' D' D ' 340' ' ' MET . . . . . . . . . . . . . 30.2 ttp -63.96 -49.94 70.6 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.065 -1.022 . . . . 0.31 109.755 -179.659 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' D' D ' 341' ' ' PHE . . . . . 0.49 ' CZ ' ' HA ' ' B' ' 345' ' ' ASN . 36.2 m-85 -61.97 -43.96 97.74 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.314 -0.866 . . . . 0.18 110.106 -179.721 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' D' D ' 342' ' ' ARG . . . . . 0.493 ' NH1' ' HG2' ' D' ' 342' ' ' ARG . 0.1 OUTLIER -49.32 -44.54 44.49 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.401 -0.812 . . . . 2.41 110.042 -179.54 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' D' D ' 343' ' ' GLU . . . . . . . . . . . . . 4.4 tt0 -58.49 -47.85 82.73 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.247 -0.908 . . . . 2.35 109.949 -179.448 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' D' D ' 344' ' ' LEU . . . . . . . . . . . . . 47.3 mt -61.58 -32.03 72.11 Favored 'General case' 0 N--CA 1.489 1.493 0 O-C-N 121.065 -1.022 . . . . 0.19 109.979 -179.66 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' D' D ' 345' ' ' ASN . . . . . . . . . . . . . 16.3 t-20 -57.09 -60.39 3.66 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.23 -0.919 . . . . 1.09 109.85 -179.538 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' D' D ' 346' ' ' GLU . . . . . . . . . . . . . 3.9 tt0 -61.09 -24.71 66.44 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.391 -0.818 . . . . 1.69 109.699 -179.549 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' D' D ' 347' ' ' ALA . . . . . 0.454 ' HB1' ' HB1' ' C' ' 347' ' ' ALA . . . -60.15 -61.7 2.41 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.162 -0.961 . . . . 0.18 110.058 -179.719 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' D' D ' 348' ' ' LEU . . . . . 0.606 HD22 ' N ' ' D' ' 348' ' ' LEU . 3.5 mm? -61.4 -47.72 84.52 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.144 -0.972 . . . . 0.31 110.219 -179.616 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' D' D ' 349' ' ' GLU . . . . . . . . . . . . . 3.5 mm-40 -56.71 -29.81 62.84 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.131 -0.981 . . . . 1.95 109.723 -179.327 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' D' D ' 350' ' ' LEU . . . . . 0.99 HD13 ' CD2' ' C' ' 350' ' ' LEU . 4.3 tt -64.95 -45.92 83.75 Favored 'General case' 0 N--CA 1.488 1.469 0 O-C-N 121.252 -0.905 . . . . 0.43 109.368 179.947 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' D' D ' 351' ' ' LYS . . . . . . . . . . . . . 29.3 tttt -60.04 -51.62 68.85 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.504 -0.748 . . . . 1.4 109.584 179.959 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' D' D ' 352' ' ' ASP . . . . . . . . . . . . . 69.3 m-20 -55.3 -38.04 68.13 Favored 'General case' 0 N--CA 1.489 1.48 0 O-C-N 121.343 -0.848 . . . . 1.17 109.382 -179.916 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' D' D ' 353' ' ' ALA . . . . . . . . . . . . . . . -65.17 -35.17 80.24 Favored 'General case' 0 N--CA 1.489 1.489 0 O-C-N 121.146 -0.971 . . . . 0.59 109.552 -179.998 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' D' D ' 354' ' ' GLN . . . . . . . . . . . . . 4.1 tt0 -83.51 -11.24 57.68 Favored 'General case' 0 N--CA 1.488 1.457 0 O-C-N 121.151 -0.968 . . . . 1.44 109.557 -179.944 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' D' D ' 355' ' ' ALA . . . . . . . . . . . . . . . -72.08 -31.99 66.61 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.261 -0.9 . . . . 0.98 109.479 179.832 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' D' D ' 356' ' ' GLY . . . . . . . . . . . . . . . -78.71 -7.31 88.25 Favored Glycine 0 N--CA 1.49 2.293 0 N-CA-C 109.588 -1.405 . . . . 1.28 109.588 -179.93 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' D' D ' 357' ' ' LYS . . . . . . . . . . . . . 27.0 mtpt -90.66 -11.74 38.91 Favored 'General case' 0 N--CA 1.489 1.499 0 O-C-N 121.234 -1.157 . . . . 4.09 108.98 179.465 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' D' D ' 358' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -54.92 126.38 59.05 Favored Pre-proline 0 N--CA 1.488 1.466 0 O-C-N 121.299 -0.876 . . . . 5.71 109.535 -179.99 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' D' D ' 359' ' ' PRO . . . . . . . . . . . . . 1.7 Cg_endo -64.13 111.55 1.62 Allowed 'Trans proline' 0 C--N 1.313 -1.307 0 C-N-CA 121.967 1.778 . . . . 4.97 109.666 179.567 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' D' D ' 360' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.19 0 CA-C-O 118.038 -1.423 . . . . 6.97 109.746 -179.92 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 319' ' ' LYS . . . . . 0.418 ' O ' ' HB2' ' A' ' 320' ' ' LYS . 0.9 OUTLIER . . . . . 0 N--CA 1.488 1.461 0 N-CA-C 109.454 -0.573 . . . . 7.55 109.454 . . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 320' ' ' LYS . . . . . 0.418 ' HB2' ' O ' ' A' ' 319' ' ' LYS . 35.2 mttp 60.47 -88.72 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.277 -0.89 . . . . 6.43 109.752 179.757 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 321' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -156.83 76.58 4.24 Favored Pre-proline 0 N--CA 1.492 1.669 0 O-C-N 121.121 -0.987 . . . . 6.13 109.389 179.854 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 322' ' ' PRO . . . . . . . . . . . . . 2.9 Cg_endo -62.33 110.41 1.04 Allowed 'Trans proline' 0 C--N 1.309 -1.526 0 C-N-CA 122.335 2.023 . . . . 2.83 110.319 -179.779 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 323' ' ' LEU . . . . . . . . . . . . . 36.4 mt -82.64 111.82 18.96 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.314 -0.866 . . . . 2.83 109.317 179.841 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 324' ' ' ASP . . . . . . . . . . . . . 32.5 m-20 -80.46 107.56 13.36 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.087 -1.008 . . . . 1.53 109.41 179.856 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 325' ' ' GLY . . . . . 0.552 ' O ' ' CD2' ' A' ' 327' ' ' TYR . . . -68.11 -169.41 5.01 Favored Glycine 0 N--CA 1.49 2.299 0 N-CA-C 109.512 -1.435 . . . . 0.61 109.512 -179.961 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 326' ' ' GLU . . . . . 0.453 ' HB3' ' CE2' ' A' ' 328' ' ' PHE . 43.5 mm-40 -59.18 163.93 3.44 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.261 -1.14 . . . . 2.13 109.093 179.941 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 327' ' ' TYR . . . . . 0.611 ' CE1' ' HG2' ' C' ' 333' ' ' ARG . 41.2 m-85 -149.69 104.83 3.37 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.169 -0.957 . . . . 0.48 109.428 -179.894 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 328' ' ' PHE . . . . . 0.453 ' CE2' ' HB3' ' A' ' 326' ' ' GLU . 88.9 m-85 -111.46 -166.19 1.06 Allowed 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.419 -0.801 . . . . 0.31 109.576 -179.72 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 329' ' ' THR . . . . . 0.404 ' HA ' ' O ' ' C' ' 330' ' ' LEU . 33.5 p -153.61 160.92 42.56 Favored 'General case' 0 N--CA 1.488 1.435 0 O-C-N 121.451 -0.781 . . . . 0.22 108.923 -179.826 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 330' ' ' LEU . . . . . 0.59 HD11 HD22 ' C' ' 345' ' ' ASN . 25.9 tp -150.78 129.84 12.62 Favored 'General case' 0 N--CA 1.488 1.465 0 O-C-N 121.167 -0.958 . . . . 0.28 109.738 -179.611 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 331' ' ' GLN . . . . . . . . . . . . . 1.3 tt0 -88.82 113.81 24.77 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.22 -0.925 . . . . 0.91 109.189 179.732 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 332' ' ' ILE . . . . . 0.478 HD12 ' CD1' ' A' ' 338' ' ' PHE . 38.5 mt -103.41 111.76 34.35 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.505 0 O-C-N 121.08 -1.013 . . . . 0.26 109.911 -179.864 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 333' ' ' ARG . . . . . 0.594 ' CG ' ' CE1' ' C' ' 327' ' ' TYR . 0.0 OUTLIER -73.12 149.28 43.17 Favored 'General case' 0 C--N 1.302 -1.47 0 O-C-N 121.27 -0.894 . . . . 2.92 109.488 179.725 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 334' ' ' GLY . . . . . . . . . . . . . . . 84.77 132.57 2.53 Favored Glycine 0 N--CA 1.49 2.259 0 N-CA-C 109.514 -1.434 . . . . 0.4 109.514 -179.917 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 335' ' ' ARG . . . . . . . . . . . . . 36.0 ttt180 -78.92 -42.48 26.98 Favored 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.199 -1.177 . . . . 3.01 109.59 -179.83 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 336' ' ' GLU . . . . . . . . . . . . . 3.5 pt-20 -57.22 -53.08 62.14 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.232 -0.917 . . . . 2.29 110.115 -179.589 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 337' ' ' ARG . . . . . 0.604 ' CZ ' HD12 ' C' ' 348' ' ' LEU . 12.6 mmt180 -61.97 -34.81 76.82 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 120.97 -1.081 . . . . 2.93 109.809 -179.754 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 338' ' ' PHE . . . . . 0.478 ' CD1' HD12 ' A' ' 332' ' ' ILE . 80.8 t80 -55.32 -57.55 11.36 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.173 -0.955 . . . . 0.38 109.802 -179.711 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 339' ' ' GLU . . . . . . . . . . . . . 44.1 mt-10 -51.43 -36.09 42.29 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.224 -0.923 . . . . 1.97 110.425 -179.681 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 340' ' ' MET . . . . . . . . . . . . . 47.1 ttp -62.44 -48.57 79.08 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.119 -0.988 . . . . 0.31 109.808 -179.448 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 341' ' ' PHE . . . . . 0.434 ' CZ ' ' HA ' ' C' ' 345' ' ' ASN . 43.3 m-85 -62.55 -47.81 82.24 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.128 -0.982 . . . . 0.18 109.982 -179.614 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 342' ' ' ARG . . . . . . . . . . . . . 19.7 ttt180 -49.23 -42.32 40.18 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.316 -0.865 . . . . 2.42 110.21 -179.496 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 343' ' ' GLU . . . . . . . . . . . . . 4.2 tp10 -58.89 -49.05 79.24 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.143 -0.973 . . . . 2.35 109.921 -179.611 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 344' ' ' LEU . . . . . 0.569 HD22 ' CD2' ' B' ' 344' ' ' LEU . 37.1 mt -61.34 -31.56 71.43 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.217 -0.927 . . . . 0.18 109.76 -179.568 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 345' ' ' ASN . . . . . . . . . . . . . 62.4 t-20 -57.36 -54.3 48.4 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.295 -0.878 . . . . 1.09 109.698 -179.717 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 346' ' ' GLU . . . . . . . . . . . . . 6.0 tp10 -62.62 -27.74 69.41 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.331 -0.855 . . . . 1.65 110.097 -179.661 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 347' ' ' ALA . . . . . 0.891 ' HB1' ' HB1' ' B' ' 347' ' ' ALA . . . -61.85 -58.82 6.5 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.217 -0.927 . . . . 0.18 110.025 -179.609 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 348' ' ' LEU . . . . . 0.583 HD22 ' N ' ' A' ' 348' ' ' LEU . 3.8 mm? -60.72 -48.53 81.37 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.119 -0.988 . . . . 0.3 110.053 -179.304 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 349' ' ' GLU . . . . . 0.452 ' OE1' ' NH1' ' C' ' 333' ' ' ARG . 43.4 mt-10 -56.98 -33.13 66.79 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.155 -0.966 . . . . 1.94 109.533 -179.47 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 350' ' ' LEU . . . . . 0.817 ' O ' HD23 ' A' ' 350' ' ' LEU . 3.9 tt -63.96 -45.34 89.59 Favored 'General case' 0 C--N 1.302 -1.469 0 O-C-N 121.269 -0.895 . . . . 0.46 109.182 179.887 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 351' ' ' LYS . . . . . . . . . . . . . 9.5 tttp -60.5 -45.33 94.19 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.279 -0.888 . . . . 1.4 109.624 179.858 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 352' ' ' ASP . . . . . . . . . . . . . 7.0 m-20 -55.19 -37.56 67.23 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.233 -0.917 . . . . 1.16 109.633 -179.844 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 353' ' ' ALA . . . . . . . . . . . . . . . -66.08 -30.29 70.78 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.228 -0.92 . . . . 0.63 109.702 -179.795 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 354' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -82.73 -5.61 58.98 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.239 -0.913 . . . . 1.47 109.727 -179.954 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 355' ' ' ALA . . . . . . . . . . . . . . . -71.45 -5.69 34.77 Favored 'General case' 0 N--CA 1.488 1.465 0 O-C-N 121.251 -0.905 . . . . 1.01 109.605 -179.887 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 356' ' ' GLY . . . . . . . . . . . . . . . -79.95 2.06 76.61 Favored Glycine 0 N--CA 1.492 2.377 0 N-CA-C 109.682 -1.367 . . . . 1.3 109.682 179.936 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 357' ' ' LYS . . . . . . . . . . . . . 1.5 mtpp -86.25 103.81 15.2 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.146 -1.208 . . . . 4.1 109.635 -179.823 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 358' ' ' GLU . . . . . 0.575 ' N ' ' HD2' ' A' ' 359' ' ' PRO . 3.6 tt0 -50.84 -53.56 46.04 Favored Pre-proline 0 N--CA 1.491 1.6 0 O-C-N 121.385 -0.822 . . . . 5.75 109.787 179.855 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 359' ' ' PRO . . . . . 0.575 ' HD2' ' N ' ' A' ' 358' ' ' GLU . 2.8 Cg_endo -61.1 -48.29 10.49 Favored 'Trans proline' 0 C--N 1.313 -1.304 0 C-N-CA 121.586 1.524 . . . . 5.0 110.108 -179.879 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 360' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.228 0 N-CA-C 109.527 -1.429 . . . . 6.97 109.527 -179.901 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' B' B ' 319' ' ' LYS . . . . . 0.405 ' O ' ' HB2' ' B' ' 320' ' ' LYS . 1.0 OUTLIER . . . . . 0 N--CA 1.49 1.557 0 N-CA-C 109.422 -0.584 . . . . 7.55 109.422 . . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 320' ' ' LYS . . . . . 0.405 ' HB2' ' O ' ' B' ' 319' ' ' LYS . 33.6 mttp 60.33 -89.14 0.03 OUTLIER 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.256 -0.903 . . . . 6.44 109.715 179.937 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 321' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -156.83 76.97 4.18 Favored Pre-proline 0 N--CA 1.49 1.537 0 O-C-N 121.352 -0.842 . . . . 6.13 109.4 179.981 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 322' ' ' PRO . . . . . . . . . . . . . 2.3 Cg_endo -62.71 110.0 1.01 Allowed 'Trans proline' 0 C--N 1.311 -1.404 0 C-N-CA 122.353 2.035 . . . . 2.82 110.423 -179.775 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 323' ' ' LEU . . . . . . . . . . . . . 38.8 mt -82.04 112.0 18.71 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.261 -0.899 . . . . 2.84 109.32 179.824 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 324' ' ' ASP . . . . . . . . . . . . . 27.5 m-20 -80.77 108.21 14.23 Favored 'General case' 0 N--CA 1.488 1.47 0 O-C-N 121.058 -1.026 . . . . 1.53 109.275 179.777 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 325' ' ' GLY . . . . . 0.572 ' O ' ' CD2' ' B' ' 327' ' ' TYR . . . -68.74 -169.71 5.88 Favored Glycine 0 N--CA 1.489 2.176 0 N-CA-C 109.415 -1.474 . . . . 0.59 109.415 -179.968 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 326' ' ' GLU . . . . . 0.452 ' HB3' ' CE2' ' B' ' 328' ' ' PHE . 45.1 mm-40 -58.74 163.63 3.22 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.195 -1.18 . . . . 2.13 109.205 179.783 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 327' ' ' TYR . . . . . 0.622 ' CE1' ' CG ' ' D' ' 333' ' ' ARG . 42.9 m-85 -149.16 106.36 3.61 Favored 'General case' 0 C--N 1.301 -1.516 0 O-C-N 121.177 -0.952 . . . . 0.48 109.199 179.974 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 328' ' ' PHE . . . . . 0.53 ' CE2' ' HA ' ' D' ' 335' ' ' ARG . 89.3 m-85 -113.57 -167.07 1.15 Allowed 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.331 -0.856 . . . . 0.32 109.458 -179.563 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 329' ' ' THR . . . . . . . . . . . . . 33.9 p -152.74 161.32 42.72 Favored 'General case' 0 N--CA 1.488 1.459 0 O-C-N 121.314 -0.866 . . . . 0.23 109.08 -179.912 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 330' ' ' LEU . . . . . 0.69 HD11 HD22 ' D' ' 345' ' ' ASN . 25.4 tp -151.19 129.09 11.69 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 120.966 -1.084 . . . . 0.28 109.779 -179.637 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 331' ' ' GLN . . . . . . . . . . . . . 1.3 tt0 -87.96 114.91 25.03 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.201 -0.937 . . . . 0.91 109.185 179.623 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 332' ' ' ILE . . . . . 0.474 HD12 ' CD1' ' B' ' 338' ' ' PHE . 39.1 mt -103.89 111.81 34.97 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.594 0 O-C-N 121.09 -1.006 . . . . 0.24 109.718 -179.871 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 333' ' ' ARG . . . . . 0.598 ' HG2' ' CE1' ' D' ' 327' ' ' TYR . 0.0 OUTLIER -73.34 149.21 42.77 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.231 -0.918 . . . . 2.93 109.587 179.755 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 334' ' ' GLY . . . . . . . . . . . . . . . 84.23 132.36 2.29 Favored Glycine 0 N--CA 1.492 2.391 0 N-CA-C 109.437 -1.465 . . . . 0.4 109.437 -179.834 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 335' ' ' ARG . . . . . 0.492 ' HA ' ' CE2' ' D' ' 328' ' ' PHE . 38.4 ttt180 -78.62 -41.96 30.15 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.332 -1.099 . . . . 3.01 109.737 -179.768 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 336' ' ' GLU . . . . . . . . . . . . . 3.7 pt-20 -57.16 -53.2 60.84 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.224 -0.922 . . . . 2.28 110.09 -179.677 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 337' ' ' ARG . . . . . . . . . . . . . 13.0 mmt180 -62.05 -34.9 77.12 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.044 -1.035 . . . . 2.93 109.929 -179.75 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 338' ' ' PHE . . . . . 0.474 ' CD1' HD12 ' B' ' 332' ' ' ILE . 80.3 t80 -55.61 -56.71 17.2 Favored 'General case' 0 C--N 1.303 -1.455 0 O-C-N 121.211 -0.931 . . . . 0.37 109.88 -179.618 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 339' ' ' GLU . . . . . . . . . . . . . 44.0 mt-10 -52.4 -35.2 51.13 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.222 -0.923 . . . . 1.98 110.337 -179.489 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 340' ' ' MET . . . . . . . . . . . . . 47.4 ttp -63.27 -48.27 78.85 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.135 -0.978 . . . . 0.32 109.755 -179.405 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 341' ' ' PHE . . . . . . . . . . . . . 43.9 m-85 -62.49 -47.94 81.74 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.204 -0.935 . . . . 0.18 109.848 -179.886 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 342' ' ' ARG . . . . . . . . . . . . . 17.2 ttt180 -49.24 -41.98 39.25 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.246 -0.909 . . . . 2.42 110.162 -179.55 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 343' ' ' GLU . . . . . . . . . . . . . 4.3 tp10 -59.16 -48.72 80.57 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.026 -1.046 . . . . 2.35 109.839 -179.53 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 344' ' ' LEU . . . . . 0.569 ' CD2' HD22 ' A' ' 344' ' ' LEU . 38.0 mt -61.76 -31.3 71.48 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.207 -0.933 . . . . 0.18 109.865 -179.609 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 345' ' ' ASN . . . . . 0.63 HD22 HD11 ' D' ' 330' ' ' LEU . 63.0 t-20 -57.64 -54.65 44.42 Favored 'General case' 0 C--N 1.302 -1.465 0 O-C-N 121.175 -0.953 . . . . 1.09 109.641 -179.714 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 346' ' ' GLU . . . . . . . . . . . . . 6.3 tp10 -62.0 -28.06 69.3 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.29 -0.881 . . . . 1.66 110.047 -179.659 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 347' ' ' ALA . . . . . 0.891 ' HB1' ' HB1' ' A' ' 347' ' ' ALA . . . -61.62 -58.32 8.55 Favored 'General case' 0 N--CA 1.495 1.795 0 O-C-N 121.138 -0.976 . . . . 0.17 110.238 -179.732 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 348' ' ' LEU . . . . . 0.569 HD22 ' N ' ' B' ' 348' ' ' LEU . 3.8 mm? -61.09 -49.54 76.88 Favored 'General case' 0 N--CA 1.493 1.692 0 O-C-N 121.287 -0.883 . . . . 0.29 109.869 -179.283 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 349' ' ' GLU . . . . . . . . . . . . . 44.0 mt-10 -56.1 -32.9 64.6 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.047 -1.033 . . . . 1.95 109.617 -179.624 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 350' ' ' LEU . . . . . 0.832 ' O ' HD23 ' B' ' 350' ' ' LEU . 4.0 tt -64.46 -44.38 91.26 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.245 -0.909 . . . . 0.45 109.399 179.929 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 351' ' ' LYS . . . . . . . . . . . . . 9.9 tttp -61.56 -45.32 94.65 Favored 'General case' 0 N--CA 1.488 1.45 0 O-C-N 121.337 -0.852 . . . . 1.38 109.619 179.872 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 352' ' ' ASP . . . . . . . . . . . . . 6.3 m-20 -55.23 -37.21 66.86 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.201 -0.937 . . . . 1.16 109.602 -179.995 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 353' ' ' ALA . . . . . . . . . . . . . . . -66.44 -30.97 71.44 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.164 -0.96 . . . . 0.61 109.548 -179.75 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 354' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -82.19 -5.09 58.24 Favored 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.109 -0.994 . . . . 1.45 109.552 -179.962 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 355' ' ' ALA . . . . . . . . . . . . . . . -71.43 -5.9 36.32 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.134 -0.979 . . . . 0.98 109.575 179.926 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 356' ' ' GLY . . . . . . . . . . . . . . . -80.28 3.28 73.08 Favored Glycine 0 N--CA 1.489 2.192 0 N-CA-C 109.813 -1.315 . . . . 1.29 109.813 -179.945 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 357' ' ' LYS . . . . . . . . . . . . . 1.7 mtpp -86.91 104.01 15.84 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.051 -1.264 . . . . 4.09 109.471 179.985 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 358' ' ' GLU . . . . . 0.586 ' N ' ' HD2' ' B' ' 359' ' ' PRO . 3.4 tt0 -51.13 -53.08 52.5 Favored Pre-proline 0 C--N 1.302 -1.488 0 O-C-N 121.191 -0.943 . . . . 5.72 109.834 179.979 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 359' ' ' PRO . . . . . 0.586 ' HD2' ' N ' ' B' ' 358' ' ' GLU . 2.7 Cg_endo -61.32 -47.39 12.13 Favored 'Trans proline' 0 C--N 1.311 -1.396 0 C-N-CA 121.859 1.706 . . . . 4.98 110.135 -179.795 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 360' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.234 0 N-CA-C 109.326 -1.51 . . . . 6.98 109.326 -179.947 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' C' C ' 319' ' ' LYS . . . . . 0.463 ' O ' ' O ' ' C' ' 320' ' ' LYS . 0.0 OUTLIER . . . . . 0 N--CA 1.489 1.52 0 N-CA-C 109.332 -0.618 . . . . 6.82 109.332 . . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' C' C ' 320' ' ' LYS . . . . . 0.463 ' O ' ' O ' ' C' ' 319' ' ' LYS . 0.0 OUTLIER 61.0 130.4 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.483 0 O-C-N 121.198 -0.939 . . . . 6.49 109.635 179.82 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' C' C ' 321' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -157.58 79.54 3.41 Favored Pre-proline 0 N--CA 1.489 1.478 0 O-C-N 121.238 -0.914 . . . . 6.4 109.335 179.977 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' C' C ' 322' ' ' PRO . . . . . . . . . . . . . 5.4 Cg_exo -58.32 174.75 0.65 Allowed 'Trans proline' 0 C--N 1.308 -1.567 0 C-N-CA 121.96 1.774 . . . . 3.42 109.98 179.964 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 323' ' ' LEU . . . . . . . . . . . . . 87.0 mt -78.66 142.43 37.17 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.131 -0.98 . . . . 3.95 109.415 -179.844 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 324' ' ' ASP . . . . . 0.432 ' HB3' ' OH ' ' C' ' 327' ' ' TYR . 1.6 m-20 -79.82 149.33 31.06 Favored 'General case' 0 N--CA 1.489 1.5 0 O-C-N 121.343 -0.848 . . . . 1.63 109.299 179.99 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' C' C ' 325' ' ' GLY . . . . . . . . . . . . . . . -68.75 -173.28 8.28 Favored Glycine 0 N--CA 1.49 2.242 0 N-CA-C 109.876 -1.29 . . . . 0.73 109.876 -179.557 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 326' ' ' GLU . . . . . . . . . . . . . 3.1 mt-10 -58.1 -179.56 0.06 Allowed 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.255 -1.144 . . . . 2.17 109.635 -179.968 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 327' ' ' TYR . . . . . 0.594 ' CE1' ' CG ' ' A' ' 333' ' ' ARG . 38.2 m-85 -149.14 111.45 4.69 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.412 -0.805 . . . . 0.48 109.512 179.823 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' C' C ' 328' ' ' PHE . . . . . 0.418 ' O ' HG23 ' C' ' 329' ' ' THR . 93.8 m-85 -113.47 -170.17 1.64 Allowed 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.2 -0.938 . . . . 0.33 109.578 -179.941 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' C' C ' 329' ' ' THR . . . . . 0.418 HG23 ' O ' ' C' ' 328' ' ' PHE . 6.3 p -153.28 161.78 42.01 Favored 'General case' 0 N--CA 1.491 1.609 0 N-CA-C 108.807 -0.812 . . . . 0.23 108.807 179.84 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' C' C ' 330' ' ' LEU . . . . . 0.404 ' O ' ' HA ' ' A' ' 329' ' ' THR . 15.7 tp -150.46 130.01 13.05 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.0 -1.063 . . . . 0.28 110.609 -179.027 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' C' C ' 331' ' ' GLN . . . . . . . . . . . . . 1.8 tp60 -89.32 116.0 27.21 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.394 -0.816 . . . . 1.48 108.938 178.885 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 332' ' ' ILE . . . . . . . . . . . . . 58.5 mt -103.7 115.04 44.91 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.695 0 O-C-N 121.011 -1.056 . . . . 0.24 109.984 -179.569 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 333' ' ' ARG . . . . . 0.611 ' HG2' ' CE1' ' A' ' 327' ' ' TYR . 0.7 OUTLIER -72.61 146.64 46.5 Favored 'General case' 0 N--CA 1.489 1.494 0 O-C-N 121.319 -0.863 . . . . 2.74 109.223 179.58 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' C' C ' 334' ' ' GLY . . . . . . . . . . . . . . . 84.43 127.79 1.6 Allowed Glycine 0 N--CA 1.49 2.272 0 N-CA-C 109.896 -1.282 . . . . 0.35 109.896 179.759 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 335' ' ' ARG . . . . . 0.418 ' O ' ' HB3' ' C' ' 338' ' ' PHE . 62.4 ttt180 -78.5 -32.97 48.4 Favored 'General case' 0 C--N 1.301 -1.501 0 O-C-N 121.331 -1.099 . . . . 2.53 109.271 179.634 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' C' C ' 336' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -57.74 -62.03 2.09 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.355 -0.841 . . . . 2.62 110.027 -179.702 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' C' C ' 337' ' ' ARG . . . . . . . . . . . . . 1.1 mpt_? -60.43 -26.54 66.8 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.287 -0.883 . . . . 2.81 109.905 -179.427 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 338' ' ' PHE . . . . . 0.418 ' HB3' ' O ' ' C' ' 335' ' ' ARG . 76.1 t80 -55.89 -58.95 5.71 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.236 -0.915 . . . . 0.4 109.855 -179.899 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' C' C ' 339' ' ' GLU . . . . . . . . . . . . . 10.2 mm-40 -51.64 -34.51 38.21 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.309 -0.87 . . . . 2.05 109.884 -179.537 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 340' ' ' MET . . . . . . . . . . . . . 33.4 ttp -64.43 -49.53 71.11 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.22 -0.925 . . . . 0.32 109.898 -179.665 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 341' ' ' PHE . . . . . . . . . . . . . 41.2 m-85 -60.78 -39.54 89.19 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.177 -0.952 . . . . 0.18 109.848 -179.505 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 342' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -51.77 -45.83 63.9 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.119 -0.988 . . . . 2.91 109.835 179.879 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' C' C ' 343' ' ' GLU . . . . . . . . . . . . . 2.3 tp10 -59.17 -47.77 84.09 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.309 -0.869 . . . . 2.14 110.486 -179.267 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 344' ' ' LEU . . . . . 0.464 ' CD2' HD22 ' D' ' 344' ' ' LEU . 30.2 mt -61.62 -35.0 76.65 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.034 -1.041 . . . . 0.22 110.159 -179.376 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' C' C ' 345' ' ' ASN . . . . . 0.59 HD22 HD11 ' A' ' 330' ' ' LEU . 50.4 t-20 -58.17 -59.76 4.8 Favored 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.245 -0.91 . . . . 1.08 110.217 -179.506 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' C' C ' 346' ' ' GLU . . . . . . . . . . . . . 2.6 tt0 -60.55 -22.95 64.22 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.183 -0.948 . . . . 2.21 110.168 -179.375 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 347' ' ' ALA . . . . . 0.652 ' HB1' ' HB1' ' D' ' 347' ' ' ALA . . . -61.52 -57.47 12.0 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.124 -0.985 . . . . 0.18 110.159 -179.657 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' C' C ' 348' ' ' LEU . . . . . 0.604 HD12 ' CZ ' ' A' ' 337' ' ' ARG . 4.2 mm? -61.83 -52.92 62.19 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.267 -0.896 . . . . 0.32 110.272 -179.165 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' C' C ' 349' ' ' GLU . . . . . . . . . . . . . 21.4 mm-40 -55.75 -31.29 62.42 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.157 -0.964 . . . . 2.19 109.995 -179.195 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 350' ' ' LEU . . . . . 1.029 ' CD1' HD13 ' D' ' 350' ' ' LEU . 0.3 OUTLIER -65.22 -49.24 70.46 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.126 -0.984 . . . . 0.46 109.342 -179.91 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' C' C ' 351' ' ' LYS . . . . . 0.861 ' N ' HD13 ' C' ' 350' ' ' LEU . 9.6 tttt -61.4 -44.19 97.57 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.322 -0.861 . . . . 1.35 109.744 179.696 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' C' C ' 352' ' ' ASP . . . . . . . . . . . . . 77.8 m-20 -55.98 -31.48 63.06 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.47 -0.769 . . . . 1.19 110.182 -179.53 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 353' ' ' ALA . . . . . . . . . . . . . . . -64.68 -40.41 95.35 Favored 'General case' 0 N--CA 1.489 1.493 0 O-C-N 121.066 -1.021 . . . . 0.57 109.441 -179.676 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 354' ' ' GLN . . . . . 0.755 ' NE2' HD11 ' D' ' 350' ' ' LEU . 24.9 mt-30 -83.5 -4.49 58.57 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.049 -1.032 . . . . 1.47 110.085 -179.943 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' C' C ' 355' ' ' ALA . . . . . . . . . . . . . . . -72.59 -4.8 32.99 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.152 -0.968 . . . . 0.93 110.027 -179.815 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 356' ' ' GLY . . . . . . . . . . . . . . . -77.84 -77.58 0.83 Allowed Glycine 0 N--CA 1.493 2.448 0 N-CA-C 109.951 -1.26 . . . . 1.33 109.951 -179.645 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 357' ' ' LYS . . . . . . . . . . . . . 51.4 pttt -85.18 27.08 0.82 Allowed 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.293 -1.122 . . . . 4.01 109.956 -179.641 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 358' ' ' GLU . . . . . . . . . . . . . 6.9 tm-20 -47.95 112.78 2.35 Favored Pre-proline 0 N--CA 1.49 1.556 0 O-C-N 121.092 -1.005 . . . . 5.75 109.426 179.86 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 359' ' ' PRO . . . . . . . . . . . . . 2.3 Cg_endo -62.43 112.29 1.54 Allowed 'Trans proline' 0 C--N 1.313 -1.316 0 C-N-CA 122.053 1.835 . . . . 4.94 110.137 -179.786 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 360' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.336 0 CA-C-O 117.966 -1.463 . . . . 6.5 109.647 -179.929 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' D' D ' 319' ' ' LYS . . . . . 0.412 ' O ' ' HB2' ' D' ' 320' ' ' LYS . 1.1 mmpt? . . . . . 0 N--CA 1.492 1.652 0 N-CA-C 109.337 -0.616 . . . . 7.53 109.337 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' D' D ' 320' ' ' LYS . . . . . 0.412 ' HB2' ' O ' ' D' ' 319' ' ' LYS . 31.7 mttp 59.87 -89.17 0.02 OUTLIER 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.223 -0.923 . . . . 6.41 109.692 179.894 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' D' D ' 321' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -156.51 76.94 4.35 Favored Pre-proline 0 N--CA 1.493 1.717 0 O-C-N 121.149 -0.969 . . . . 6.11 109.364 179.974 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' D' D ' 322' ' ' PRO . . . . . . . . . . . . . 2.5 Cg_endo -62.49 109.41 0.86 Allowed 'Trans proline' 0 C--N 1.312 -1.372 0 C-N-CA 122.248 1.966 . . . . 2.82 110.768 -179.864 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' D' D ' 323' ' ' LEU . . . . . . . . . . . . . 34.3 mt -81.33 112.61 18.78 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.137 -0.977 . . . . 2.83 109.383 179.689 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' D' D ' 324' ' ' ASP . . . . . . . . . . . . . 25.2 m-20 -81.35 107.52 14.2 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.124 -0.985 . . . . 1.54 109.218 179.854 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' D' D ' 325' ' ' GLY . . . . . 0.571 ' O ' ' CD2' ' D' ' 327' ' ' TYR . . . -68.15 -169.3 5.0 Favored Glycine 0 N--CA 1.491 2.331 0 N-CA-C 109.484 -1.446 . . . . 0.59 109.484 -179.915 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' D' D ' 326' ' ' GLU . . . . . 0.46 ' HB3' ' CE2' ' D' ' 328' ' ' PHE . 48.1 mm-40 -58.93 163.51 3.43 Favored 'General case' 0 N--CA 1.487 1.399 0 O-C-N 121.235 -1.156 . . . . 2.13 109.123 179.824 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' D' D ' 327' ' ' TYR . . . . . 0.598 ' CE1' ' HG2' ' B' ' 333' ' ' ARG . 41.8 m-85 -149.16 106.21 3.59 Favored 'General case' 0 C--N 1.302 -1.467 0 O-C-N 121.203 -0.935 . . . . 0.47 109.385 179.814 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' D' D ' 328' ' ' PHE . . . . . 0.492 ' CE2' ' HA ' ' B' ' 335' ' ' ARG . 87.8 m-85 -113.09 -166.39 1.08 Allowed 'General case' 0 N--CA 1.488 1.456 0 O-C-N 121.298 -0.876 . . . . 0.3 109.623 -179.557 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' D' D ' 329' ' ' THR . . . . . . . . . . . . . 35.2 p -153.51 160.32 42.48 Favored 'General case' 0 N--CA 1.488 1.464 0 O-C-N 121.345 -0.847 . . . . 0.22 109.012 -179.544 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' D' D ' 330' ' ' LEU . . . . . 0.63 HD11 HD22 ' B' ' 345' ' ' ASN . 23.4 tp -151.05 129.6 12.2 Favored 'General case' 0 N--CA 1.488 1.475 0 O-C-N 121.152 -0.968 . . . . 0.28 109.639 -179.677 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' D' D ' 331' ' ' GLN . . . . . . . . . . . . . 1.3 tt0 -88.44 114.54 25.16 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.367 -0.833 . . . . 0.93 109.271 179.865 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' D' D ' 332' ' ' ILE . . . . . 0.478 HD12 ' CD1' ' D' ' 338' ' ' PHE . 38.5 mt -103.52 111.7 34.24 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.447 0 O-C-N 121.094 -1.004 . . . . 0.25 109.849 -179.604 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' D' D ' 333' ' ' ARG . . . . . 0.622 ' CG ' ' CE1' ' B' ' 327' ' ' TYR . 0.0 OUTLIER -73.11 148.9 43.52 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.291 -0.88 . . . . 2.93 109.527 179.803 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' D' D ' 334' ' ' GLY . . . . . . . . . . . . . . . 84.97 131.94 2.48 Favored Glycine 0 N--CA 1.492 2.37 0 N-CA-C 109.567 -1.413 . . . . 0.41 109.567 179.988 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' D' D ' 335' ' ' ARG . . . . . 0.53 ' HA ' ' CE2' ' B' ' 328' ' ' PHE . 39.7 ttt180 -78.75 -40.66 32.78 Favored 'General case' 0 N--CA 1.49 1.525 0 O-C-N 121.158 -1.201 . . . . 3.03 109.558 -179.821 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' D' D ' 336' ' ' GLU . . . . . . . . . . . . . 3.7 pt-20 -58.18 -53.28 60.02 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.173 -0.955 . . . . 2.26 110.001 -179.566 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' D' D ' 337' ' ' ARG . . . . . . . . . . . . . 12.9 mmt180 -61.79 -35.98 79.76 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.182 -0.949 . . . . 2.92 109.795 -179.719 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' D' D ' 338' ' ' PHE . . . . . 0.478 ' CD1' HD12 ' D' ' 332' ' ' ILE . 80.5 t80 -54.73 -56.66 16.9 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.145 -0.972 . . . . 0.37 110.054 -179.65 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' D' D ' 339' ' ' GLU . . . . . . . . . . . . . 43.4 mt-10 -52.26 -35.9 51.19 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.214 -0.929 . . . . 1.99 110.337 -179.565 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' D' D ' 340' ' ' MET . . . . . . . . . . . . . 46.9 ttp -62.97 -48.03 80.62 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 120.989 -1.069 . . . . 0.31 109.83 -179.454 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' D' D ' 341' ' ' PHE . . . . . . . . . . . . . 44.5 m-85 -62.83 -47.9 81.39 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.207 -0.933 . . . . 0.18 109.859 -179.752 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' D' D ' 342' ' ' ARG . . . . . . . . . . . . . 16.7 ttt180 -48.98 -42.26 37.05 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.374 -0.829 . . . . 2.41 110.104 -179.544 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' D' D ' 343' ' ' GLU . . . . . . . . . . . . . 4.2 tp10 -59.12 -48.95 79.73 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.037 -1.039 . . . . 2.35 109.845 -179.692 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' D' D ' 344' ' ' LEU . . . . . 0.464 HD22 ' CD2' ' C' ' 344' ' ' LEU . 39.0 mt -60.95 -33.03 72.56 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.097 -1.002 . . . . 0.19 109.741 -179.68 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' D' D ' 345' ' ' ASN . . . . . 0.69 HD22 HD11 ' B' ' 330' ' ' LEU . 63.2 t-20 -56.2 -54.6 43.31 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.223 -0.923 . . . . 1.09 109.739 -179.928 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' D' D ' 346' ' ' GLU . . . . . . . . . . . . . 6.6 tp10 -62.46 -27.48 69.15 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.124 -0.985 . . . . 1.69 110.101 -179.589 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' D' D ' 347' ' ' ALA . . . . . 0.652 ' HB1' ' HB1' ' C' ' 347' ' ' ALA . . . -62.16 -58.48 7.63 Favored 'General case' 0 N--CA 1.493 1.725 0 O-C-N 121.051 -1.03 . . . . 0.18 110.221 -179.573 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' D' D ' 348' ' ' LEU . . . . . 0.582 HD22 ' N ' ' D' ' 348' ' ' LEU . 3.8 mm? -60.8 -48.81 80.09 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.26 -0.9 . . . . 0.31 110.017 -179.321 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' D' D ' 349' ' ' GLU . . . . . . . . . . . . . 43.4 mt-10 -56.83 -33.31 66.62 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.073 -1.017 . . . . 1.95 109.594 -179.591 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' D' D ' 350' ' ' LEU . . . . . 1.029 HD13 ' CD1' ' C' ' 350' ' ' LEU . 4.2 tt -64.16 -44.4 92.21 Favored 'General case' 0 N--CA 1.489 1.479 0 O-C-N 121.374 -0.829 . . . . 0.43 109.243 179.968 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' D' D ' 351' ' ' LYS . . . . . . . . . . . . . 10.1 tttp -61.51 -44.78 96.45 Favored 'General case' 0 N--CA 1.489 1.486 0 O-C-N 121.393 -0.817 . . . . 1.4 109.677 -179.943 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' D' D ' 352' ' ' ASP . . . . . . . . . . . . . 6.0 m-20 -55.96 -37.1 68.57 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.352 -0.842 . . . . 1.17 109.701 -179.795 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' D' D ' 353' ' ' ALA . . . . . . . . . . . . . . . -66.44 -30.51 70.88 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.278 -0.889 . . . . 0.59 109.722 -179.767 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' D' D ' 354' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -82.68 -5.23 58.75 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.269 -0.894 . . . . 1.44 109.603 -179.947 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' D' D ' 355' ' ' ALA . . . . . . . . . . . . . . . -71.42 -6.04 37.33 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.153 -0.967 . . . . 0.98 109.593 179.938 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' D' D ' 356' ' ' GLY . . . . . . . . . . . . . . . -80.25 3.18 73.32 Favored Glycine 0 N--CA 1.49 2.295 0 N-CA-C 109.632 -1.387 . . . . 1.28 109.632 179.941 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' D' D ' 357' ' ' LYS . . . . . . . . . . . . . 2.0 mtpp -86.47 104.0 15.53 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.215 -1.168 . . . . 4.09 109.462 179.942 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' D' D ' 358' ' ' GLU . . . . . 0.598 ' N ' ' HD2' ' D' ' 359' ' ' PRO . 3.4 tt0 -51.22 -53.08 52.82 Favored Pre-proline 0 N--CA 1.489 1.48 0 O-C-N 121.248 -0.908 . . . . 5.71 109.811 179.8 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' D' D ' 359' ' ' PRO . . . . . 0.598 ' HD2' ' N ' ' D' ' 358' ' ' GLU . 2.5 Cg_endo -61.52 -47.92 10.52 Favored 'Trans proline' 0 C--N 1.311 -1.432 0 C-N-CA 121.791 1.661 . . . . 4.97 110.077 -179.847 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' D' D ' 360' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.488 2.145 0 CA-C-O 117.964 -1.464 . . . . 6.97 109.496 179.97 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 319' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 N--CA 1.488 1.438 0 N-CA-C 109.468 -0.567 . . . . 7.55 109.468 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 320' ' ' LYS . . . . . 0.483 ' O ' ' CG ' ' A' ' 321' ' ' LYS . 0.1 OUTLIER 63.62 -142.44 0.33 Allowed 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.305 -0.872 . . . . 6.43 109.406 179.874 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 321' ' ' LYS . . . . . 0.483 ' CG ' ' O ' ' A' ' 320' ' ' LYS . 0.9 OUTLIER -157.76 87.75 2.51 Favored Pre-proline 0 N--CA 1.491 1.592 0 O-C-N 121.176 -0.953 . . . . 6.13 109.722 -179.611 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 322' ' ' PRO . . . . . . . . . . . . . 4.8 Cg_endo -69.29 -3.92 12.67 Favored 'Trans proline' 0 C--N 1.311 -1.416 0 C-N-CA 122.208 1.939 . . . . 2.83 110.455 179.993 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 323' ' ' LEU . . . . . . . . . . . . . 36.1 mt -79.03 100.94 7.55 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.171 -0.956 . . . . 2.83 109.331 -179.887 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 324' ' ' ASP . . . . . . . . . . . . . 10.8 m-20 -79.63 176.79 9.39 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.085 -1.009 . . . . 1.53 109.615 -179.867 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 325' ' ' GLY . . . . . . . . . . . . . . . -69.06 -176.73 13.54 Favored Glycine 0 N--CA 1.492 2.367 0 N-CA-C 109.211 -1.556 . . . . 0.61 109.211 179.654 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 326' ' ' GLU . . . . . . . . . . . . . 3.5 mt-10 -57.82 -175.82 0.02 OUTLIER 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.319 -1.107 . . . . 2.13 109.716 -179.876 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 327' ' ' TYR . . . . . 0.611 ' CE1' ' HG2' ' C' ' 333' ' ' ARG . 39.1 m-85 -149.44 109.66 4.16 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.471 -0.768 . . . . 0.48 109.613 -179.877 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 328' ' ' PHE . . . . . 0.45 ' O ' ' OE1' ' C' ' 331' ' ' GLN . 81.2 m-85 -113.01 -166.6 1.09 Allowed 'General case' 0 N--CA 1.489 1.487 0 O-C-N 121.439 -0.788 . . . . 0.31 109.293 179.658 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 329' ' ' THR . . . . . 0.441 ' HA ' ' O ' ' C' ' 330' ' ' LEU . 15.2 p -153.77 167.14 30.63 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.305 -0.872 . . . . 0.22 109.216 179.985 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 330' ' ' LEU . . . . . 0.423 HD11 HD22 ' C' ' 345' ' ' ASN . 15.1 tp -152.79 131.55 12.39 Favored 'General case' 0 C--N 1.303 -1.415 0 O-C-N 121.278 -0.889 . . . . 0.28 109.876 -179.698 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 331' ' ' GLN . . . . . 0.406 ' O ' ' NH2' ' A' ' 333' ' ' ARG . 1.5 tt0 -86.4 117.42 25.19 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.29 -0.881 . . . . 0.91 108.87 179.635 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 332' ' ' ILE . . . . . 0.586 HG21 ' HA ' ' A' ' 338' ' ' PHE . 61.1 mt -102.91 103.55 15.24 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.526 0 O-C-N 121.042 -1.036 . . . . 0.26 109.725 -179.796 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 333' ' ' ARG . . . . . 0.469 HH11 ' CG ' ' A' ' 333' ' ' ARG . 0.0 OUTLIER -69.96 145.86 51.56 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.372 -0.83 . . . . 2.92 109.123 179.659 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 334' ' ' GLY . . . . . . . . . . . . . . . 82.5 126.86 1.02 Allowed Glycine 0 N--CA 1.492 2.421 0 N-CA-C 109.654 -1.378 . . . . 0.4 109.654 -179.801 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 335' ' ' ARG . . . . . 0.462 ' O ' ' HB3' ' A' ' 338' ' ' PHE . 10.2 ttm180 -74.6 -38.5 62.59 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.387 -1.066 . . . . 3.01 109.334 179.881 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 336' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -55.54 -54.94 37.73 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.416 -0.802 . . . . 2.29 109.792 -179.555 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 337' ' ' ARG . . . . . . . . . . . . . 17.8 mtp180 -62.81 -28.65 70.15 Favored 'General case' 0 N--CA 1.496 1.835 0 O-C-N 121.381 -0.824 . . . . 2.93 109.87 179.803 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 338' ' ' PHE . . . . . 0.586 ' HA ' HG21 ' A' ' 332' ' ' ILE . 77.9 t80 -55.05 -61.5 2.27 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.035 -1.04 . . . . 0.38 109.833 -179.453 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 339' ' ' GLU . . . . . . . . . . . . . 43.1 mt-10 -50.58 -31.75 16.69 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 120.935 -1.103 . . . . 1.97 109.769 -179.748 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 340' ' ' MET . . . . . . . . . . . . . 27.2 ttp -63.8 -55.06 25.82 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 120.991 -1.068 . . . . 0.31 110.153 -179.519 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 341' ' ' PHE . . . . . . . . . . . . . 43.5 m-85 -61.37 -53.72 53.03 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.346 -0.846 . . . . 0.18 109.647 -179.502 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 342' ' ' ARG . . . . . . . . . . . . . 5.4 ttp180 -44.52 -40.57 5.75 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.466 -0.771 . . . . 2.42 109.596 -179.866 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 343' ' ' GLU . . . . . . . . . . . . . 21.6 tt0 -58.68 -46.69 86.66 Favored 'General case' 0 N--CA 1.489 1.5 0 O-C-N 121.18 -0.95 . . . . 2.35 109.866 -179.689 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 344' ' ' LEU . . . . . 0.616 HD22 ' CD2' ' B' ' 344' ' ' LEU . 49.3 mt -63.36 -45.16 92.46 Favored 'General case' 0 C--N 1.3 -1.552 0 O-C-N 121.269 -0.895 . . . . 0.18 109.988 -179.628 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 345' ' ' ASN . . . . . . . . . . . . . 34.5 t-20 -53.02 -48.93 67.18 Favored 'General case' 0 C--N 1.302 -1.478 0 O-C-N 121.247 -0.908 . . . . 1.09 109.595 -179.613 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 346' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -59.61 -36.34 76.12 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.178 -0.951 . . . . 1.65 109.514 -179.922 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 347' ' ' ALA . . . . . 0.837 ' HB1' ' HB1' ' B' ' 347' ' ' ALA . . . -61.05 -49.44 77.35 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.239 -0.913 . . . . 0.18 109.854 -179.924 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 348' ' ' LEU . . . . . 0.518 HD22 ' N ' ' A' ' 348' ' ' LEU . 4.0 mm? -61.84 -41.6 98.0 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 120.949 -1.094 . . . . 0.3 109.739 -179.729 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 349' ' ' GLU . . . . . . . . . . . . . 61.5 mt-10 -58.06 -41.02 82.47 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.231 -0.918 . . . . 1.94 110.117 -179.441 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 350' ' ' LEU . . . . . 0.621 HD22 HD13 ' B' ' 350' ' ' LEU . 7.7 tt -62.9 -41.43 99.44 Favored 'General case' 0 N--CA 1.488 1.461 0 O-C-N 121.109 -0.995 . . . . 0.46 109.86 -179.52 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 351' ' ' LYS . . . . . . . . . . . . . 10.5 tttt -58.04 -46.7 84.91 Favored 'General case' 0 N--CA 1.494 1.751 0 O-C-N 121.0 -1.063 . . . . 1.4 109.387 -179.741 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 352' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -55.8 -51.88 65.91 Favored 'General case' 0 N--CA 1.487 1.389 0 O-C-N 121.481 -0.762 . . . . 1.16 109.778 -179.951 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 353' ' ' ALA . . . . . . . . . . . . . . . -68.65 -14.76 63.23 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 120.964 -1.085 . . . . 0.63 109.574 -179.829 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 354' ' ' GLN . . . . . 0.529 ' NE2' ' CD1' ' B' ' 350' ' ' LEU . 0.7 OUTLIER -82.19 -1.83 50.32 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.279 -0.888 . . . . 1.47 109.611 -179.893 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 355' ' ' ALA . . . . . . . . . . . . . . . -69.82 -89.19 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.18 -0.95 . . . . 1.01 109.802 -179.92 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 356' ' ' GLY . . . . . . . . . . . . . . . -67.43 100.67 0.61 Allowed Glycine 0 N--CA 1.493 2.433 0 N-CA-C 109.656 -1.378 . . . . 1.3 109.656 -179.915 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 357' ' ' LYS . . . . . 0.416 ' O ' ' HD3' ' A' ' 359' ' ' PRO . 0.9 OUTLIER -89.44 128.17 35.92 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.177 -1.19 . . . . 4.1 109.564 179.948 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 358' ' ' GLU . . . . . . . . . . . . . 11.2 tt0 -48.27 107.66 0.79 Allowed Pre-proline 0 N--CA 1.488 1.45 0 O-C-N 121.335 -0.853 . . . . 5.75 109.04 179.337 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 359' ' ' PRO . . . . . 0.416 ' HD3' ' O ' ' A' ' 357' ' ' LYS . 1.8 Cg_endo -62.31 125.56 16.57 Favored 'Trans proline' 0 C--N 1.315 -1.204 0 C-N-CA 122.186 1.924 . . . . 5.0 109.888 179.88 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 360' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.281 0 N-CA-C 109.136 -1.586 . . . . 6.97 109.136 -179.933 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' B' B ' 319' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 N--CA 1.49 1.534 0 N-CA-C 109.536 -0.542 . . . . 7.55 109.536 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 320' ' ' LYS . . . . . 0.451 ' O ' ' CG ' ' B' ' 321' ' ' LYS . 0.1 OUTLIER 64.13 -144.24 0.29 Allowed 'General case' 0 N--CA 1.487 1.416 0 O-C-N 121.335 -0.853 . . . . 6.44 109.456 179.942 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' B' B ' 321' ' ' LYS . . . . . 0.451 ' CG ' ' O ' ' B' ' 320' ' ' LYS . 0.8 OUTLIER -156.83 88.01 2.73 Favored Pre-proline 0 N--CA 1.492 1.657 0 O-C-N 121.234 -0.916 . . . . 6.13 109.636 -179.802 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' B' B ' 322' ' ' PRO . . . . . . . . . . . . . 4.2 Cg_endo -69.72 -1.85 9.14 Favored 'Trans proline' 0 C--N 1.31 -1.473 0 C-N-CA 122.25 1.966 . . . . 2.82 110.357 -179.888 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 323' ' ' LEU . . . . . . . . . . . . . 40.0 mt -80.17 99.92 8.02 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.109 -0.994 . . . . 2.84 109.54 -179.777 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 324' ' ' ASP . . . . . . . . . . . . . 13.1 m-20 -78.74 174.71 11.15 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.207 -0.933 . . . . 1.53 109.779 -179.835 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 325' ' ' GLY . . . . . . . . . . . . . . . -66.88 -174.75 6.58 Favored Glycine 0 N--CA 1.489 2.226 0 N-CA-C 109.533 -1.427 . . . . 0.59 109.533 179.865 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 326' ' ' GLU . . . . . . . . . . . . . 3.4 mt-10 -59.19 -174.18 0.02 OUTLIER 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.44 -1.036 . . . . 2.13 109.391 -179.902 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 327' ' ' TYR . . . . . 0.455 ' CE1' ' HG2' ' D' ' 333' ' ' ARG . 41.1 m-85 -150.35 109.72 3.98 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.444 -0.785 . . . . 0.48 109.556 179.902 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 328' ' ' PHE . . . . . 0.402 ' O ' HG23 ' B' ' 329' ' ' THR . 91.1 m-85 -113.41 -167.05 1.14 Allowed 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.363 -0.835 . . . . 0.32 109.399 179.999 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 329' ' ' THR . . . . . 0.446 ' HA ' ' O ' ' D' ' 330' ' ' LEU . 18.0 p -153.53 165.64 35.24 Favored 'General case' 0 N--CA 1.487 1.41 0 O-C-N 121.122 -0.987 . . . . 0.23 109.351 179.836 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 330' ' ' LEU . . . . . 0.416 HD11 HD22 ' D' ' 345' ' ' ASN . 14.9 tp -151.19 132.8 14.83 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.206 -0.934 . . . . 0.28 110.102 -179.685 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 331' ' ' GLN . . . . . . . . . . . . . 1.4 tt0 -87.06 117.95 26.13 Favored 'General case' 0 C--N 1.301 -1.528 0 O-C-N 121.296 -0.877 . . . . 0.91 109.067 179.496 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 332' ' ' ILE . . . . . 0.601 HG21 ' HA ' ' B' ' 338' ' ' PHE . 56.4 mt -103.02 104.89 17.29 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.5 0 O-C-N 121.14 -0.975 . . . . 0.24 109.664 179.813 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 333' ' ' ARG . . . . . 0.472 ' CG ' HH11 ' B' ' 333' ' ' ARG . 0.0 OUTLIER -70.76 145.44 50.43 Favored 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.385 -0.822 . . . . 2.93 108.927 179.602 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' B' B ' 334' ' ' GLY . . . . . . . . . . . . . . . 81.62 131.18 1.27 Allowed Glycine 0 N--CA 1.491 2.303 0 N-CA-C 109.264 -1.534 . . . . 0.4 109.264 -179.685 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 335' ' ' ARG . . . . . 0.47 ' O ' ' HB3' ' B' ' 338' ' ' PHE . 9.9 ttm180 -77.5 -38.14 49.62 Favored 'General case' 0 N--CA 1.489 1.48 0 O-C-N 121.283 -1.128 . . . . 3.01 109.472 -179.931 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 336' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -56.38 -54.48 45.11 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.362 -0.837 . . . . 2.28 109.382 -179.924 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 337' ' ' ARG . . . . . . . . . . . . . 18.6 mtp180 -62.19 -28.49 69.71 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.189 -0.944 . . . . 2.93 109.944 -179.987 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 338' ' ' PHE . . . . . 0.601 ' HA ' HG21 ' B' ' 332' ' ' ILE . 80.2 t80 -55.85 -61.18 2.54 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 120.985 -1.072 . . . . 0.37 109.848 -179.617 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 339' ' ' GLU . . . . . . . . . . . . . 35.8 mt-10 -50.44 -32.84 18.96 Favored 'General case' 0 N--CA 1.494 1.77 0 O-C-N 121.241 -0.912 . . . . 1.98 109.846 -179.6 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 340' ' ' MET . . . . . . . . . . . . . 27.0 ttp -63.08 -54.42 38.33 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.265 -0.897 . . . . 0.32 109.921 -179.725 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 341' ' ' PHE . . . . . 0.416 ' O ' ' C ' ' B' ' 342' ' ' ARG . 45.0 m-85 -62.28 -54.06 46.1 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.464 -0.772 . . . . 0.18 109.826 -179.721 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 342' ' ' ARG . . . . . 0.416 ' C ' ' O ' ' B' ' 341' ' ' PHE . 4.4 ttp180 -45.0 -39.14 5.31 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 120.926 -1.108 . . . . 2.42 109.768 -179.954 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 343' ' ' GLU . . . . . . . . . . . . . 20.1 tt0 -58.68 -47.6 83.94 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.111 -0.993 . . . . 2.35 109.568 -179.911 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 344' ' ' LEU . . . . . 0.616 ' CD2' HD22 ' A' ' 344' ' ' LEU . 48.0 mt -63.27 -45.25 92.33 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.047 -1.033 . . . . 0.18 110.244 -179.628 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 345' ' ' ASN . . . . . 0.521 HD22 HD11 ' D' ' 330' ' ' LEU . 36.8 t-20 -52.79 -48.12 67.09 Favored 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.28 -0.887 . . . . 1.09 109.666 -179.316 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 346' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -60.48 -35.64 76.39 Favored 'General case' 0 N--CA 1.488 1.447 0 O-C-N 121.021 -1.049 . . . . 1.66 109.465 179.882 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 347' ' ' ALA . . . . . 0.837 ' HB1' ' HB1' ' A' ' 347' ' ' ALA . . . -61.72 -48.88 78.75 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.145 -0.972 . . . . 0.17 110.406 -179.732 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 348' ' ' LEU . . . . . 0.543 HD22 ' N ' ' B' ' 348' ' ' LEU . 3.8 mm? -63.0 -40.85 99.0 Favored 'General case' 0 N--CA 1.495 1.818 0 O-C-N 121.263 -0.898 . . . . 0.29 109.661 -179.647 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 349' ' ' GLU . . . . . . . . . . . . . 64.5 mt-10 -58.32 -41.54 84.79 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.264 -0.898 . . . . 1.95 110.254 -179.863 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 350' ' ' LEU . . . . . 0.621 HD13 HD22 ' A' ' 350' ' ' LEU . 8.6 tt -61.93 -41.65 98.2 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.067 -1.021 . . . . 0.45 109.969 -179.428 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 351' ' ' LYS . . . . . . . . . . . . . 10.9 tttt -57.9 -47.02 84.03 Favored 'General case' 0 C--N 1.3 -1.577 0 O-C-N 121.084 -1.01 . . . . 1.38 109.425 179.952 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 352' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -55.28 -50.62 69.06 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 120.917 -1.114 . . . . 1.16 109.835 -179.9 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 353' ' ' ALA . . . . . . . . . . . . . . . -69.26 -16.0 63.49 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 121.284 -0.885 . . . . 0.61 109.667 -179.853 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 354' ' ' GLN . . . . . 0.42 ' NE2' ' CD1' ' A' ' 350' ' ' LEU . 1.0 OUTLIER -81.94 -2.71 52.29 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.263 -0.898 . . . . 1.45 109.892 -179.808 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' B' B ' 355' ' ' ALA . . . . . . . . . . . . . . . -69.31 -89.46 0.01 OUTLIER 'General case' 0 N--CA 1.493 1.717 0 O-C-N 121.321 -0.862 . . . . 0.98 109.818 -179.568 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 356' ' ' GLY . . . . . . . . . . . . . . . -67.1 100.3 0.57 Allowed Glycine 0 N--CA 1.492 2.39 0 N-CA-C 109.686 -1.366 . . . . 1.29 109.686 -179.79 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 357' ' ' LYS . . . . . 0.441 ' O ' ' HD3' ' B' ' 359' ' ' PRO . 0.5 OUTLIER -88.94 127.34 35.65 Favored 'General case' 0 N--CA 1.494 1.731 0 O-C-N 121.4 -1.059 . . . . 4.09 109.685 -179.989 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' B' B ' 358' ' ' GLU . . . . . . . . . . . . . 10.9 tt0 -48.17 106.78 0.64 Allowed Pre-proline 0 N--CA 1.49 1.541 0 O-C-N 121.518 -0.739 . . . . 5.72 109.029 179.687 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 359' ' ' PRO . . . . . 0.441 ' HD3' ' O ' ' B' ' 357' ' ' LYS . 2.2 Cg_endo -60.9 124.89 15.84 Favored 'Trans proline' 0 C--N 1.314 -1.276 0 C-N-CA 122.067 1.845 . . . . 4.98 110.292 -179.83 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 360' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.17 0 CA-C-O 118.084 -1.398 . . . . 6.98 109.643 -179.91 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' C' C ' 319' ' ' LYS . . . . . . . . . . . . . 11.5 mmtp . . . . . 0 N--CA 1.489 1.496 0 N-CA-C 109.437 -0.579 . . . . 6.82 109.437 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' C' C ' 320' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 60.12 -88.84 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.174 -0.953 . . . . 6.49 109.674 179.934 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' C' C ' 321' ' ' LYS . . . . . . . . . . . . . 1.9 mttp -161.06 86.21 1.75 Allowed Pre-proline 0 N--CA 1.491 1.596 0 O-C-N 121.304 -0.873 . . . . 6.4 110.163 -179.665 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 322' ' ' PRO . . . . . . . . . . . . . 3.9 Cg_exo -61.08 -152.69 0.01 OUTLIER 'Trans proline' 0 C--N 1.311 -1.438 0 C-N-CA 122.247 1.965 . . . . 3.42 110.135 179.665 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 323' ' ' LEU . . . . . . . . . . . . . 95.1 mt -77.57 107.66 10.19 Favored 'General case' 0 N--CA 1.489 1.492 0 O-C-N 121.295 -0.878 . . . . 3.95 109.168 179.898 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 324' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -80.39 128.99 34.21 Favored 'General case' 0 N--CA 1.488 1.439 0 O-C-N 121.33 -0.856 . . . . 1.63 109.537 -179.745 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 325' ' ' GLY . . . . . 0.561 ' O ' ' CE2' ' C' ' 327' ' ' TYR . . . -66.72 178.59 14.81 Favored Glycine 0 N--CA 1.491 2.326 0 N-CA-C 108.952 -1.659 . . . . 0.73 108.952 179.781 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' C' C ' 326' ' ' GLU . . . . . . . . . . . . . 8.0 mm-40 -56.88 179.05 0.05 OUTLIER 'General case' 0 C--N 1.303 -1.445 0 O-C-N 120.717 -1.46 . . . . 2.17 108.938 179.893 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 327' ' ' TYR . . . . . 0.561 ' CE2' ' O ' ' C' ' 325' ' ' GLY . 47.9 m-85 -149.78 109.46 4.04 Favored 'General case' 0 C--N 1.3 -1.561 0 O-C-N 121.014 -1.054 . . . . 0.48 110.139 -179.804 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' C' C ' 328' ' ' PHE . . . . . 0.407 ' CZ ' ' HG3' ' A' ' 335' ' ' ARG . 77.4 m-85 -110.72 -167.79 1.23 Allowed 'General case' 0 N--CA 1.491 1.59 0 N-CA-C 108.886 -0.783 . . . . 0.33 108.886 179.742 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' C' C ' 329' ' ' THR . . . . . 0.402 HG23 ' O ' ' C' ' 328' ' ' PHE . 6.4 p -151.77 160.12 43.69 Favored 'General case' 0 C--N 1.302 -1.486 0 O-C-N 121.052 -1.03 . . . . 0.23 109.312 -179.779 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' C' C ' 330' ' ' LEU . . . . . 0.441 ' O ' ' HA ' ' A' ' 329' ' ' THR . 21.8 tp -149.32 126.87 11.61 Favored 'General case' 0 N--CA 1.494 1.771 0 O-C-N 121.083 -1.01 . . . . 0.28 109.833 -179.674 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' C' C ' 331' ' ' GLN . . . . . 0.45 ' OE1' ' O ' ' A' ' 328' ' ' PHE . 0.7 OUTLIER -87.14 120.99 28.99 Favored 'General case' 0 N--CA 1.496 1.851 0 O-C-N 121.437 -0.79 . . . . 1.48 109.578 179.904 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' C' C ' 332' ' ' ILE . . . . . 0.493 HD12 ' CD1' ' C' ' 338' ' ' PHE . 15.2 mt -103.88 111.1 32.25 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.854 0 O-C-N 121.023 -1.048 . . . . 0.24 109.843 179.762 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' C' C ' 333' ' ' ARG . . . . . 0.611 ' HG2' ' CE1' ' A' ' 327' ' ' TYR . 4.4 mtp180 -72.06 137.66 47.29 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.351 -0.843 . . . . 2.74 109.332 179.709 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' C' C ' 334' ' ' GLY . . . . . . . . . . . . . . . 90.94 137.0 7.01 Favored Glycine 0 N--CA 1.491 2.303 0 N-CA-C 109.82 -1.312 . . . . 0.35 109.82 179.709 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 335' ' ' ARG . . . . . 0.409 ' HA ' ' CE1' ' A' ' 328' ' ' PHE . 3.1 ttt180 -80.09 -38.9 30.76 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.272 -1.134 . . . . 2.53 109.31 179.929 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' C' C ' 336' ' ' GLU . . . . . 0.418 ' HA ' ' OE1' ' C' ' 339' ' ' GLU . 1.7 tm-20 -58.91 -52.8 64.18 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.569 -0.707 . . . . 2.62 109.391 179.992 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' C' C ' 337' ' ' ARG . . . . . . . . . . . . . 34.9 mtp180 -60.91 -34.66 75.02 Favored 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.33 -0.856 . . . . 2.81 109.324 179.975 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 338' ' ' PHE . . . . . 0.493 ' CD1' HD12 ' C' ' 332' ' ' ILE . 57.5 t80 -53.57 -65.21 0.6 Allowed 'General case' 0 N--CA 1.487 1.403 0 O-C-N 121.264 -0.898 . . . . 0.4 109.745 -179.735 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' C' C ' 339' ' ' GLU . . . . . 0.418 ' OE1' ' HA ' ' C' ' 336' ' ' GLU . 3.2 mp0 -47.13 -34.84 6.46 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.249 -0.907 . . . . 2.05 110.375 -179.217 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' C' C ' 340' ' ' MET . . . . . . . . . . . . . 15.2 ttp -63.92 -53.4 50.98 Favored 'General case' 0 C--N 1.301 -1.51 0 O-C-N 120.841 -1.162 . . . . 0.32 110.034 -179.208 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 341' ' ' PHE . . . . . 0.441 ' HB2' HD13 ' C' ' 332' ' ' ILE . 40.6 m-85 -61.29 -44.92 96.42 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.032 -1.043 . . . . 0.18 109.614 -179.581 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' C' C ' 342' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -50.5 -45.52 56.51 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.213 -0.929 . . . . 2.91 110.41 -179.699 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' C' C ' 343' ' ' GLU . . . . . . . . . . . . . 5.1 tt0 -57.34 -43.58 83.52 Favored 'General case' 0 N--CA 1.489 1.497 0 O-C-N 121.331 -0.856 . . . . 2.14 109.786 -179.431 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 344' ' ' LEU . . . . . 0.437 HD22 HD22 ' D' ' 344' ' ' LEU . 41.3 mt -62.64 -46.93 85.95 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.192 -0.942 . . . . 0.22 109.779 179.945 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' C' C ' 345' ' ' ASN . . . . . 0.423 HD22 HD11 ' A' ' 330' ' ' LEU . 31.2 t-20 -55.22 -49.48 71.87 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.287 -0.883 . . . . 1.08 109.896 -179.499 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' C' C ' 346' ' ' GLU . . . . . . . . . . . . . 13.6 tp10 -58.18 -35.95 72.35 Favored 'General case' 0 N--CA 1.489 1.5 0 O-C-N 121.098 -1.001 . . . . 2.21 109.713 -179.556 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 347' ' ' ALA . . . . . 0.809 ' HB1' ' HB1' ' D' ' 347' ' ' ALA . . . -61.49 -47.0 87.61 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.03 -1.044 . . . . 0.18 109.802 -179.931 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' C' C ' 348' ' ' LEU . . . . . 0.496 HD22 ' N ' ' C' ' 348' ' ' LEU . 4.2 mm? -62.83 -48.44 79.08 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.104 -0.998 . . . . 0.32 110.401 -179.552 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' C' C ' 349' ' ' GLU . . . . . . . . . . . . . 33.4 mt-10 -57.7 -36.53 72.1 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.151 -0.968 . . . . 2.19 109.878 -179.176 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 350' ' ' LEU . . . . . 0.597 ' CD2' HD22 ' D' ' 350' ' ' LEU . 3.9 tt -62.05 -40.07 94.53 Favored 'General case' 0 N--CA 1.489 1.482 0 O-C-N 121.312 -0.867 . . . . 0.46 109.424 -179.87 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' C' C ' 351' ' ' LYS . . . . . . . . . . . . . 12.3 tttt -58.72 -37.83 77.0 Favored 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.147 -0.97 . . . . 1.35 109.084 -179.929 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 352' ' ' ASP . . . . . . . . . . . . . 49.0 m-20 -55.1 -54.97 36.41 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.29 -0.881 . . . . 1.19 109.556 179.519 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 353' ' ' ALA . . . . . . . . . . . . . . . -68.55 -12.71 61.65 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.351 -0.843 . . . . 0.57 109.544 -179.85 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 354' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -81.36 -6.86 59.35 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.222 -0.924 . . . . 1.47 109.611 -179.853 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' C' C ' 355' ' ' ALA . . . . . . . . . . . . . . . -66.74 -86.51 0.02 OUTLIER 'General case' 0 C--N 1.302 -1.461 0 O-C-N 121.243 -0.911 . . . . 0.93 109.429 179.886 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 356' ' ' GLY . . . . . . . . . . . . . . . -77.07 104.12 1.88 Allowed Glycine 0 N--CA 1.491 2.355 0 N-CA-C 109.399 -1.48 . . . . 1.33 109.399 -179.907 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 357' ' ' LYS . . . . . . . . . . . . . 14.9 mttt -87.7 103.92 16.05 Favored 'General case' 0 N--CA 1.487 1.419 0 O-C-N 121.223 -1.163 . . . . 4.01 109.003 179.824 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 358' ' ' GLU . . . . . 0.596 ' CB ' ' HD3' ' C' ' 359' ' ' PRO . 3.7 mt-10 -50.02 -60.11 5.74 Favored Pre-proline 0 N--CA 1.492 1.66 0 O-C-N 121.414 -0.804 . . . . 5.75 109.767 -179.61 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' C' C ' 359' ' ' PRO . . . . . 0.596 ' HD3' ' CB ' ' C' ' 358' ' ' GLU . 5.3 Cg_exo -59.01 -154.06 0.01 OUTLIER 'Trans proline' 0 C--N 1.312 -1.393 0 C-N-CA 121.977 1.785 . . . . 4.94 110.377 179.821 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' C' C ' 360' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.364 0 CA-C-O 117.955 -1.47 . . . . 6.5 109.428 179.878 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' D' D ' 319' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 N--CA 1.491 1.587 0 CA-C-O 121.143 0.497 . . . . 7.53 109.679 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' D' D ' 320' ' ' LYS . . . . . 0.52 ' O ' ' CG ' ' D' ' 321' ' ' LYS . 0.1 OUTLIER 62.98 -144.39 0.36 Allowed 'General case' 0 C--N 1.301 -1.513 0 O-C-N 121.094 -1.004 . . . . 6.41 109.718 179.524 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' D' D ' 321' ' ' LYS . . . . . 0.52 ' CG ' ' O ' ' D' ' 320' ' ' LYS . 0.3 OUTLIER -158.74 88.77 2.19 Favored Pre-proline 0 N--CA 1.488 1.436 0 O-C-N 121.106 -0.996 . . . . 6.11 109.458 -179.657 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' D' D ' 322' ' ' PRO . . . . . . . . . . . . . 2.5 Cg_endo -69.45 -1.54 8.4 Favored 'Trans proline' 0 C--N 1.312 -1.384 0 C-N-CA 122.292 1.995 . . . . 2.82 110.546 179.666 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' D' D ' 323' ' ' LEU . . . . . . . . . . . . . 38.4 mt -79.55 100.15 7.62 Favored 'General case' 0 N--CA 1.488 1.474 0 O-C-N 121.033 -1.042 . . . . 2.83 109.384 -179.789 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' D' D ' 324' ' ' ASP . . . . . . . . . . . . . 17.9 m-20 -78.81 175.01 10.88 Favored 'General case' 0 N--CA 1.493 1.722 0 O-C-N 121.466 -0.772 . . . . 1.54 109.529 -179.983 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' D' D ' 325' ' ' GLY . . . . . . . . . . . . . . . -67.76 -174.14 7.54 Favored Glycine 0 N--CA 1.491 2.364 0 N-CA-C 109.655 -1.378 . . . . 0.59 109.655 -179.893 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' D' D ' 326' ' ' GLU . . . . . . . . . . . . . 3.4 mt-10 -59.59 -175.26 0.03 OUTLIER 'General case' 0 N--CA 1.489 1.491 0 O-C-N 121.276 -1.132 . . . . 2.13 109.723 -179.899 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' D' D ' 327' ' ' TYR . . . . . . . . . . . . . 40.5 m-85 -149.39 109.88 4.22 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.277 -0.89 . . . . 0.47 109.541 -179.695 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' D' D ' 328' ' ' PHE . . . . . 0.442 ' O ' HG23 ' D' ' 329' ' ' THR . 94.9 m-85 -113.29 -166.83 1.12 Allowed 'General case' 0 N--CA 1.488 1.469 0 O-C-N 121.213 -0.929 . . . . 0.3 109.38 179.986 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' D' D ' 329' ' ' THR . . . . . 0.442 HG23 ' O ' ' D' ' 328' ' ' PHE . 19.1 p -154.1 165.05 37.44 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.248 -0.907 . . . . 0.22 109.517 179.875 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' D' D ' 330' ' ' LEU . . . . . 0.521 HD11 HD22 ' B' ' 345' ' ' ASN . 14.7 tp -150.69 132.56 15.08 Favored 'General case' 0 N--CA 1.487 1.413 0 O-C-N 121.029 -1.044 . . . . 0.28 109.997 -179.463 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' D' D ' 331' ' ' GLN . . . . . . . . . . . . . 1.3 tt0 -86.21 117.14 24.84 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.234 -0.916 . . . . 0.93 108.576 179.402 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' D' D ' 332' ' ' ILE . . . . . 0.619 HG21 ' HA ' ' D' ' 338' ' ' PHE . 63.7 mt -102.65 104.2 16.17 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.618 0 O-C-N 121.162 -0.961 . . . . 0.25 109.584 -179.923 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' D' D ' 333' ' ' ARG . . . . . 0.457 HH11 ' CG ' ' D' ' 333' ' ' ARG . 0.0 OUTLIER -70.19 146.49 50.71 Favored 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.422 -0.799 . . . . 2.93 109.477 179.869 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' D' D ' 334' ' ' GLY . . . . . . . . . . . . . . . 80.33 130.93 0.94 Allowed Glycine 0 N--CA 1.491 2.363 0 N-CA-C 109.533 -1.427 . . . . 0.41 109.533 -179.77 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' D' D ' 335' ' ' ARG . . . . . 0.477 ' O ' ' HB3' ' D' ' 338' ' ' PHE . 9.8 ttm180 -77.66 -36.33 51.47 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.104 -1.233 . . . . 3.03 109.572 -179.753 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' D' D ' 336' ' ' GLU . . . . . . . . . . . . . 1.1 tt0 -57.12 -55.31 36.36 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.369 -0.832 . . . . 2.26 109.358 -179.759 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' D' D ' 337' ' ' ARG . . . . . . . . . . . . . 18.1 mtp180 -61.48 -28.38 69.25 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.356 -0.84 . . . . 2.92 109.695 -179.932 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' D' D ' 338' ' ' PHE . . . . . 0.619 ' HA ' HG21 ' D' ' 332' ' ' ILE . 79.5 t80 -55.74 -61.76 2.14 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.21 -0.931 . . . . 0.37 109.83 -179.482 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' D' D ' 339' ' ' GLU . . . . . . . . . . . . . 45.1 mt-10 -50.66 -31.63 16.81 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.38 -0.825 . . . . 1.99 109.945 -179.655 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' D' D ' 340' ' ' MET . . . . . . . . . . . . . 29.3 ttp -64.64 -53.86 40.96 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.093 -1.004 . . . . 0.31 110.0 -179.482 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' D' D ' 341' ' ' PHE . . . . . . . . . . . . . 46.3 m-85 -62.57 -53.41 55.1 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.216 -0.928 . . . . 0.18 109.549 -179.74 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' D' D ' 342' ' ' ARG . . . . . . . . . . . . . 4.0 ttp180 -45.08 -38.67 5.19 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.101 -0.999 . . . . 2.41 109.904 -179.924 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' D' D ' 343' ' ' GLU . . . . . . . . . . . . . 20.9 tt0 -59.39 -47.65 84.62 Favored 'General case' 0 N--CA 1.49 1.525 0 O-C-N 121.12 -0.988 . . . . 2.35 109.534 -179.978 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' D' D ' 344' ' ' LEU . . . . . 0.453 ' O ' HD23 ' D' ' 348' ' ' LEU . 44.9 mt -63.18 -45.37 92.08 Favored 'General case' 0 C--N 1.301 -1.51 0 O-C-N 121.193 -0.942 . . . . 0.19 110.037 -179.703 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' D' D ' 345' ' ' ASN . . . . . 0.416 HD22 HD11 ' B' ' 330' ' ' LEU . 33.9 t-20 -52.43 -49.03 65.36 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.22 -0.925 . . . . 1.09 109.858 -179.349 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' D' D ' 346' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -60.07 -35.63 75.59 Favored 'General case' 0 N--CA 1.488 1.436 0 O-C-N 121.077 -1.014 . . . . 1.69 109.453 -179.961 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' D' D ' 347' ' ' ALA . . . . . 0.809 ' HB1' ' HB1' ' C' ' 347' ' ' ALA . . . -61.42 -48.97 78.78 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.259 -0.901 . . . . 0.18 110.215 -179.677 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' D' D ' 348' ' ' LEU . . . . . 0.57 HD22 ' N ' ' D' ' 348' ' ' LEU . 4.0 mm? -62.91 -40.66 98.25 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.147 -0.971 . . . . 0.31 109.663 -179.7 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' D' D ' 349' ' ' GLU . . . . . . . . . . . . . 59.6 mt-10 -59.05 -41.64 88.39 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.3 -0.875 . . . . 1.95 110.059 -179.309 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' D' D ' 350' ' ' LEU . . . . . 0.597 HD22 ' CD2' ' C' ' 350' ' ' LEU . 8.3 tt -61.76 -41.45 97.7 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.04 -1.037 . . . . 0.43 109.791 -179.282 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' D' D ' 351' ' ' LYS . . . . . . . . . . . . . 13.3 tttt -57.56 -47.34 82.33 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.01 -1.056 . . . . 1.4 109.301 -179.96 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' D' D ' 352' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -55.8 -51.45 67.4 Favored 'General case' 0 C--N 1.301 -1.505 0 O-C-N 121.393 -0.817 . . . . 1.17 109.503 179.984 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' D' D ' 353' ' ' ALA . . . . . . . . . . . . . . . -68.77 -14.88 63.31 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.153 -0.967 . . . . 0.59 109.616 -179.806 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' D' D ' 354' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -82.81 -3.76 57.13 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.334 -0.854 . . . . 1.44 109.955 -179.51 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' D' D ' 355' ' ' ALA . . . . . . . . . . . . . . . -69.51 -91.15 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.208 -0.932 . . . . 0.98 109.983 -179.846 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' D' D ' 356' ' ' GLY . . . . . . . . . . . . . . . -64.41 99.25 0.32 Allowed Glycine 0 N--CA 1.497 2.747 0 N-CA-C 109.744 -1.342 . . . . 1.28 109.744 -179.699 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' D' D ' 357' ' ' LYS . . . . . 0.424 ' O ' ' HD3' ' D' ' 359' ' ' PRO . 0.2 OUTLIER -89.55 128.44 36.01 Favored 'General case' 0 N--CA 1.493 1.692 0 O-C-N 121.421 -1.047 . . . . 4.09 109.535 -179.741 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' D' D ' 358' ' ' GLU . . . . . . . . . . . . . 12.0 tt0 -48.44 107.01 0.68 Allowed Pre-proline 0 N--CA 1.49 1.528 0 O-C-N 121.185 -0.947 . . . . 5.71 109.217 179.633 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' D' D ' 359' ' ' PRO . . . . . 0.424 ' HD3' ' O ' ' D' ' 357' ' ' LYS . 2.3 Cg_endo -61.97 126.15 18.15 Favored 'Trans proline' 0 C--N 1.313 -1.312 0 C-N-CA 122.003 1.802 . . . . 4.97 109.977 -179.943 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' D' D ' 360' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.232 0 N-CA-C 109.361 -1.496 . . . . 6.97 109.361 -179.944 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 319' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.49 1.535 0 N-CA-C 109.282 -0.636 . . . . 7.55 109.282 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 320' ' ' LYS . . . . . . . . . . . . . 32.4 tttt 58.43 90.43 0.05 OUTLIER 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.177 -0.952 . . . . 6.43 109.167 -179.878 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 321' ' ' LYS . . . . . . . . . . . . . 27.8 mttt -81.4 155.27 71.74 Favored Pre-proline 0 N--CA 1.489 1.475 0 O-C-N 121.328 -0.857 . . . . 6.13 109.565 -179.731 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 322' ' ' PRO . . . . . . . . . . . . . 4.0 Cg_exo -59.51 -154.28 0.01 OUTLIER 'Trans proline' 0 C--N 1.308 -1.585 0 C-N-CA 122.179 1.919 . . . . 2.83 110.146 -179.993 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 323' ' ' LEU . . . . . . . . . . . . . 87.9 mt -80.67 123.36 28.1 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.154 -0.966 . . . . 2.83 109.398 -179.964 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 324' ' ' ASP . . . . . . . . . . . . . 6.1 m-20 -80.26 -157.23 0.14 Allowed 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.241 -0.912 . . . . 1.53 109.613 -179.883 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 325' ' ' GLY . . . . . . . . . . . . . . . -69.09 174.4 33.78 Favored Glycine 0 N--CA 1.49 2.281 0 N-CA-C 109.669 -1.372 . . . . 0.61 109.669 -179.944 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 326' ' ' GLU . . . . . . . . . . . . . 6.2 mm-40 -58.85 -169.96 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.316 -1.108 . . . . 2.13 109.548 179.957 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 327' ' ' TYR . . . . . 0.607 ' CE1' ' HG2' ' C' ' 333' ' ' ARG . 49.1 m-85 -149.36 108.47 3.91 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.31 -0.869 . . . . 0.48 109.315 179.98 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 328' ' ' PHE . . . . . 0.422 ' CZ ' ' HG3' ' C' ' 335' ' ' ARG . 98.0 m-85 -113.97 -167.54 1.22 Allowed 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.261 -0.9 . . . . 0.31 109.693 -179.902 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 329' ' ' THR . . . . . . . . . . . . . 41.5 p -152.83 165.13 36.39 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.398 -0.814 . . . . 0.22 108.967 179.91 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 330' ' ' LEU . . . . . . . . . . . . . 21.4 tp -151.55 129.59 11.83 Favored 'General case' 0 N--CA 1.489 1.497 0 O-C-N 121.067 -1.021 . . . . 0.28 110.063 -179.519 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 331' ' ' GLN . . . . . . . . . . . . . 1.7 tp60 -88.28 116.32 26.4 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.28 -0.887 . . . . 0.91 109.02 179.422 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 332' ' ' ILE . . . . . 0.593 HD12 ' CD1' ' A' ' 338' ' ' PHE . 36.1 mt -103.71 108.64 25.0 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.641 0 O-C-N 121.107 -0.996 . . . . 0.26 110.082 -179.588 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 333' ' ' ARG . . . . . 0.452 ' HG2' ' CE1' ' C' ' 327' ' ' TYR . 0.1 OUTLIER -73.41 144.84 46.22 Favored 'General case' 0 N--CA 1.489 1.483 0 O-C-N 121.284 -0.885 . . . . 2.92 109.152 179.417 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 334' ' ' GLY . . . . . 0.489 ' CA ' ' HB2' ' C' ' 326' ' ' GLU . . . 82.37 128.01 1.1 Allowed Glycine 0 N--CA 1.492 2.385 0 N-CA-C 109.534 -1.426 . . . . 0.4 109.534 -179.853 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 335' ' ' ARG . . . . . . . . . . . . . 40.3 ttp180 -79.92 -30.48 40.04 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.269 -1.136 . . . . 3.01 110.019 -179.717 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 336' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -55.41 -68.29 0.21 Allowed 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.199 -0.938 . . . . 2.29 109.967 -179.537 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 337' ' ' ARG . . . . . . . . . . . . . 16.3 mmt180 -60.36 -28.05 67.88 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.182 -0.949 . . . . 2.93 109.693 -179.72 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 338' ' ' PHE . . . . . 0.593 ' CD1' HD12 ' A' ' 332' ' ' ILE . 66.2 t80 -55.56 -56.35 21.31 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.141 -0.974 . . . . 0.38 109.749 -179.934 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 339' ' ' GLU . . . . . . . . . . . . . 20.2 mm-40 -51.37 -37.48 48.3 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.276 -0.89 . . . . 1.97 109.948 -179.774 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 340' ' ' MET . . . . . . . . . . . . . 33.6 ttp -64.36 -45.39 87.95 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.138 -0.977 . . . . 0.31 110.252 -179.545 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 341' ' ' PHE . . . . . . . . . . . . . 32.8 m-85 -63.04 -51.07 68.18 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.234 -0.917 . . . . 0.18 110.313 -179.341 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 342' ' ' ARG . . . . . 0.549 ' HG2' ' NH1' ' A' ' 342' ' ' ARG . 4.5 ttt-85 -49.0 -46.2 43.53 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.187 -0.946 . . . . 2.42 110.158 -179.295 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 343' ' ' GLU . . . . . . . . . . . . . 2.1 tt0 -58.44 -43.05 88.6 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.27 -0.894 . . . . 2.35 110.046 -179.408 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 344' ' ' LEU . . . . . . . . . . . . . 40.3 mt -62.54 -38.41 89.9 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.111 -0.993 . . . . 0.18 109.828 -179.745 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 345' ' ' ASN . . . . . . . . . . . . . 46.7 t-20 -56.88 -48.43 78.18 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.152 -0.967 . . . . 1.09 109.648 -179.778 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 346' ' ' GLU . . . . . . . . . . . . . 2.9 tt0 -61.7 -33.65 74.39 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.274 -0.891 . . . . 1.65 109.835 -179.776 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 347' ' ' ALA . . . . . 0.945 ' HB1' ' HB1' ' B' ' 347' ' ' ALA . . . -60.53 -53.76 53.59 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.204 -0.935 . . . . 0.18 110.27 -179.601 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 348' ' ' LEU . . . . . 0.599 HD22 ' N ' ' A' ' 348' ' ' LEU . 4.1 mm? -61.51 -48.46 80.93 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.201 -0.937 . . . . 0.3 110.166 -179.319 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 349' ' ' GLU . . . . . . . . . . . . . 64.9 mm-40 -57.86 -32.89 68.1 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.182 -0.949 . . . . 1.94 110.126 -179.426 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 350' ' ' LEU . . . . . 0.562 ' C ' HD23 ' A' ' 350' ' ' LEU . 7.7 tt -64.39 -49.11 72.88 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.136 -0.978 . . . . 0.46 109.821 -179.647 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 351' ' ' LYS . . . . . . . . . . . . . 68.0 tttt -59.01 -43.25 91.52 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.193 -0.942 . . . . 1.4 109.781 -179.547 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 352' ' ' ASP . . . . . . . . . . . . . 66.7 m-20 -56.52 -50.91 70.45 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.11 -0.994 . . . . 1.16 109.66 -179.79 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 353' ' ' ALA . . . . . . . . . . . . . . . -68.23 -14.11 62.74 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.308 -0.87 . . . . 0.63 109.803 -179.676 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 354' ' ' GLN . . . . . . . . . . . . . 10.6 tt0 -83.85 -12.71 55.16 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.181 -0.949 . . . . 1.47 109.798 -179.857 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 355' ' ' ALA . . . . . . . . . . . . . . . -72.08 -46.28 57.44 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.276 -0.89 . . . . 1.01 109.797 -179.911 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 356' ' ' GLY . . . . . . . . . . . . . . . -80.27 11.03 39.4 Favored Glycine 0 N--CA 1.492 2.377 0 N-CA-C 110.333 -1.107 . . . . 1.3 110.333 -179.673 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 357' ' ' LYS . . . . . . . . . . . . . 2.8 tttt -85.76 14.76 5.45 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.013 -1.287 . . . . 4.1 109.714 -179.831 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 358' ' ' GLU . . . . . . . . . . . . . 18.1 tt0 -49.31 135.11 16.74 Favored Pre-proline 0 N--CA 1.49 1.552 0 O-C-N 121.168 -0.958 . . . . 5.75 109.222 -179.99 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 359' ' ' PRO . . . . . . . . . . . . . 2.3 Cg_endo -62.06 -155.95 0.02 OUTLIER 'Trans proline' 0 C--N 1.312 -1.372 0 C-N-CA 122.034 1.823 . . . . 5.0 110.267 -179.823 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 360' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.204 0 CA-C-O 117.993 -1.448 . . . . 6.97 109.612 -179.995 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' B' B ' 319' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.49 1.548 0 N-CA-C 109.437 -0.579 . . . . 7.55 109.437 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 320' ' ' LYS . . . . . . . . . . . . . 31.7 tttt 58.63 90.03 0.05 Allowed 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.225 -0.922 . . . . 6.44 109.179 -179.776 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 321' ' ' LYS . . . . . . . . . . . . . 27.0 mttt -81.09 155.47 72.43 Favored Pre-proline 0 N--CA 1.489 1.499 0 O-C-N 121.26 -0.9 . . . . 6.13 109.511 -179.714 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 322' ' ' PRO . . . . . . . . . . . . . 4.0 Cg_exo -59.71 -154.48 0.01 OUTLIER 'Trans proline' 0 C--N 1.309 -1.531 0 C-N-CA 122.237 1.958 . . . . 2.82 110.038 179.896 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 323' ' ' LEU . . . . . . . . . . . . . 87.8 mt -80.48 123.4 28.04 Favored 'General case' 0 N--CA 1.488 1.465 0 O-C-N 121.201 -0.937 . . . . 2.84 109.458 -179.923 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 324' ' ' ASP . . . . . . . . . . . . . 6.1 m-20 -80.19 -156.64 0.13 Allowed 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.272 -0.892 . . . . 1.53 109.584 -179.838 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 325' ' ' GLY . . . . . . . . . . . . . . . -69.71 174.47 35.82 Favored Glycine 0 N--CA 1.489 2.225 0 N-CA-C 109.683 -1.367 . . . . 0.59 109.683 -179.895 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 326' ' ' GLU . . . . . . . . . . . . . 6.5 mm-40 -58.75 -170.19 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.318 -1.107 . . . . 2.13 109.536 179.956 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 327' ' ' TYR . . . . . 0.477 ' CE1' ' HG2' ' D' ' 333' ' ' ARG . 49.0 m-85 -149.33 108.69 3.96 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.264 -0.898 . . . . 0.48 109.373 179.881 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 328' ' ' PHE . . . . . . . . . . . . . 98.0 m-85 -114.09 -167.32 1.2 Allowed 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.242 -0.911 . . . . 0.32 109.73 -179.847 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 329' ' ' THR . . . . . . . . . . . . . 40.9 p -152.81 165.2 36.13 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.423 -0.798 . . . . 0.23 109.041 179.876 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 330' ' ' LEU . . . . . . . . . . . . . 21.4 tp -151.81 129.66 11.68 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.038 -1.039 . . . . 0.28 110.038 -179.647 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 331' ' ' GLN . . . . . . . . . . . . . 1.7 tp60 -88.42 116.32 26.56 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.397 -0.814 . . . . 0.91 109.001 179.528 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 332' ' ' ILE . . . . . 0.607 HD12 ' CD1' ' B' ' 338' ' ' PHE . 35.4 mt -103.74 108.94 25.7 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.614 0 O-C-N 121.18 -0.95 . . . . 0.24 109.988 -179.555 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 333' ' ' ARG . . . . . 0.551 ' HG2' ' CE1' ' D' ' 327' ' ' TYR . 0.1 OUTLIER -73.83 144.57 45.45 Favored 'General case' 0 N--CA 1.489 1.481 0 O-C-N 121.267 -0.896 . . . . 2.93 109.043 179.359 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 334' ' ' GLY . . . . . . . . . . . . . . . 82.65 127.54 1.11 Allowed Glycine 0 N--CA 1.492 2.418 0 N-CA-C 109.491 -1.444 . . . . 0.4 109.491 -179.821 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 335' ' ' ARG . . . . . . . . . . . . . 40.3 ttp180 -79.71 -30.32 40.94 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.333 -1.098 . . . . 3.01 109.944 -179.654 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 336' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -55.6 -68.43 0.2 Allowed 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.128 -0.982 . . . . 2.28 109.824 -179.533 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 337' ' ' ARG . . . . . . . . . . . . . 16.5 mmt180 -60.21 -27.88 67.54 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.192 -0.942 . . . . 2.93 109.67 -179.614 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 338' ' ' PHE . . . . . 0.607 ' CD1' HD12 ' B' ' 332' ' ' ILE . 65.4 t80 -55.73 -56.39 21.06 Favored 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.298 -0.876 . . . . 0.37 109.672 -179.867 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 339' ' ' GLU . . . . . . . . . . . . . 21.2 mm-40 -51.42 -37.56 49.14 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.229 -0.919 . . . . 1.98 109.886 -179.77 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 340' ' ' MET . . . . . . . . . . . . . 33.6 ttp -64.25 -45.54 87.68 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.202 -0.936 . . . . 0.32 110.171 -179.48 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 341' ' ' PHE . . . . . . . . . . . . . 32.6 m-85 -62.88 -50.85 69.26 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.202 -0.936 . . . . 0.18 110.433 -179.331 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 342' ' ' ARG . . . . . 0.542 ' NH1' ' HG2' ' B' ' 342' ' ' ARG . 4.5 ttt-85 -49.25 -46.21 45.78 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.165 -0.959 . . . . 2.42 110.164 -179.337 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 343' ' ' GLU . . . . . . . . . . . . . 2.0 tt0 -58.28 -43.03 87.83 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.061 -1.024 . . . . 2.35 110.016 -179.475 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 344' ' ' LEU . . . . . . . . . . . . . 40.2 mt -62.71 -38.19 89.47 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.107 -0.995 . . . . 0.18 109.922 -179.718 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 345' ' ' ASN . . . . . . . . . . . . . 47.0 t-20 -57.13 -48.3 79.0 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.211 -0.931 . . . . 1.09 109.658 -179.825 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 346' ' ' GLU . . . . . . . . . . . . . 2.9 tt0 -61.66 -33.7 74.42 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.206 -0.934 . . . . 1.66 109.812 -179.825 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 347' ' ' ALA . . . . . 0.945 ' HB1' ' HB1' ' A' ' 347' ' ' ALA . . . -60.56 -53.74 53.81 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.197 -0.939 . . . . 0.17 110.188 -179.526 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 348' ' ' LEU . . . . . 0.594 HD22 ' N ' ' B' ' 348' ' ' LEU . 4.1 mm? -61.42 -48.59 80.49 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.221 -0.924 . . . . 0.29 110.178 -179.287 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 349' ' ' GLU . . . . . . . . . . . . . 64.3 mm-40 -57.76 -32.91 67.94 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.188 -0.945 . . . . 1.95 110.105 -179.348 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 350' ' ' LEU . . . . . 0.566 HD23 ' C ' ' B' ' 350' ' ' LEU . 7.6 tt -64.44 -49.06 72.94 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.133 -0.979 . . . . 0.45 109.853 -179.631 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 351' ' ' LYS . . . . . . . . . . . . . 67.3 tttt -59.06 -43.41 91.73 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.299 -0.876 . . . . 1.38 109.77 -179.569 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 352' ' ' ASP . . . . . . . . . . . . . 66.7 m-20 -56.25 -50.99 69.75 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.147 -0.971 . . . . 1.16 109.729 -179.902 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 353' ' ' ALA . . . . . . . . . . . . . . . -68.29 -13.98 62.66 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.217 -0.927 . . . . 0.61 109.777 -179.621 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 354' ' ' GLN . . . . . . . . . . . . . 10.5 tt0 -83.97 -12.53 55.18 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.17 -0.956 . . . . 1.45 109.775 -179.871 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 355' ' ' ALA . . . . . . . . . . . . . . . -72.46 -45.92 57.28 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.28 -0.887 . . . . 0.98 109.638 -179.878 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 356' ' ' GLY . . . . . . . . . . . . . . . -80.5 11.06 40.77 Favored Glycine 0 N--CA 1.492 2.392 0 N-CA-C 110.358 -1.097 . . . . 1.29 110.358 -179.665 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 357' ' ' LYS . . . . . . . . . . . . . 2.8 tttt -85.91 15.08 5.21 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 120.969 -1.313 . . . . 4.09 109.749 -179.806 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 358' ' ' GLU . . . . . . . . . . . . . 18.1 tt0 -49.47 135.27 17.87 Favored Pre-proline 0 N--CA 1.491 1.586 0 O-C-N 121.143 -0.973 . . . . 5.72 109.246 179.967 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 359' ' ' PRO . . . . . . . . . . . . . 2.4 Cg_endo -62.05 -155.71 0.02 OUTLIER 'Trans proline' 0 C--N 1.312 -1.353 0 C-N-CA 121.983 1.788 . . . . 4.98 110.247 -179.88 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 360' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.311 0 N-CA-C 109.522 -1.431 . . . . 6.98 109.522 179.985 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' C' C ' 319' ' ' LYS . . . . . 0.452 ' O ' ' HD2' ' C' ' 322' ' ' PRO . 1.7 tttp . . . . . 0 N--CA 1.49 1.535 0 CA-C-O 121.4 0.619 . . . . 6.82 109.48 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 320' ' ' LYS . . . . . 0.443 ' HB2' ' O ' ' C' ' 319' ' ' LYS . 2.5 mptt 66.55 -91.94 0.03 OUTLIER 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.24 -0.912 . . . . 6.49 109.788 179.871 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' C' C ' 321' ' ' LYS . . . . . 0.631 ' CB ' ' HD3' ' C' ' 322' ' ' PRO . 0.2 OUTLIER -84.51 -64.97 0.22 Allowed Pre-proline 0 N--CA 1.49 1.558 0 O-C-N 121.045 -1.035 . . . . 6.4 110.617 -179.394 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' C' C ' 322' ' ' PRO . . . . . 0.631 ' HD3' ' CB ' ' C' ' 321' ' ' LYS . 3.0 Cg_exo -58.37 83.68 0.05 OUTLIER 'Trans proline' 0 C--N 1.315 -1.211 0 C-N-CA 121.874 1.716 . . . . 3.42 110.994 -179.697 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' C' C ' 323' ' ' LEU . . . . . 0.46 ' HG ' ' O ' ' C' ' 321' ' ' LYS . 76.1 mt -85.62 42.85 0.99 Allowed 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.225 -0.922 . . . . 3.95 109.326 179.398 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' C' C ' 324' ' ' ASP . . . . . 0.404 ' N ' ' OD1' ' C' ' 324' ' ' ASP . 6.9 m-20 -83.41 5.6 23.04 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.19 -0.944 . . . . 1.63 110.572 -179.344 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' C' C ' 325' ' ' GLY . . . . . 0.603 ' O ' ' CD2' ' C' ' 327' ' ' TYR . . . -65.85 159.47 46.12 Favored Glycine 0 N--CA 1.491 2.341 0 N-CA-C 108.91 -1.676 . . . . 0.73 108.91 179.846 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' C' C ' 326' ' ' GLU . . . . . 0.489 ' HB2' ' CA ' ' A' ' 334' ' ' GLY . 6.5 mm-40 -58.18 157.89 7.72 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 120.993 -1.298 . . . . 2.17 108.836 -179.947 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' C' C ' 327' ' ' TYR . . . . . 0.603 ' CD2' ' O ' ' C' ' 325' ' ' GLY . 37.5 m-85 -149.09 102.94 3.29 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.042 -1.036 . . . . 0.48 110.215 -179.583 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' C' C ' 328' ' ' PHE . . . . . 0.442 ' CE2' ' HB3' ' C' ' 326' ' ' GLU . 90.6 m-85 -112.98 -165.23 0.97 Allowed 'General case' 0 N--CA 1.489 1.478 0 O-C-N 121.48 -0.762 . . . . 0.33 108.966 179.337 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' C' C ' 329' ' ' THR . . . . . 0.436 HG23 ' C ' ' C' ' 328' ' ' PHE . 54.6 p -155.48 156.45 35.27 Favored 'General case' 0 N--CA 1.489 1.492 0 O-C-N 121.085 -1.01 . . . . 0.23 109.437 179.961 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' C' C ' 330' ' ' LEU . . . . . . . . . . . . . 18.1 tp -148.71 120.06 7.87 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.331 -0.856 . . . . 0.28 109.596 -179.671 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 331' ' ' GLN . . . . . 0.45 ' OE1' ' HB3' ' A' ' 327' ' ' TYR . 0.1 OUTLIER -86.98 117.69 25.87 Favored 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.32 -0.863 . . . . 1.48 109.089 179.743 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' C' C ' 332' ' ' ILE . . . . . 0.417 HD12 ' CD1' ' C' ' 338' ' ' PHE . 18.8 mt -103.8 118.68 51.31 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.557 0 O-C-N 121.116 -0.99 . . . . 0.24 109.972 -179.639 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' C' C ' 333' ' ' ARG . . . . . 0.607 ' HG2' ' CE1' ' A' ' 327' ' ' TYR . 4.1 mtp180 -73.25 143.38 47.1 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.384 -0.823 . . . . 2.74 109.309 179.526 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' C' C ' 334' ' ' GLY . . . . . . . . . . . . . . . 86.22 130.78 2.73 Favored Glycine 0 N--CA 1.491 2.365 0 N-CA-C 109.694 -1.363 . . . . 0.35 109.694 179.867 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 335' ' ' ARG . . . . . 0.448 ' O ' ' HB3' ' C' ' 338' ' ' PHE . 0.0 OUTLIER -80.25 -37.91 31.99 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.367 -1.078 . . . . 2.53 109.81 -179.994 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' C' C ' 336' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -56.33 -59.0 5.59 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.222 -0.923 . . . . 2.62 109.521 -179.83 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' C' C ' 337' ' ' ARG . . . . . 0.518 ' HD2' ' N ' ' C' ' 337' ' ' ARG . 18.6 mmm180 -60.95 -30.82 70.46 Favored 'General case' 0 N--CA 1.489 1.482 0 O-C-N 121.247 -0.908 . . . . 2.81 109.241 179.836 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' C' C ' 338' ' ' PHE . . . . . 0.448 ' HB3' ' O ' ' C' ' 335' ' ' ARG . 91.7 t80 -55.03 -54.99 36.0 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.326 -0.859 . . . . 0.4 109.554 179.991 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' C' C ' 339' ' ' GLU . . . . . . . . . . . . . 27.4 mt-10 -51.82 -32.81 33.14 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.313 -0.867 . . . . 2.05 110.055 -179.787 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 340' ' ' MET . . . . . . . . . . . . . 3.3 ttt -63.66 -51.7 63.96 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.073 -1.017 . . . . 0.32 110.067 -179.539 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 341' ' ' PHE . . . . . . . . . . . . . 65.1 m-85 -62.68 -46.48 87.96 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.161 -0.962 . . . . 0.18 110.057 -179.506 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 342' ' ' ARG . . . . . 0.483 ' O ' ' HB3' ' C' ' 345' ' ' ASN . 14.6 ttm180 -49.81 -43.53 48.61 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.2 -0.937 . . . . 2.91 109.965 -179.558 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' C' C ' 343' ' ' GLU . . . . . . . . . . . . . 1.3 tt0 -58.19 -48.53 80.02 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.04 -1.037 . . . . 2.14 109.568 -179.685 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 344' ' ' LEU . . . . . . . . . . . . . 36.7 mt -61.82 -26.58 68.2 Favored 'General case' 0 N--CA 1.488 1.469 0 O-C-N 121.229 -0.919 . . . . 0.22 109.549 -179.977 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 345' ' ' ASN . . . . . 0.483 ' HB3' ' O ' ' C' ' 342' ' ' ARG . 24.0 t-20 -57.15 -62.52 1.7 Allowed 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.219 -0.926 . . . . 1.08 109.659 -179.866 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' C' C ' 346' ' ' GLU . . . . . 0.454 ' O ' ' HB2' ' C' ' 350' ' ' LEU . 2.5 tt0 -62.04 -23.66 66.6 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.209 -0.932 . . . . 2.21 109.768 -179.692 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' C' C ' 347' ' ' ALA . . . . . 0.728 ' HB1' ' HB1' ' D' ' 347' ' ' ALA . . . -62.33 -57.04 12.81 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.194 -0.941 . . . . 0.18 109.865 -179.84 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' C' C ' 348' ' ' LEU . . . . . 0.508 ' N ' ' CD2' ' C' ' 348' ' ' LEU . 3.6 mm? -61.58 -53.46 55.93 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.244 -0.91 . . . . 0.32 110.032 -179.658 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' C' C ' 349' ' ' GLU . . . . . . . . . . . . . 1.5 mt-10 -56.38 -28.83 60.39 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.172 -0.955 . . . . 2.19 109.692 -179.578 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 350' ' ' LEU . . . . . 0.699 ' CD2' HD13 ' D' ' 350' ' ' LEU . 10.3 tt -65.24 -48.78 72.11 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.341 -0.849 . . . . 0.46 109.212 179.821 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' C' C ' 351' ' ' LYS . . . . . . . . . . . . . 31.1 tttm -58.26 -42.83 87.29 Favored 'General case' 0 N--CA 1.488 1.454 0 O-C-N 121.466 -0.771 . . . . 1.35 109.579 -179.782 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 352' ' ' ASP . . . . . . . . . . . . . 5.2 m-20 -61.0 -43.05 99.46 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.288 -0.882 . . . . 1.19 109.712 179.752 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 353' ' ' ALA . . . . . . . . . . . . . . . -66.73 -9.96 42.01 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.275 -0.891 . . . . 0.57 109.855 -179.483 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 354' ' ' GLN . . . . . 0.427 ' NE2' HD11 ' D' ' 350' ' ' LEU . 4.9 mt-30 -81.21 -49.62 10.56 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.24 -0.913 . . . . 1.47 109.37 -179.997 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' C' C ' 355' ' ' ALA . . . . . . . . . . . . . . . -70.19 -19.51 63.17 Favored 'General case' 0 N--CA 1.489 1.5 0 O-C-N 121.226 -0.921 . . . . 0.93 108.949 179.713 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 356' ' ' GLY . . . . . . . . . . . . . . . -80.6 -78.36 0.94 Allowed Glycine 0 N--CA 1.489 2.233 0 N-CA-C 108.934 -1.666 . . . . 1.33 108.934 179.509 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 357' ' ' LYS . . . . . . . . . . . . . 1.7 ttmm -84.96 101.06 12.06 Favored 'General case' 0 N--CA 1.488 1.464 0 O-C-N 121.412 -1.052 . . . . 4.01 109.145 179.699 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 358' ' ' GLU . . . . . 0.565 ' N ' ' HD2' ' C' ' 359' ' ' PRO . 0.9 OUTLIER -48.79 -55.2 21.2 Favored Pre-proline 0 N--CA 1.489 1.51 0 O-C-N 121.222 -0.924 . . . . 5.75 109.715 -179.799 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' C' C ' 359' ' ' PRO . . . . . 0.565 ' HD2' ' N ' ' C' ' 358' ' ' GLU . 1.8 Cg_endo -63.37 103.75 0.39 Allowed 'Trans proline' 0 C--N 1.311 -1.418 0 C-N-CA 121.868 1.712 . . . . 4.94 110.182 -179.975 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' C' C ' 360' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.488 2.156 0 CA-C-O 117.983 -1.454 . . . . 6.5 109.506 179.943 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' D' D ' 319' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.489 1.501 0 N-CA-C 109.377 -0.601 . . . . 7.53 109.377 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' D' D ' 320' ' ' LYS . . . . . . . . . . . . . 31.5 tttt 58.63 90.3 0.05 OUTLIER 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.232 -0.917 . . . . 6.41 109.182 -179.762 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' D' D ' 321' ' ' LYS . . . . . . . . . . . . . 27.4 mttt -81.11 155.19 72.52 Favored Pre-proline 0 N--CA 1.489 1.498 0 O-C-N 121.316 -0.865 . . . . 6.11 109.623 -179.767 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' D' D ' 322' ' ' PRO . . . . . . . . . . . . . 4.0 Cg_exo -59.66 -154.29 0.01 OUTLIER 'Trans proline' 0 C--N 1.309 -1.511 0 C-N-CA 122.053 1.835 . . . . 2.82 110.116 179.823 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' D' D ' 323' ' ' LEU . . . . . . . . . . . . . 88.1 mt -80.52 123.27 27.95 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.212 -0.93 . . . . 2.83 109.519 -179.947 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' D' D ' 324' ' ' ASP . . . . . . . . . . . . . 6.3 m-20 -80.3 -156.93 0.13 Allowed 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.299 -0.876 . . . . 1.54 109.638 -179.787 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' D' D ' 325' ' ' GLY . . . . . . . . . . . . . . . -69.32 174.35 34.65 Favored Glycine 0 N--CA 1.489 2.217 0 N-CA-C 109.705 -1.358 . . . . 0.59 109.705 -179.94 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' D' D ' 326' ' ' GLU . . . . . . . . . . . . . 6.6 mm-40 -58.93 -170.26 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.287 -1.126 . . . . 2.13 109.45 179.921 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' D' D ' 327' ' ' TYR . . . . . 0.551 ' CE1' ' HG2' ' B' ' 333' ' ' ARG . 49.4 m-85 -149.25 108.81 3.99 Favored 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.295 -0.878 . . . . 0.47 109.371 179.979 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' D' D ' 328' ' ' PHE . . . . . . . . . . . . . 97.9 m-85 -114.09 -167.15 1.17 Allowed 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.352 -0.842 . . . . 0.3 109.687 -179.808 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' D' D ' 329' ' ' THR . . . . . . . . . . . . . 40.7 p -152.97 164.96 36.99 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.369 -0.832 . . . . 0.22 109.024 179.934 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' D' D ' 330' ' ' LEU . . . . . . . . . . . . . 21.3 tp -151.66 129.53 11.69 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.113 -0.992 . . . . 0.28 110.016 -179.571 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' D' D ' 331' ' ' GLN . . . . . . . . . . . . . 1.7 tp60 -88.27 116.38 26.44 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.266 -0.896 . . . . 0.93 108.97 179.506 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' D' D ' 332' ' ' ILE . . . . . 0.601 HD12 ' CD1' ' D' ' 338' ' ' PHE . 36.2 mt -103.81 109.02 25.91 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.57 0 O-C-N 121.023 -1.048 . . . . 0.25 110.071 -179.634 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' D' D ' 333' ' ' ARG . . . . . 0.477 ' HG2' ' CE1' ' B' ' 327' ' ' TYR . 0.1 OUTLIER -73.87 144.54 45.37 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.306 -0.871 . . . . 2.93 109.142 179.442 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' D' D ' 334' ' ' GLY . . . . . . . . . . . . . . . 82.58 127.91 1.14 Allowed Glycine 0 N--CA 1.492 2.399 0 N-CA-C 109.417 -1.473 . . . . 0.41 109.417 -179.841 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' D' D ' 335' ' ' ARG . . . . . . . . . . . . . 40.4 ttp180 -79.96 -30.29 39.8 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.239 -1.153 . . . . 3.03 110.017 -179.722 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' D' D ' 336' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -55.48 -68.47 0.19 Allowed 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.126 -0.984 . . . . 2.26 109.889 -179.568 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' D' D ' 337' ' ' ARG . . . . . . . . . . . . . 16.3 mmt180 -60.23 -27.9 67.57 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.24 -0.913 . . . . 2.92 109.746 -179.787 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' D' D ' 338' ' ' PHE . . . . . 0.601 ' CD1' HD12 ' D' ' 332' ' ' ILE . 65.6 t80 -55.69 -56.41 20.81 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.174 -0.954 . . . . 0.37 109.638 -179.917 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' D' D ' 339' ' ' GLU . . . . . . . . . . . . . 21.7 mm-40 -51.45 -37.51 49.07 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.245 -0.909 . . . . 1.99 109.865 -179.764 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' D' D ' 340' ' ' MET . . . . . . . . . . . . . 33.6 ttp -64.21 -45.78 86.77 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.164 -0.96 . . . . 0.31 110.162 -179.468 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' D' D ' 341' ' ' PHE . . . . . . . . . . . . . 32.5 m-85 -62.61 -51.18 68.31 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.127 -0.983 . . . . 0.18 110.377 -179.357 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' D' D ' 342' ' ' ARG . . . . . 0.534 ' NH1' ' HG2' ' D' ' 342' ' ' ARG . 4.7 ttt-85 -49.06 -46.12 44.0 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.13 -0.981 . . . . 2.41 110.212 -179.314 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' D' D ' 343' ' ' GLU . . . . . . . . . . . . . 2.0 tt0 -58.4 -43.04 88.41 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.115 -0.991 . . . . 2.35 109.921 -179.481 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' D' D ' 344' ' ' LEU . . . . . . . . . . . . . 39.1 mt -62.59 -38.37 89.87 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.163 -0.961 . . . . 0.19 109.898 -179.675 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' D' D ' 345' ' ' ASN . . . . . . . . . . . . . 46.4 t-20 -57.01 -48.4 78.56 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.231 -0.918 . . . . 1.09 109.667 -179.838 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' D' D ' 346' ' ' GLU . . . . . . . . . . . . . 2.8 tt0 -61.53 -33.99 74.78 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.22 -0.925 . . . . 1.69 109.753 -179.784 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' D' D ' 347' ' ' ALA . . . . . 0.728 ' HB1' ' HB1' ' C' ' 347' ' ' ALA . . . -60.27 -53.64 55.22 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.238 -0.914 . . . . 0.18 110.331 -179.594 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' D' D ' 348' ' ' LEU . . . . . 0.59 HD22 ' N ' ' D' ' 348' ' ' LEU . 4.2 mm? -61.63 -48.63 79.99 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.187 -0.946 . . . . 0.31 110.112 -179.165 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' D' D ' 349' ' ' GLU . . . . . . . . . . . . . 64.5 mm-40 -57.8 -32.78 67.89 Favored 'General case' 0 N--CA 1.492 1.675 0 O-C-N 121.257 -0.902 . . . . 1.95 110.076 -179.296 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' D' D ' 350' ' ' LEU . . . . . 0.699 HD13 ' CD2' ' C' ' 350' ' ' LEU . 7.6 tt -64.48 -49.12 72.64 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.13 -0.981 . . . . 0.43 109.855 -179.697 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' D' D ' 351' ' ' LYS . . . . . . . . . . . . . 66.5 tttt -58.97 -43.1 91.3 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.246 -0.909 . . . . 1.4 109.785 -179.581 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' D' D ' 352' ' ' ASP . . . . . . . . . . . . . 66.7 m-20 -56.58 -51.05 70.1 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.286 -0.884 . . . . 1.17 109.706 -179.848 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' D' D ' 353' ' ' ALA . . . . . . . . . . . . . . . -68.11 -14.01 62.65 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.287 -0.883 . . . . 0.59 109.866 -179.824 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' D' D ' 354' ' ' GLN . . . . . . . . . . . . . 10.5 tt0 -83.94 -12.69 54.98 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.092 -1.005 . . . . 1.44 109.69 -179.867 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' D' D ' 355' ' ' ALA . . . . . . . . . . . . . . . -72.18 -46.12 57.61 Favored 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.195 -0.941 . . . . 0.98 109.799 -179.927 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' D' D ' 356' ' ' GLY . . . . . . . . . . . . . . . -80.47 11.11 40.33 Favored Glycine 0 N--CA 1.492 2.391 0 N-CA-C 110.3 -1.12 . . . . 1.28 110.3 -179.69 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' D' D ' 357' ' ' LYS . . . . . . . . . . . . . 2.7 tttt -85.76 14.92 5.23 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.053 -1.263 . . . . 4.09 109.733 -179.862 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' D' D ' 358' ' ' GLU . . . . . . . . . . . . . 18.0 tt0 -49.47 135.42 17.77 Favored Pre-proline 0 N--CA 1.49 1.569 0 O-C-N 121.21 -0.931 . . . . 5.71 109.145 -179.954 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' D' D ' 359' ' ' PRO . . . . . . . . . . . . . 2.3 Cg_endo -62.15 -155.56 0.02 OUTLIER 'Trans proline' 0 C--N 1.312 -1.367 0 C-N-CA 121.972 1.781 . . . . 4.97 110.312 -179.918 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' D' D ' 360' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.322 0 CA-C-O 117.998 -1.446 . . . . 6.97 109.501 -179.968 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 319' ' ' LYS . . . . . . . . . . . . . 14.9 mttt . . . . . 0 N--CA 1.49 1.561 0 N-CA-C 109.393 -0.595 . . . . 7.55 109.393 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 320' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 60.81 16.85 7.15 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.275 -0.891 . . . . 6.43 109.452 179.965 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 321' ' ' LYS . . . . . 0.48 ' N ' ' HD3' ' A' ' 322' ' ' PRO . 0.0 OUTLIER -158.1 62.27 2.35 Favored Pre-proline 0 N--CA 1.489 1.496 0 O-C-N 121.335 -0.853 . . . . 6.13 109.095 179.839 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 322' ' ' PRO . . . . . 0.48 ' HD3' ' N ' ' A' ' 321' ' ' LYS . 5.2 Cg_exo -58.68 106.43 0.28 Allowed 'Trans proline' 0 C--N 1.309 -1.549 0 C-N-CA 122.158 1.905 . . . . 2.83 110.183 -179.893 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 323' ' ' LEU . . . . . . . . . . . . . 90.4 mt -81.55 80.84 7.82 Favored 'General case' 0 N--CA 1.489 1.481 0 O-C-N 121.253 -0.904 . . . . 2.83 109.362 179.97 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 324' ' ' ASP . . . . . 0.52 ' CB ' ' OH ' ' A' ' 327' ' ' TYR . 63.3 m-20 -81.38 159.06 24.44 Favored 'General case' 0 N--CA 1.489 1.484 0 O-C-N 121.248 -0.908 . . . . 1.53 109.131 179.816 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 325' ' ' GLY . . . . . . . . . . . . . . . -67.64 -170.52 5.06 Favored Glycine 0 N--CA 1.489 2.22 0 N-CA-C 109.138 -1.585 . . . . 0.61 109.138 179.889 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 326' ' ' GLU . . . . . . . . . . . . . 11.0 mm-40 -57.2 -169.8 0.0 OUTLIER 'General case' 0 N--CA 1.488 1.462 0 O-C-N 121.178 -1.19 . . . . 2.13 109.362 -179.903 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 327' ' ' TYR . . . . . 0.52 ' OH ' ' CB ' ' A' ' 324' ' ' ASP . 39.5 m-85 -148.7 109.51 4.26 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.244 -0.91 . . . . 0.48 109.732 -179.9 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 328' ' ' PHE . . . . . 0.486 ' CD1' ' N ' ' A' ' 328' ' ' PHE . 5.2 m-85 -113.7 -169.18 1.46 Allowed 'General case' 0 N--CA 1.488 1.473 0 O-C-N 121.401 -0.812 . . . . 0.31 108.969 179.75 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 329' ' ' THR . . . . . 0.426 HG23 ' O ' ' A' ' 328' ' ' PHE . 23.9 p -154.4 171.67 18.95 Favored 'General case' 0 N--CA 1.489 1.476 0 O-C-N 121.041 -1.037 . . . . 0.22 109.605 -179.763 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 330' ' ' LEU . . . . . 0.46 HD21 HD22 ' C' ' 345' ' ' ASN . 29.7 tp -150.49 129.88 12.93 Favored 'General case' 0 N--CA 1.488 1.456 0 O-C-N 121.307 -0.87 . . . . 0.28 109.378 -179.913 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 331' ' ' GLN . . . . . . . . . . . . . 1.6 tp60 -87.27 113.89 23.4 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.19 -0.944 . . . . 0.91 109.511 -179.982 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 332' ' ' ILE . . . . . 1.013 HG21 ' HA ' ' A' ' 338' ' ' PHE . 96.1 mt -103.44 99.97 9.48 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.552 0 O-C-N 121.162 -0.961 . . . . 0.26 109.417 179.902 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 333' ' ' ARG . . . . . . . . . . . . . 25.7 mtt180 -71.85 145.29 48.69 Favored 'General case' 0 N--CA 1.489 1.49 0 O-C-N 121.2 -0.937 . . . . 2.92 109.27 179.756 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 334' ' ' GLY . . . . . . . . . . . . . . . 82.71 121.3 0.68 Allowed Glycine 0 N--CA 1.489 2.181 0 N-CA-C 109.452 -1.459 . . . . 0.4 109.452 -179.854 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 335' ' ' ARG . . . . . 0.544 ' NH1' ' HG3' ' A' ' 335' ' ' ARG . 1.3 ttm-85 -69.18 -29.36 67.33 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.327 -1.102 . . . . 3.01 109.684 -179.844 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 336' ' ' GLU . . . . . . . . . . . . . 21.6 tt0 -59.31 -65.63 0.64 Allowed 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.267 -0.896 . . . . 2.29 109.906 -179.763 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 337' ' ' ARG . . . . . 0.61 ' CB ' ' CZ ' ' A' ' 337' ' ' ARG . 0.4 OUTLIER -59.0 -31.05 68.45 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.223 -0.923 . . . . 2.93 109.289 -179.906 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 338' ' ' PHE . . . . . 1.013 ' HA ' HG21 ' A' ' 332' ' ' ILE . 54.3 t80 -54.47 -58.09 8.8 Favored 'General case' 0 N--CA 1.488 1.469 0 O-C-N 121.409 -0.807 . . . . 0.38 109.695 -179.856 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 339' ' ' GLU . . . . . . . . . . . . . 12.5 mt-10 -51.19 -34.18 30.58 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.204 -0.935 . . . . 1.97 110.146 -179.709 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 340' ' ' MET . . . . . . . . . . . . . 32.3 ttp -63.9 -51.58 63.87 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.14 -0.975 . . . . 0.31 110.27 -179.388 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 341' ' ' PHE . . . . . 0.435 ' CZ ' ' HA ' ' C' ' 345' ' ' ASN . 39.7 m-85 -62.12 -47.67 83.56 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.11 -0.994 . . . . 0.18 110.029 -179.513 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 342' ' ' ARG . . . . . . . . . . . . . 31.4 ttt180 -48.05 -41.83 26.9 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.246 -0.909 . . . . 2.42 109.95 -179.563 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 343' ' ' GLU . . . . . . . . . . . . . 3.2 tt0 -58.72 -48.27 81.74 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.08 -1.013 . . . . 2.35 109.738 -179.643 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 344' ' ' LEU . . . . . . . . . . . . . 80.9 mt -62.29 -31.2 71.75 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.142 -0.974 . . . . 0.18 109.618 -179.853 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 345' ' ' ASN . . . . . . . . . . . . . 17.5 t-20 -57.16 -60.56 3.43 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.296 -0.878 . . . . 1.09 109.802 -179.67 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 346' ' ' GLU . . . . . 0.422 ' O ' ' HB2' ' A' ' 350' ' ' LEU . 24.9 tt0 -62.35 -25.25 67.8 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.316 -0.865 . . . . 1.65 110.15 -179.684 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 347' ' ' ALA . . . . . 0.593 ' HB1' ' HB1' ' B' ' 347' ' ' ALA . . . -60.33 -59.91 4.65 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.195 -0.941 . . . . 0.18 110.17 -179.568 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 348' ' ' LEU . . . . . 0.594 HD22 ' N ' ' A' ' 348' ' ' LEU . 3.8 mm? -61.34 -49.03 78.6 Favored 'General case' 0 N--CA 1.493 1.711 0 O-C-N 121.274 -0.891 . . . . 0.3 109.901 -179.523 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 349' ' ' GLU . . . . . . . . . . . . . 4.5 mm-40 -57.43 -27.62 62.57 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.223 -0.923 . . . . 1.94 109.798 -179.565 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 350' ' ' LEU . . . . . 0.836 ' O ' HD23 ' A' ' 350' ' ' LEU . 2.9 tt -64.49 -43.59 93.66 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.244 -0.91 . . . . 0.46 109.293 -179.984 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 351' ' ' LYS . . . . . . . . . . . . . 33.3 tttt -59.4 -52.94 63.44 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.41 -0.806 . . . . 1.4 109.868 -179.788 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 352' ' ' ASP . . . . . . . . . . . . . 66.9 m-20 -57.17 -38.54 73.74 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.246 -0.909 . . . . 1.16 109.966 -179.594 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 353' ' ' ALA . . . . . . . . . . . . . . . -67.08 -24.67 65.98 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.104 -0.997 . . . . 0.63 109.886 -179.539 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 354' ' ' GLN . . . . . 0.415 ' NE2' HD11 ' B' ' 350' ' ' LEU . 3.8 tt0 -84.15 -15.44 47.11 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.091 -1.005 . . . . 1.47 109.586 -179.854 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 355' ' ' ALA . . . . . . . . . . . . . . . -73.3 -4.58 34.1 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.182 -0.949 . . . . 1.01 109.716 179.864 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 356' ' ' GLY . . . . . . . . . . . . . . . -77.61 3.48 59.63 Favored Glycine 0 N--CA 1.492 2.407 0 N-CA-C 109.896 -1.282 . . . . 1.3 109.896 -179.777 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 357' ' ' LYS . . . . . . . . . . . . . 14.0 tttt -85.33 143.19 28.82 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.202 -1.175 . . . . 4.1 109.43 -179.968 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 358' ' ' GLU . . . . . . . . . . . . . 38.4 mt-10 -49.71 149.24 4.57 Favored Pre-proline 0 N--CA 1.49 1.556 0 O-C-N 121.265 -0.897 . . . . 5.75 109.525 -179.81 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 359' ' ' PRO . . . . . . . . . . . . . 2.6 Cg_endo -62.08 -160.35 0.03 OUTLIER 'Trans proline' 0 C--N 1.309 -1.514 0 C-N-CA 122.272 1.982 . . . . 5.0 110.36 179.952 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 360' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.302 0 CA-C-O 118.014 -1.437 . . . . 6.97 109.543 -179.943 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' B' B ' 319' ' ' LYS . . . . . . . . . . . . . 14.5 mttt . . . . . 0 N--CA 1.49 1.546 0 CA-C-O 121.3 0.571 . . . . 7.55 109.462 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' B' B ' 320' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 60.6 16.97 7.0 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.321 -0.862 . . . . 6.44 109.516 -179.886 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 321' ' ' LYS . . . . . 0.474 ' N ' ' HD3' ' B' ' 322' ' ' PRO . 0.0 OUTLIER -158.16 62.31 2.34 Favored Pre-proline 0 N--CA 1.489 1.5 0 O-C-N 121.287 -0.883 . . . . 6.13 109.126 179.828 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' B' B ' 322' ' ' PRO . . . . . 0.474 ' HD3' ' N ' ' B' ' 321' ' ' LYS . 5.3 Cg_exo -58.58 106.28 0.27 Allowed 'Trans proline' 0 C--N 1.308 -1.566 0 C-N-CA 122.21 1.94 . . . . 2.82 110.209 -179.896 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 323' ' ' LEU . . . . . . . . . . . . . 89.7 mt -81.55 81.08 7.76 Favored 'General case' 0 N--CA 1.489 1.495 0 O-C-N 121.234 -0.916 . . . . 2.84 109.336 179.938 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 324' ' ' ASP . . . . . 0.52 ' CB ' ' OH ' ' B' ' 327' ' ' TYR . 60.4 m-20 -81.82 157.58 24.39 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.351 -0.843 . . . . 1.53 109.291 179.769 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 325' ' ' GLY . . . . . . . . . . . . . . . -65.93 -170.34 3.28 Favored Glycine 0 N--CA 1.49 2.234 0 N-CA-C 109.298 -1.521 . . . . 0.59 109.298 179.91 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 326' ' ' GLU . . . . . . . . . . . . . 10.4 mm-40 -57.65 -169.82 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.162 -1.199 . . . . 2.13 109.349 -179.977 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 327' ' ' TYR . . . . . 0.52 ' OH ' ' CB ' ' B' ' 324' ' ' ASP . 39.8 m-85 -148.62 109.82 4.36 Favored 'General case' 0 N--CA 1.488 1.474 0 O-C-N 121.302 -0.874 . . . . 0.48 109.767 179.987 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 328' ' ' PHE . . . . . 0.485 ' CD1' ' N ' ' B' ' 328' ' ' PHE . 5.5 m-85 -113.73 -168.89 1.41 Allowed 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.293 -0.879 . . . . 0.32 109.057 179.725 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 329' ' ' THR . . . . . 0.484 ' HA ' ' O ' ' D' ' 330' ' ' LEU . 23.5 p -154.46 171.49 19.28 Favored 'General case' 0 N--CA 1.488 1.466 0 O-C-N 121.08 -1.013 . . . . 0.23 109.682 -179.947 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 330' ' ' LEU . . . . . 0.446 ' O ' ' HA ' ' D' ' 329' ' ' THR . 30.1 tp -150.41 129.67 12.82 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.34 -0.85 . . . . 0.28 109.388 -179.95 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 331' ' ' GLN . . . . . . . . . . . . . 1.7 tp60 -87.06 113.86 23.18 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.192 -0.942 . . . . 0.91 109.575 179.917 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 332' ' ' ILE . . . . . 1.018 HG21 ' HA ' ' B' ' 338' ' ' PHE . 96.2 mt -103.31 99.94 9.41 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.581 0 O-C-N 121.142 -0.974 . . . . 0.24 109.385 179.889 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 333' ' ' ARG . . . . . . . . . . . . . 25.9 mtt180 -71.94 145.59 48.34 Favored 'General case' 0 N--CA 1.489 1.482 0 O-C-N 121.263 -0.898 . . . . 2.93 109.203 179.79 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 334' ' ' GLY . . . . . . . . . . . . . . . 82.58 121.15 0.66 Allowed Glycine 0 N--CA 1.49 2.238 0 N-CA-C 109.424 -1.47 . . . . 0.4 109.424 -179.903 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 335' ' ' ARG . . . . . 0.559 ' NH1' ' HG3' ' B' ' 335' ' ' ARG . 1.3 ttm-85 -69.02 -29.57 67.76 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.341 -1.094 . . . . 3.01 109.678 -179.879 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 336' ' ' GLU . . . . . . . . . . . . . 21.3 tt0 -59.2 -65.68 0.63 Allowed 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.275 -0.891 . . . . 2.28 109.871 -179.786 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 337' ' ' ARG . . . . . 0.609 ' CZ ' ' CB ' ' B' ' 337' ' ' ARG . 0.4 OUTLIER -59.11 -30.84 68.41 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.155 -0.966 . . . . 2.93 109.326 -179.884 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' B' B ' 338' ' ' PHE . . . . . 1.018 ' HA ' HG21 ' B' ' 332' ' ' ILE . 53.5 t80 -54.65 -58.06 9.0 Favored 'General case' 0 N--CA 1.488 1.444 0 O-C-N 121.303 -0.873 . . . . 0.37 109.583 -179.797 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 339' ' ' GLU . . . . . . . . . . . . . 12.6 mt-10 -51.27 -34.08 31.22 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.154 -0.966 . . . . 1.98 110.124 -179.691 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 340' ' ' MET . . . . . . . . . . . . . 32.4 ttp -63.88 -51.75 63.11 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.108 -0.995 . . . . 0.32 110.234 -179.397 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 341' ' ' PHE . . . . . . . . . . . . . 39.5 m-85 -61.96 -47.55 84.34 Favored 'General case' 0 N--CA 1.493 1.675 0 O-C-N 121.108 -0.995 . . . . 0.18 110.089 -179.45 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 342' ' ' ARG . . . . . . . . . . . . . 31.5 ttt180 -48.16 -41.77 27.77 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.28 -0.888 . . . . 2.42 110.006 -179.543 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 343' ' ' GLU . . . . . . . . . . . . . 3.2 tt0 -58.73 -48.15 82.17 Favored 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.14 -0.975 . . . . 2.35 109.781 -179.649 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 344' ' ' LEU . . . . . . . . . . . . . 80.5 mt -62.46 -31.21 71.9 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.151 -0.968 . . . . 0.18 109.624 -179.859 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 345' ' ' ASN . . . . . . . . . . . . . 17.7 t-20 -56.98 -60.73 3.14 Favored 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.163 -0.96 . . . . 1.09 109.786 -179.812 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 346' ' ' GLU . . . . . 0.428 ' O ' ' HB2' ' B' ' 350' ' ' LEU . 24.8 tt0 -62.24 -25.27 67.73 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.304 -0.873 . . . . 1.66 110.152 -179.646 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 347' ' ' ALA . . . . . 0.593 ' HB1' ' HB1' ' A' ' 347' ' ' ALA . . . -60.29 -59.97 4.57 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.087 -1.008 . . . . 0.17 110.17 -179.534 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 348' ' ' LEU . . . . . 0.592 HD22 ' N ' ' B' ' 348' ' ' LEU . 3.7 mm? -61.34 -49.02 78.66 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.262 -0.899 . . . . 0.29 109.994 -179.498 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 349' ' ' GLU . . . . . . . . . . . . . 4.5 mm-40 -57.27 -27.94 62.54 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.165 -0.96 . . . . 1.95 109.784 -179.594 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 350' ' ' LEU . . . . . 0.833 ' O ' HD23 ' B' ' 350' ' ' LEU . 2.8 tt -64.28 -43.5 94.61 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.259 -0.901 . . . . 0.45 109.311 -179.989 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 351' ' ' LYS . . . . . . . . . . . . . 33.4 tttt -59.52 -53.13 61.66 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.305 -0.872 . . . . 1.38 109.833 -179.692 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 352' ' ' ASP . . . . . . . . . . . . . 65.9 m-20 -56.97 -38.63 73.27 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.262 -0.899 . . . . 1.16 109.979 -179.733 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 353' ' ' ALA . . . . . . . . . . . . . . . -66.94 -24.86 66.12 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.209 -0.932 . . . . 0.61 109.876 -179.54 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 354' ' ' GLN . . . . . 0.501 ' NE2' HD11 ' A' ' 350' ' ' LEU . 3.7 tt0 -83.99 -15.6 47.13 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.168 -0.958 . . . . 1.45 109.549 -179.889 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 355' ' ' ALA . . . . . . . . . . . . . . . -73.17 -4.62 33.98 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.207 -0.933 . . . . 0.98 109.718 179.928 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 356' ' ' GLY . . . . . . . . . . . . . . . -77.68 3.6 59.52 Favored Glycine 0 N--CA 1.492 2.378 0 N-CA-C 109.862 -1.295 . . . . 1.29 109.862 -179.695 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 357' ' ' LYS . . . . . . . . . . . . . 14.1 tttt -85.44 143.25 28.69 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.172 -1.193 . . . . 4.09 109.484 179.975 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 358' ' ' GLU . . . . . . . . . . . . . 38.6 mt-10 -49.67 149.16 4.56 Favored Pre-proline 0 N--CA 1.49 1.557 0 O-C-N 121.232 -0.917 . . . . 5.72 109.595 -179.899 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 359' ' ' PRO . . . . . . . . . . . . . 2.7 Cg_endo -62.16 -160.34 0.03 OUTLIER 'Trans proline' 0 C--N 1.31 -1.476 0 C-N-CA 122.202 1.934 . . . . 4.98 110.321 179.947 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 360' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.289 0 CA-C-O 117.958 -1.468 . . . . 6.98 109.468 -179.965 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' C' C ' 319' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 N--CA 1.49 1.566 0 CA-C-O 121.268 0.556 . . . . 6.82 109.513 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 320' ' ' LYS . . . . . . . . . . . . . 9.5 mttp 56.24 95.81 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.32 -0.863 . . . . 6.49 109.494 -179.965 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 321' ' ' LYS . . . . . 0.549 ' CB ' ' HD3' ' C' ' 322' ' ' PRO . 0.1 OUTLIER -80.07 -53.53 0.94 Allowed Pre-proline 0 N--CA 1.49 1.553 0 O-C-N 121.266 -0.896 . . . . 6.4 110.143 -179.701 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' C' C ' 322' ' ' PRO . . . . . 0.549 ' HD3' ' CB ' ' C' ' 321' ' ' LYS . 1.8 Cg_endo -64.94 126.9 17.4 Favored 'Trans proline' 0 C--N 1.311 -1.41 0 C-N-CA 121.982 1.788 . . . . 3.42 110.45 -179.451 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' C' C ' 323' ' ' LEU . . . . . 0.434 ' HA ' HD23 ' C' ' 323' ' ' LEU . 83.9 mt -79.62 139.21 37.52 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.22 -0.925 . . . . 3.95 108.673 179.46 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' C' C ' 324' ' ' ASP . . . . . 0.468 ' HB3' ' OH ' ' C' ' 327' ' ' TYR . 9.0 m-20 -77.59 144.92 37.14 Favored 'General case' 0 N--CA 1.489 1.48 0 O-C-N 121.115 -0.99 . . . . 1.63 109.49 -179.48 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' C' C ' 325' ' ' GLY . . . . . . . . . . . . . . . -67.22 -167.9 3.39 Favored Glycine 0 N--CA 1.487 2.05 0 N-CA-C 109.168 -1.573 . . . . 0.73 109.168 179.982 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 326' ' ' GLU . . . . . . . . . . . . . 66.3 mm-40 -57.55 -172.9 0.01 OUTLIER 'General case' 0 C--N 1.302 -1.496 0 O-C-N 121.214 -1.168 . . . . 2.17 109.48 -179.943 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 327' ' ' TYR . . . . . 0.468 ' OH ' ' HB3' ' C' ' 324' ' ' ASP . 36.2 m-85 -147.47 105.93 3.79 Favored 'General case' 0 C--N 1.302 -1.484 0 O-C-N 121.441 -0.787 . . . . 0.48 109.226 179.661 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' C' C ' 328' ' ' PHE . . . . . 0.408 ' C ' HG23 ' C' ' 329' ' ' THR . 43.3 m-85 -113.35 -171.81 1.95 Allowed 'General case' 0 C--N 1.302 -1.461 0 O-C-N 121.297 -0.877 . . . . 0.33 108.91 179.902 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' C' C ' 329' ' ' THR . . . . . 0.408 HG23 ' C ' ' C' ' 328' ' ' PHE . 19.0 p -152.5 -175.66 5.38 Favored 'General case' 0 C--N 1.302 -1.461 0 O-C-N 121.091 -1.006 . . . . 0.23 109.645 -179.973 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' C' C ' 330' ' ' LEU . . . . . . . . . . . . . 28.1 tp -153.37 128.99 10.03 Favored 'General case' 0 N--CA 1.489 1.492 0 O-C-N 121.331 -0.855 . . . . 0.28 109.557 -179.65 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 331' ' ' GLN . . . . . . . . . . . . . 8.2 tp-100 -89.08 106.49 18.47 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.253 -0.904 . . . . 1.48 109.418 179.759 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 332' ' ' ILE . . . . . . . . . . . . . 68.3 mt -103.55 108.53 24.69 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.557 0 O-C-N 121.193 -0.942 . . . . 0.24 109.813 -179.96 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 333' ' ' ARG . . . . . 0.464 ' HG2' ' CE2' ' A' ' 327' ' ' TYR . 2.1 mpt_? -74.13 156.54 37.27 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.267 -0.895 . . . . 2.74 109.685 179.935 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' C' C ' 334' ' ' GLY . . . . . . . . . . . . . . . 76.93 132.73 0.52 Allowed Glycine 0 N--CA 1.492 2.4 0 N-CA-C 109.9 -1.28 . . . . 0.35 109.9 179.709 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 335' ' ' ARG . . . . . . . . . . . . . 26.4 ttp180 -77.9 -32.83 52.0 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.3 -1.118 . . . . 2.53 109.595 179.947 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 336' ' ' GLU . . . . . . . . . . . . . 1.6 mt-10 -57.05 -59.72 4.65 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.291 -0.88 . . . . 2.62 109.67 -179.707 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 337' ' ' ARG . . . . . 0.549 ' HG2' ' NH1' ' C' ' 337' ' ' ARG . 0.1 OUTLIER -61.23 -35.22 76.63 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.217 -0.927 . . . . 2.81 109.667 -179.742 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' C' C ' 338' ' ' PHE . . . . . . . . . . . . . 51.5 t80 -54.32 -54.86 34.6 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.185 -0.947 . . . . 0.4 109.598 -179.714 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 339' ' ' GLU . . . . . . . . . . . . . 6.9 mt-10 -53.12 -33.39 52.07 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.165 -0.959 . . . . 2.05 109.942 -179.922 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 340' ' ' MET . . . . . . . . . . . . . 25.7 ttp -65.01 -55.35 19.52 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.239 -0.913 . . . . 0.32 110.366 -179.402 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 341' ' ' PHE . . . . . . . . . . . . . 49.7 m-85 -61.39 -35.23 76.93 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.111 -0.993 . . . . 0.18 110.082 -179.231 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 342' ' ' ARG . . . . . . . . . . . . . 10.7 ttt180 -53.33 -49.44 67.06 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.227 -0.92 . . . . 2.91 110.13 -179.807 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 343' ' ' GLU . . . . . . . . . . . . . 2.3 tt0 -59.28 -47.11 86.59 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.214 -0.929 . . . . 2.14 110.289 -179.33 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 344' ' ' LEU . . . . . . . . . . . . . 85.2 mt -60.33 -30.97 69.86 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.065 -1.022 . . . . 0.22 109.641 -179.457 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 345' ' ' ASN . . . . . 0.46 HD22 HD21 ' A' ' 330' ' ' LEU . 19.4 t-20 -59.15 -58.84 6.85 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.266 -0.896 . . . . 1.08 109.928 -179.873 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' C' C ' 346' ' ' GLU . . . . . . . . . . . . . 8.8 tp10 -61.85 -25.5 67.57 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.356 -0.84 . . . . 2.21 110.321 -179.351 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 347' ' ' ALA . . . . . 0.5 ' HB1' ' HB1' ' D' ' 347' ' ' ALA . . . -58.52 -62.46 1.84 Allowed 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.045 -1.035 . . . . 0.18 110.26 -179.355 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' C' C ' 348' ' ' LEU . . . . . 0.632 HD22 ' N ' ' C' ' 348' ' ' LEU . 3.4 mm? -61.34 -42.44 98.69 Favored 'General case' 0 N--CA 1.494 1.761 0 O-C-N 121.181 -0.949 . . . . 0.32 110.014 -179.274 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' C' C ' 349' ' ' GLU . . . . . . . . . . . . . 34.7 mt-10 -57.25 -31.29 65.41 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.109 -0.994 . . . . 2.19 109.709 -179.697 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 350' ' ' LEU . . . . . 0.831 ' O ' HD23 ' C' ' 350' ' ' LEU . 5.8 tt -62.87 -43.59 98.38 Favored 'General case' 0 N--CA 1.488 1.453 0 O-C-N 121.106 -0.996 . . . . 0.46 109.604 179.993 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' C' C ' 351' ' ' LYS . . . . . . . . . . . . . 6.0 tttp -58.79 -44.77 90.79 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.288 -0.883 . . . . 1.35 109.831 -179.808 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 352' ' ' ASP . . . . . . . . . . . . . 81.6 m-20 -54.99 -44.64 74.64 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.083 -1.011 . . . . 1.19 109.945 -179.753 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 353' ' ' ALA . . . . . . . . . . . . . . . -67.03 -30.5 70.61 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.1 -1.0 . . . . 0.57 109.84 -179.607 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 354' ' ' GLN . . . . . 0.438 ' NE2' HD11 ' D' ' 350' ' ' LEU . 6.9 tt0 -81.77 8.32 10.39 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.152 -0.968 . . . . 1.47 109.851 -179.879 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' C' C ' 355' ' ' ALA . . . . . . . . . . . . . . . -70.3 -67.95 0.46 Allowed 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.203 -0.935 . . . . 0.93 110.368 -179.572 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 356' ' ' GLY . . . . . . . . . . . . . . . -81.3 48.77 3.88 Favored Glycine 0 N--CA 1.494 2.527 0 C-N-CA 120.386 -0.911 . . . . 1.33 111.272 -178.825 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 357' ' ' LYS . . . . . 0.478 ' HB3' ' HD2' ' C' ' 359' ' ' PRO . 0.0 OUTLIER -87.95 -152.86 0.22 Allowed 'General case' 0 N--CA 1.493 1.701 0 O-C-N 120.778 -1.424 . . . . 4.01 109.055 179.326 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' C' C ' 358' ' ' GLU . . . . . 0.595 ' CB ' ' HD3' ' C' ' 359' ' ' PRO . 0.2 OUTLIER -50.99 -59.21 8.02 Favored Pre-proline 0 N--CA 1.492 1.644 0 O-C-N 121.028 -1.045 . . . . 5.75 109.308 -179.97 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' C' C ' 359' ' ' PRO . . . . . 0.595 ' HD3' ' CB ' ' C' ' 358' ' ' GLU . 1.9 Cg_endo -61.25 111.66 1.18 Allowed 'Trans proline' 0 C--N 1.312 -1.353 0 C-N-CA 121.923 1.749 . . . . 4.94 109.923 179.722 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' C' C ' 360' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.18 0 CA-C-O 117.965 -1.464 . . . . 6.5 109.58 -179.98 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' D' D ' 319' ' ' LYS . . . . . . . . . . . . . 14.6 mttt . . . . . 0 N--CA 1.491 1.589 0 N-CA-C 109.344 -0.613 . . . . 7.53 109.344 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' D' D ' 320' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 60.74 17.04 7.22 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.268 -0.895 . . . . 6.41 109.488 -179.953 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' D' D ' 321' ' ' LYS . . . . . 0.463 ' N ' ' HD3' ' D' ' 322' ' ' PRO . 0.0 OUTLIER -158.17 62.22 2.32 Favored Pre-proline 0 N--CA 1.49 1.557 0 O-C-N 121.287 -0.883 . . . . 6.11 109.094 179.861 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' D' D ' 322' ' ' PRO . . . . . 0.463 ' HD3' ' N ' ' D' ' 321' ' ' LYS . 5.2 Cg_exo -58.73 106.64 0.29 Allowed 'Trans proline' 0 C--N 1.309 -1.553 0 C-N-CA 122.102 1.868 . . . . 2.82 110.166 -179.769 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' D' D ' 323' ' ' LEU . . . . . . . . . . . . . 90.1 mt -81.73 80.89 7.95 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.341 -0.849 . . . . 2.83 109.272 179.979 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' D' D ' 324' ' ' ASP . . . . . 0.516 ' CB ' ' OH ' ' D' ' 327' ' ' TYR . 60.0 m-20 -81.51 158.34 24.52 Favored 'General case' 0 N--CA 1.489 1.489 0 O-C-N 121.282 -0.887 . . . . 1.54 109.241 179.688 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' D' D ' 325' ' ' GLY . . . . . . . . . . . . . . . -66.89 -170.2 4.08 Favored Glycine 0 N--CA 1.49 2.263 0 N-CA-C 109.073 -1.611 . . . . 0.59 109.073 179.897 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' D' D ' 326' ' ' GLU . . . . . . . . . . . . . 11.1 mm-40 -57.61 -169.96 0.01 OUTLIER 'General case' 0 N--CA 1.488 1.445 0 O-C-N 121.243 -1.151 . . . . 2.13 109.37 -179.969 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' D' D ' 327' ' ' TYR . . . . . 0.516 ' OH ' ' CB ' ' D' ' 324' ' ' ASP . 40.1 m-85 -148.55 110.02 4.43 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.225 -0.922 . . . . 0.47 109.721 -179.985 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' D' D ' 328' ' ' PHE . . . . . 0.478 ' CD1' ' N ' ' D' ' 328' ' ' PHE . 5.4 m-85 -113.96 -168.9 1.42 Allowed 'General case' 0 N--CA 1.489 1.483 0 O-C-N 121.345 -0.847 . . . . 0.3 109.064 179.679 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' D' D ' 329' ' ' THR . . . . . 0.446 ' HA ' ' O ' ' B' ' 330' ' ' LEU . 23.8 p -154.45 171.75 18.86 Favored 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.216 -0.928 . . . . 0.22 109.613 -179.88 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' D' D ' 330' ' ' LEU . . . . . 0.484 ' O ' ' HA ' ' B' ' 329' ' ' THR . 29.8 tp -150.65 129.53 12.48 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.299 -0.876 . . . . 0.28 109.369 -179.943 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' D' D ' 331' ' ' GLN . . . . . . . . . . . . . 1.6 tp60 -87.0 113.92 23.17 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.259 -0.901 . . . . 0.93 109.578 179.958 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' D' D ' 332' ' ' ILE . . . . . 1.0 HG21 ' HA ' ' D' ' 338' ' ' PHE . 96.2 mt -103.29 100.03 9.6 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.522 0 O-C-N 121.223 -0.923 . . . . 0.25 109.421 179.882 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' D' D ' 333' ' ' ARG . . . . . 0.44 ' HG2' ' CE2' ' B' ' 327' ' ' TYR . 26.2 mtt180 -71.88 145.61 48.43 Favored 'General case' 0 N--CA 1.488 1.427 0 O-C-N 121.253 -0.905 . . . . 2.93 109.225 179.761 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' D' D ' 334' ' ' GLY . . . . . . . . . . . . . . . 82.75 121.21 0.68 Allowed Glycine 0 N--CA 1.49 2.253 0 N-CA-C 109.518 -1.433 . . . . 0.41 109.518 -179.93 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' D' D ' 335' ' ' ARG . . . . . 0.546 ' NH1' ' HG3' ' D' ' 335' ' ' ARG . 1.3 ttm-85 -69.02 -29.98 68.27 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.324 -1.103 . . . . 3.03 109.613 -179.94 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' D' D ' 336' ' ' GLU . . . . . . . . . . . . . 21.3 tt0 -58.93 -65.57 0.64 Allowed 'General case' 0 N--CA 1.491 1.625 0 O-C-N 121.239 -0.913 . . . . 2.26 109.95 -179.728 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' D' D ' 337' ' ' ARG . . . . . 0.588 ' CZ ' ' CB ' ' D' ' 337' ' ' ARG . 0.4 OUTLIER -59.22 -30.77 68.48 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.172 -0.955 . . . . 2.92 109.355 -179.877 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' D' D ' 338' ' ' PHE . . . . . 1.0 ' HA ' HG21 ' D' ' 332' ' ' ILE . 54.0 t80 -54.61 -58.01 9.19 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.389 -0.819 . . . . 0.37 109.635 -179.951 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' D' D ' 339' ' ' GLU . . . . . . . . . . . . . 12.6 mt-10 -51.37 -34.2 33.17 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.207 -0.933 . . . . 1.99 110.093 -179.636 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' D' D ' 340' ' ' MET . . . . . . . . . . . . . 32.3 ttp -63.79 -51.53 64.38 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.077 -1.015 . . . . 0.31 110.327 -179.5 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' D' D ' 341' ' ' PHE . . . . . . . . . . . . . 39.2 m-85 -62.17 -47.67 83.48 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.128 -0.982 . . . . 0.18 110.043 -179.438 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' D' D ' 342' ' ' ARG . . . . . . . . . . . . . 31.1 ttt180 -47.89 -41.98 25.73 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.286 -0.883 . . . . 2.41 110.042 -179.606 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' D' D ' 343' ' ' GLU . . . . . . . . . . . . . 3.2 tt0 -58.72 -48.07 82.42 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.156 -0.965 . . . . 2.35 109.729 -179.556 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' D' D ' 344' ' ' LEU . . . . . . . . . . . . . 80.2 mt -62.49 -31.29 72.01 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.244 -0.91 . . . . 0.19 109.624 -179.772 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' D' D ' 345' ' ' ASN . . . . . . . . . . . . . 17.4 t-20 -56.91 -60.42 3.6 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.279 -0.888 . . . . 1.09 109.798 -179.775 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' D' D ' 346' ' ' GLU . . . . . 0.43 ' O ' ' HB2' ' D' ' 350' ' ' LEU . 24.8 tt0 -62.69 -25.4 68.13 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.179 -0.95 . . . . 1.69 110.077 -179.55 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' D' D ' 347' ' ' ALA . . . . . 0.5 ' HB1' ' HB1' ' C' ' 347' ' ' ALA . . . -60.18 -59.87 4.72 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.173 -0.954 . . . . 0.18 110.06 -179.518 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' D' D ' 348' ' ' LEU . . . . . 0.603 HD22 ' N ' ' D' ' 348' ' ' LEU . 3.8 mm? -61.44 -49.11 78.16 Favored 'General case' 0 N--CA 1.493 1.722 0 O-C-N 121.248 -0.907 . . . . 0.31 110.02 -179.48 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' D' D ' 349' ' ' GLU . . . . . . . . . . . . . 4.5 mm-40 -57.21 -27.77 62.27 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.186 -0.946 . . . . 1.95 109.77 -179.602 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' D' D ' 350' ' ' LEU . . . . . 0.818 ' O ' HD23 ' D' ' 350' ' ' LEU . 2.7 tt -64.59 -43.52 93.57 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.142 -0.974 . . . . 0.43 109.268 -179.979 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' D' D ' 351' ' ' LYS . . . . . . . . . . . . . 32.9 tttt -59.28 -53.14 61.59 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.3 -0.875 . . . . 1.4 109.913 -179.84 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' D' D ' 352' ' ' ASP . . . . . . . . . . . . . 66.6 m-20 -56.96 -38.65 73.27 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.146 -0.971 . . . . 1.17 110.006 -179.745 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' D' D ' 353' ' ' ALA . . . . . . . . . . . . . . . -66.89 -24.73 66.14 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.144 -0.972 . . . . 0.59 109.917 -179.555 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' D' D ' 354' ' ' GLN . . . . . 0.502 ' NE2' HD11 ' C' ' 350' ' ' LEU . 3.7 tt0 -84.01 -15.69 46.72 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.205 -0.934 . . . . 1.44 109.621 -179.885 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' D' D ' 355' ' ' ALA . . . . . . . . . . . . . . . -73.13 -4.59 33.66 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.17 -0.956 . . . . 0.98 109.711 179.918 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' D' D ' 356' ' ' GLY . . . . . . . . . . . . . . . -77.52 3.35 59.72 Favored Glycine 0 N--CA 1.491 2.357 0 N-CA-C 109.879 -1.288 . . . . 1.28 109.879 -179.779 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' D' D ' 357' ' ' LYS . . . . . . . . . . . . . 14.0 tttt -85.24 143.23 28.87 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.208 -1.172 . . . . 4.09 109.5 -179.998 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' D' D ' 358' ' ' GLU . . . . . 0.401 ' HA ' ' HD3' ' D' ' 359' ' ' PRO . 38.5 mt-10 -49.87 148.98 5.02 Favored Pre-proline 0 N--CA 1.49 1.557 0 O-C-N 121.222 -0.924 . . . . 5.71 109.547 -179.898 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' D' D ' 359' ' ' PRO . . . . . 0.401 ' HD3' ' HA ' ' D' ' 358' ' ' GLU . 2.5 Cg_endo -62.18 -160.35 0.03 OUTLIER 'Trans proline' 0 C--N 1.31 -1.48 0 C-N-CA 122.201 1.934 . . . . 4.97 110.278 -179.881 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' D' D ' 360' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.274 0 N-CA-C 109.516 -1.434 . . . . 6.97 109.516 179.983 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 319' ' ' LYS . . . . . . . . . . . . . 30.9 mttt . . . . . 0 N--CA 1.49 1.547 0 N-CA-C 109.329 -0.619 . . . . 7.55 109.329 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 320' ' ' LYS . . . . . . . . . . . . . 11.0 mttt 60.85 164.08 0.07 Allowed 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.194 -0.941 . . . . 6.43 109.392 -179.847 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 321' ' ' LYS . . . . . 0.483 ' HG2' ' HD2' ' A' ' 322' ' ' PRO . 0.0 OUTLIER -157.34 138.95 9.91 Favored Pre-proline 0 C--N 1.303 -1.445 0 O-C-N 121.362 -0.836 . . . . 6.13 109.075 179.571 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 322' ' ' PRO . . . . . 0.483 ' HD2' ' HG2' ' A' ' 321' ' ' LYS . 1.9 Cg_endo -63.19 -80.85 0.01 OUTLIER 'Trans proline' 0 C--N 1.311 -1.444 0 C-N-CA 122.159 1.906 . . . . 2.83 110.119 179.85 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 323' ' ' LEU . . . . . . . . . . . . . 38.8 mt -79.63 96.28 6.14 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.198 -0.939 . . . . 2.83 109.888 -179.722 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 324' ' ' ASP . . . . . . . . . . . . . 3.3 m-20 -80.17 156.07 27.13 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.378 -0.827 . . . . 1.53 109.563 179.741 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 325' ' ' GLY . . . . . 0.565 ' O ' ' CD2' ' A' ' 327' ' ' TYR . . . -68.99 176.41 29.89 Favored Glycine 0 N--CA 1.491 2.334 0 N-CA-C 109.6 -1.4 . . . . 0.61 109.6 179.866 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 326' ' ' GLU . . . . . . . . . . . . . 35.5 mm-40 -58.51 168.93 1.0 Allowed 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.156 -1.202 . . . . 2.13 109.241 179.747 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 327' ' ' TYR . . . . . 0.565 ' CD2' ' O ' ' A' ' 325' ' ' GLY . 49.7 m-85 -150.17 111.75 4.48 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.235 -0.916 . . . . 0.48 109.617 -179.892 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 328' ' ' PHE . . . . . 0.439 ' O ' HG23 ' A' ' 329' ' ' THR . 46.2 m-85 -112.56 -170.07 1.6 Allowed 'General case' 0 N--CA 1.488 1.465 0 O-C-N 121.358 -0.839 . . . . 0.31 109.425 179.934 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 329' ' ' THR . . . . . 0.485 ' HA ' ' O ' ' C' ' 330' ' ' LEU . 9.1 p -153.38 175.62 12.93 Favored 'General case' 0 N--CA 1.487 1.416 0 O-C-N 121.203 -0.936 . . . . 0.22 109.404 -179.899 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 330' ' ' LEU . . . . . 0.488 ' O ' ' HA ' ' C' ' 329' ' ' THR . 29.2 tp -151.49 133.46 15.06 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.192 -0.942 . . . . 0.28 109.665 -179.698 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 331' ' ' GLN . . . . . . . . . . . . . 1.9 tp60 -85.64 110.42 19.26 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.365 -0.834 . . . . 0.91 109.222 179.784 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 332' ' ' ILE . . . . . 0.859 HG21 ' HA ' ' A' ' 338' ' ' PHE . 83.0 mt -103.11 103.99 15.94 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.659 0 O-C-N 121.251 -0.906 . . . . 0.26 109.404 -179.772 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 333' ' ' ARG . . . . . 0.468 ' HG2' ' CE1' ' C' ' 327' ' ' TYR . 85.4 mtt180 -73.34 143.88 46.73 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.178 -0.951 . . . . 2.92 109.424 179.891 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 334' ' ' GLY . . . . . . . . . . . . . . . 88.99 131.94 4.24 Favored Glycine 0 N--CA 1.49 2.279 0 N-CA-C 109.636 -1.386 . . . . 0.4 109.636 179.932 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 335' ' ' ARG . . . . . . . . . . . . . 58.7 ttt180 -80.23 -41.19 25.58 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.304 -1.115 . . . . 3.01 109.76 -179.92 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 336' ' ' GLU . . . . . . . . . . . . . 2.4 tt0 -58.49 -59.25 5.66 Favored 'General case' 0 N--CA 1.489 1.492 0 O-C-N 121.179 -0.951 . . . . 2.29 109.685 -179.754 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 337' ' ' ARG . . . . . 0.492 ' NH2' HD12 ' C' ' 348' ' ' LEU . 1.0 OUTLIER -59.43 -33.29 71.06 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.235 -0.916 . . . . 2.93 109.422 179.993 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 338' ' ' PHE . . . . . 0.859 ' HA ' HG21 ' A' ' 332' ' ' ILE . 43.6 t80 -55.51 -56.74 16.8 Favored 'General case' 0 N--CA 1.488 1.425 0 O-C-N 121.219 -0.926 . . . . 0.38 109.456 179.95 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 339' ' ' GLU . . . . . . . . . . . . . 43.4 mt-10 -51.29 -30.9 19.51 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.23 -0.919 . . . . 1.97 109.925 179.979 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 340' ' ' MET . . . . . . . . . . . . . 6.1 ttp -63.34 -53.15 57.05 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.128 -0.983 . . . . 0.31 109.919 -179.505 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 341' ' ' PHE . . . . . . . . . . . . . 40.6 m-85 -62.03 -43.65 98.39 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.208 -0.933 . . . . 0.18 109.719 -179.918 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 342' ' ' ARG . . . . . 0.456 ' NH1' ' CG ' ' A' ' 342' ' ' ARG . 0.0 OUTLIER -49.58 -41.06 40.79 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.178 -0.951 . . . . 2.42 109.562 -179.924 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 343' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -59.68 -47.54 85.21 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.28 -0.887 . . . . 2.35 109.638 -179.816 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 344' ' ' LEU . . . . . . . . . . . . . 53.2 mt -62.24 -31.68 72.27 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.237 -0.914 . . . . 0.18 109.566 -179.81 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 345' ' ' ASN . . . . . . . . . . . . . 10.4 t-20 -57.11 -57.26 13.35 Favored 'General case' 0 N--CA 1.488 1.467 0 O-C-N 121.257 -0.902 . . . . 1.09 109.772 -179.95 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 346' ' ' GLU . . . . . . . . . . . . . 64.9 tt0 -61.74 -26.47 68.08 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.311 -0.868 . . . . 1.65 109.68 -179.851 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 347' ' ' ALA . . . . . 0.572 ' HB1' ' HB1' ' B' ' 347' ' ' ALA . . . -61.82 -61.18 2.69 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.229 -0.919 . . . . 0.18 110.064 -179.59 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 348' ' ' LEU . . . . . 0.564 HD22 ' N ' ' A' ' 348' ' ' LEU . 4.1 mm? -59.79 -44.84 93.75 Favored 'General case' 0 N--CA 1.493 1.725 0 O-C-N 121.137 -0.977 . . . . 0.3 109.825 -179.519 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 349' ' ' GLU . . . . . . . . . . . . . 92.8 mt-10 -57.95 -32.47 67.85 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.196 -0.94 . . . . 1.94 109.901 -179.571 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 350' ' ' LEU . . . . . 0.625 HD22 HD13 ' B' ' 350' ' ' LEU . 5.9 tt -64.03 -45.55 88.38 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.24 -0.913 . . . . 0.46 109.274 -179.894 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 351' ' ' LYS . . . . . . . . . . . . . 85.9 tttt -60.26 -41.57 93.52 Favored 'General case' 0 C--N 1.303 -1.454 0 O-C-N 121.436 -0.79 . . . . 1.4 109.319 179.991 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 352' ' ' ASP . . . . . . . . . . . . . 21.1 m-20 -57.83 -40.91 81.14 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.406 -0.809 . . . . 1.16 109.841 179.922 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 353' ' ' ALA . . . . . . . . . . . . . . . -66.99 -21.2 65.97 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.293 -0.879 . . . . 0.63 109.798 -179.602 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 354' ' ' GLN . . . . . . . . . . . . . 5.6 tt0 -82.76 -15.47 51.65 Favored 'General case' 0 C--N 1.302 -1.459 0 O-C-N 121.04 -1.038 . . . . 1.47 109.0 179.729 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 355' ' ' ALA . . . . . . . . . . . . . . . -72.62 -2.67 20.89 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.262 -0.898 . . . . 1.01 109.6 179.683 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 356' ' ' GLY . . . . . . . . . . . . . . . -77.69 -79.09 0.74 Allowed Glycine 0 N--CA 1.491 2.328 0 N-CA-C 110.0 -1.24 . . . . 1.3 110.0 -179.741 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 357' ' ' LYS . . . . . . . . . . . . . 3.7 mttp -85.37 105.47 16.04 Favored 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.235 -1.156 . . . . 4.1 109.858 -179.544 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 358' ' ' GLU . . . . . 0.493 ' HB2' ' HD2' ' A' ' 359' ' ' PRO . 17.0 pt-20 -53.34 159.71 2.09 Favored Pre-proline 0 N--CA 1.49 1.552 0 O-C-N 121.251 -0.906 . . . . 5.75 109.23 179.582 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 359' ' ' PRO . . . . . 0.493 ' HD2' ' HB2' ' A' ' 358' ' ' GLU . 2.6 Cg_endo -61.71 -164.43 0.04 OUTLIER 'Trans proline' 0 C--N 1.309 -1.513 0 C-N-CA 122.035 1.823 . . . . 5.0 110.261 179.665 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 360' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.357 0 CA-C-O 117.961 -1.466 . . . . 6.97 109.669 -179.707 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' B' B ' 319' ' ' LYS . . . . . . . . . . . . . 33.0 mttt . . . . . 0 N--CA 1.491 1.581 0 CA-C-O 121.326 0.584 . . . . 7.55 109.542 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' B' B ' 320' ' ' LYS . . . . . . . . . . . . . 11.7 mttt 61.43 165.04 0.09 Allowed 'General case' 0 N--CA 1.489 1.485 0 O-C-N 121.266 -0.896 . . . . 6.44 109.527 179.955 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 321' ' ' LYS . . . . . 0.485 ' HG2' ' HD2' ' B' ' 322' ' ' PRO . 0.0 OUTLIER -158.21 137.92 8.58 Favored Pre-proline 0 C--N 1.302 -1.472 0 O-C-N 121.308 -0.87 . . . . 6.13 109.121 179.717 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 322' ' ' PRO . . . . . 0.485 ' HD2' ' HG2' ' B' ' 321' ' ' LYS . 2.2 Cg_endo -62.37 -81.1 0.01 OUTLIER 'Trans proline' 0 C--N 1.308 -1.566 0 C-N-CA 121.997 1.798 . . . . 2.82 110.105 179.938 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 323' ' ' LEU . . . . . . . . . . . . . 37.6 mt -79.2 96.62 5.94 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.245 -0.91 . . . . 2.84 109.745 -179.686 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 324' ' ' ASP . . . . . . . . . . . . . 3.6 m-20 -80.77 156.4 26.23 Favored 'General case' 0 N--CA 1.489 1.477 0 O-C-N 121.341 -0.85 . . . . 1.53 109.483 179.668 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 325' ' ' GLY . . . . . 0.541 ' O ' ' CD2' ' B' ' 327' ' ' TYR . . . -69.16 177.49 28.46 Favored Glycine 0 N--CA 1.491 2.321 0 N-CA-C 109.557 -1.417 . . . . 0.59 109.557 179.9 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 326' ' ' GLU . . . . . . . . . . . . . 37.5 mm-40 -59.26 168.97 1.26 Allowed 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.145 -1.209 . . . . 2.13 109.224 179.806 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 327' ' ' TYR . . . . . 0.541 ' CD2' ' O ' ' B' ' 325' ' ' GLY . 50.4 m-85 -149.85 112.12 4.67 Favored 'General case' 0 N--CA 1.488 1.469 0 O-C-N 121.205 -0.934 . . . . 0.48 109.489 179.91 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 328' ' ' PHE . . . . . 0.431 ' O ' HG23 ' B' ' 329' ' ' THR . 47.6 m-85 -112.73 -170.21 1.62 Allowed 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.401 -0.812 . . . . 0.32 109.216 179.879 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 329' ' ' THR . . . . . 0.431 HG23 ' O ' ' B' ' 328' ' ' PHE . 9.3 p -153.41 175.51 13.06 Favored 'General case' 0 N--CA 1.489 1.485 0 O-C-N 121.282 -0.886 . . . . 0.23 109.315 -179.89 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 330' ' ' LEU . . . . . 0.46 ' O ' ' HA ' ' D' ' 329' ' ' THR . 27.1 tp -151.21 133.92 15.65 Favored 'General case' 0 N--CA 1.488 1.442 0 O-C-N 121.167 -0.958 . . . . 0.28 109.644 -179.761 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 331' ' ' GLN . . . . . . . . . . . . . 1.9 tp60 -85.79 110.18 19.18 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.416 -0.803 . . . . 0.91 109.158 179.839 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 332' ' ' ILE . . . . . 0.852 HG21 ' HA ' ' B' ' 338' ' ' PHE . 83.5 mt -103.07 103.29 14.87 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.668 0 O-C-N 121.249 -0.907 . . . . 0.24 109.72 -179.737 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 333' ' ' ARG . . . . . 0.425 ' HG2' ' CD1' ' D' ' 327' ' ' TYR . 85.0 mtt180 -72.72 143.95 47.84 Favored 'General case' 0 N--CA 1.489 1.481 0 O-C-N 121.252 -0.905 . . . . 2.93 109.492 179.834 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 334' ' ' GLY . . . . . . . . . . . . . . . 89.11 132.13 4.36 Favored Glycine 0 N--CA 1.492 2.377 0 N-CA-C 109.561 -1.415 . . . . 0.4 109.561 -179.95 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 335' ' ' ARG . . . . . . . . . . . . . 58.4 ttt180 -80.31 -41.7 24.39 Favored 'General case' 0 N--CA 1.489 1.481 0 O-C-N 121.221 -1.164 . . . . 3.01 109.53 -179.99 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 336' ' ' GLU . . . . . . . . . . . . . 2.5 tt0 -58.0 -59.68 4.9 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.27 -0.894 . . . . 2.28 109.685 -179.823 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 337' ' ' ARG . . . . . 0.609 ' CZ ' HD12 ' D' ' 348' ' ' LEU . 1.0 OUTLIER -58.86 -33.59 70.63 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.148 -0.97 . . . . 2.93 109.395 -179.872 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 338' ' ' PHE . . . . . 0.852 ' HA ' HG21 ' B' ' 332' ' ' ILE . 45.8 t80 -55.14 -56.72 16.75 Favored 'General case' 0 N--CA 1.487 1.397 0 O-C-N 121.324 -0.86 . . . . 0.37 109.623 179.963 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 339' ' ' GLU . . . . . . . . . . . . . 44.7 mt-10 -51.58 -30.46 20.98 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.205 -0.934 . . . . 1.98 109.984 -179.98 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 340' ' ' MET . . . . . . . . . . . . . 5.8 ttp -63.55 -53.71 47.51 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.177 -0.952 . . . . 0.32 109.784 -179.461 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 341' ' ' PHE . . . . . . . . . . . . . 39.8 m-85 -61.76 -43.84 98.06 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.282 -0.886 . . . . 0.18 109.637 -179.812 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 342' ' ' ARG . . . . . 0.449 ' CG ' HH11 ' B' ' 342' ' ' ARG . 0.1 OUTLIER -49.02 -41.7 35.62 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.258 -0.901 . . . . 2.42 109.711 -179.948 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 343' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -58.98 -48.69 80.66 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.266 -0.896 . . . . 2.35 109.599 -179.987 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 344' ' ' LEU . . . . . . . . . . . . . 59.6 mt -61.12 -31.18 70.89 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.253 -0.904 . . . . 0.18 109.807 -179.753 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 345' ' ' ASN . . . . . . . . . . . . . 10.5 t-20 -57.95 -56.91 15.92 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.192 -0.943 . . . . 1.09 109.681 -179.833 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 346' ' ' GLU . . . . . . . . . . . . . 62.4 tt0 -62.02 -26.38 68.2 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.226 -0.921 . . . . 1.66 109.572 -179.768 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 347' ' ' ALA . . . . . 0.572 ' HB1' ' HB1' ' A' ' 347' ' ' ALA . . . -61.86 -60.62 3.38 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.192 -0.943 . . . . 0.17 110.202 -179.687 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 348' ' ' LEU . . . . . 0.954 HD12 ' NH2' ' D' ' 337' ' ' ARG . 4.2 mm? -60.27 -45.16 94.27 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.045 -1.034 . . . . 0.29 109.683 -179.441 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 349' ' ' GLU . . . . . . . . . . . . . 93.2 mt-10 -57.34 -33.36 67.67 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.386 -0.821 . . . . 1.95 109.863 -179.649 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 350' ' ' LEU . . . . . 0.625 HD13 HD22 ' A' ' 350' ' ' LEU . 5.9 tt -63.13 -46.63 86.36 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.122 -0.986 . . . . 0.45 109.167 179.988 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 351' ' ' LYS . . . . . . . . . . . . . 87.5 tttt -59.23 -41.41 88.64 Favored 'General case' 0 N--CA 1.488 1.462 0 O-C-N 121.244 -0.91 . . . . 1.38 109.455 179.856 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 352' ' ' ASP . . . . . . . . . . . . . 21.1 m-20 -58.11 -40.99 82.59 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.095 -1.003 . . . . 1.16 110.06 -179.874 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 353' ' ' ALA . . . . . . . . . . . . . . . -66.48 -21.98 66.19 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.251 -0.905 . . . . 0.61 109.66 -179.64 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 354' ' ' GLN . . . . . . . . . . . . . 5.5 tt0 -82.14 -14.82 55.12 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.205 -0.934 . . . . 1.45 109.241 179.853 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 355' ' ' ALA . . . . . . . . . . . . . . . -73.09 -2.81 22.86 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.239 -0.913 . . . . 0.98 109.539 179.682 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 356' ' ' GLY . . . . . . . . . . . . . . . -77.51 -79.25 0.72 Allowed Glycine 0 N--CA 1.491 2.328 0 N-CA-C 109.989 -1.244 . . . . 1.29 109.989 -179.538 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 357' ' ' LYS . . . . . . . . . . . . . 3.4 mttp -85.74 104.47 15.48 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.282 -1.128 . . . . 4.09 110.213 -179.28 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 358' ' ' GLU . . . . . 0.475 ' HB2' ' HD2' ' B' ' 359' ' ' PRO . 17.0 pt-20 -52.04 159.02 1.56 Allowed Pre-proline 0 N--CA 1.491 1.599 0 O-C-N 121.276 -0.89 . . . . 5.72 109.484 179.6 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 359' ' ' PRO . . . . . 0.475 ' HD2' ' HB2' ' B' ' 358' ' ' GLU . 2.9 Cg_endo -61.61 -164.2 0.04 OUTLIER 'Trans proline' 0 C--N 1.309 -1.516 0 C-N-CA 122.094 1.863 . . . . 4.98 110.018 179.756 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 360' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 2.405 0 CA-C-O 117.878 -1.512 . . . . 6.98 109.597 -179.884 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' C' C ' 319' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.491 1.583 0 N-CA-C 109.279 -0.637 . . . . 6.82 109.279 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 320' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 60.54 94.29 0.04 OUTLIER 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.271 -0.893 . . . . 6.49 109.81 179.572 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' C' C ' 321' ' ' LYS . . . . . 0.626 ' CB ' ' HD3' ' C' ' 322' ' ' PRO . 0.0 OUTLIER -160.13 -65.38 0.02 OUTLIER Pre-proline 0 N--CA 1.493 1.676 0 O-C-N 121.085 -1.009 . . . . 6.4 109.844 179.473 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' C' C ' 322' ' ' PRO . . . . . 0.626 ' HD3' ' CB ' ' C' ' 321' ' ' LYS . 3.4 Cg_exo -57.93 -151.0 0.01 OUTLIER 'Trans proline' 0 C--N 1.315 -1.219 0 C-N-CA 121.708 1.605 . . . . 3.42 110.079 179.648 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' C' C ' 323' ' ' LEU . . . . . . . . . . . . . 96.4 mt -77.34 141.66 39.76 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.199 -0.938 . . . . 3.95 109.114 179.697 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 324' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 -77.69 -172.81 2.74 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.2 -0.938 . . . . 1.63 109.711 -179.698 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 325' ' ' GLY . . . . . 0.47 ' O ' ' CE2' ' C' ' 327' ' ' TYR . . . -69.83 176.96 31.92 Favored Glycine 0 N--CA 1.491 2.318 0 N-CA-C 110.223 -1.151 . . . . 0.73 110.223 -179.591 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' C' C ' 326' ' ' GLU . . . . . . . . . . . . . 45.0 mt-10 -59.68 -178.53 0.07 Allowed 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.278 -1.131 . . . . 2.17 109.763 179.921 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 327' ' ' TYR . . . . . 0.47 ' CE2' ' O ' ' C' ' 325' ' ' GLY . 59.1 m-85 -150.77 108.04 3.61 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.39 -0.819 . . . . 0.48 109.507 -179.905 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' C' C ' 328' ' ' PHE . . . . . 0.411 ' C ' HG23 ' C' ' 329' ' ' THR . 67.3 m-85 -104.12 -164.02 1.02 Allowed 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.201 -0.937 . . . . 0.33 109.825 -179.885 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' C' C ' 329' ' ' THR . . . . . 0.488 ' HA ' ' O ' ' A' ' 330' ' ' LEU . 56.1 p -156.28 177.8 11.03 Favored 'General case' 0 N--CA 1.491 1.589 0 N-CA-C 108.997 -0.742 . . . . 0.23 108.997 179.748 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' C' C ' 330' ' ' LEU . . . . . 0.485 ' O ' ' HA ' ' A' ' 329' ' ' THR . 39.3 tp -153.48 132.09 12.23 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 120.949 -1.095 . . . . 0.28 109.492 179.823 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' C' C ' 331' ' ' GLN . . . . . . . . . . . . . 1.1 tp60 -87.56 114.04 23.81 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.133 -0.979 . . . . 1.48 109.547 179.791 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 332' ' ' ILE . . . . . 0.762 HG21 ' HA ' ' C' ' 338' ' ' PHE . 48.5 mt -103.91 108.28 24.23 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.526 0 O-C-N 121.197 -0.939 . . . . 0.24 109.728 -179.933 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' C' C ' 333' ' ' ARG . . . . . 0.462 ' HG2' ' CE1' ' A' ' 327' ' ' TYR . 5.1 mtp180 -72.89 144.98 47.18 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.006 -1.058 . . . . 2.74 109.488 179.848 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' C' C ' 334' ' ' GLY . . . . . . . . . . . . . . . 73.05 130.92 0.15 Allowed Glycine 0 N--CA 1.491 2.322 0 N-CA-C 109.93 -1.268 . . . . 0.35 109.93 179.794 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 335' ' ' ARG . . . . . 0.49 ' O ' ' HB3' ' C' ' 338' ' ' PHE . 2.4 ttp180 -73.45 -27.77 61.6 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.238 -1.154 . . . . 2.53 109.667 179.922 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' C' C ' 336' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -57.08 -58.82 6.52 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 120.961 -1.087 . . . . 2.62 109.158 -179.987 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' C' C ' 337' ' ' ARG . . . . . 0.555 ' HG3' ' NH1' ' C' ' 337' ' ' ARG . 0.5 OUTLIER -60.95 -30.83 70.47 Favored 'General case' 0 N--CA 1.488 1.474 0 O-C-N 121.296 -0.877 . . . . 2.81 108.776 179.618 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' C' C ' 338' ' ' PHE . . . . . 0.762 ' HA ' HG21 ' C' ' 332' ' ' ILE . 82.6 t80 -54.89 -58.66 6.68 Favored 'General case' 0 C--N 1.304 -1.378 0 O-C-N 121.345 -0.847 . . . . 0.4 109.646 -179.835 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' C' C ' 339' ' ' GLU . . . . . . . . . . . . . 41.2 mt-10 -50.97 -32.63 21.62 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.07 -1.018 . . . . 2.05 109.989 -179.657 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 340' ' ' MET . . . . . . . . . . . . . 29.8 ttp -65.37 -56.24 13.71 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.242 -0.911 . . . . 0.32 110.208 -179.472 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 341' ' ' PHE . . . . . . . . . . . . . 63.9 m-85 -61.44 -53.51 55.53 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.091 -1.006 . . . . 0.18 110.155 -179.416 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 342' ' ' ARG . . . . . 0.438 ' NH1' ' CG ' ' C' ' 342' ' ' ARG . 0.0 OUTLIER -44.8 -41.15 6.73 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.255 -0.903 . . . . 2.91 110.051 -179.265 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' C' C ' 343' ' ' GLU . . . . . . . . . . . . . 36.6 tt0 -57.89 -51.42 69.67 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.162 -0.961 . . . . 2.14 109.77 -179.91 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 344' ' ' LEU . . . . . . . . . . . . . 55.8 mt -62.73 -26.87 68.9 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.329 -0.857 . . . . 0.22 109.7 179.983 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 345' ' ' ASN . . . . . . . . . . . . . 13.2 t-20 -58.0 -58.54 7.96 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.281 -0.887 . . . . 1.08 109.501 -179.957 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 346' ' ' GLU . . . . . . . . . . . . . 10.0 tp10 -62.2 -28.88 69.99 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.456 -0.778 . . . . 2.21 109.722 -179.667 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 347' ' ' ALA . . . . . 0.675 ' HB1' ' HB1' ' D' ' 347' ' ' ALA . . . -60.7 -57.79 11.21 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.103 -0.998 . . . . 0.18 109.984 -179.72 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' C' C ' 348' ' ' LEU . . . . . 0.526 HD22 ' N ' ' C' ' 348' ' ' LEU . 3.5 mm? -62.5 -45.8 91.35 Favored 'General case' 0 N--CA 1.494 1.761 0 O-C-N 121.096 -1.002 . . . . 0.32 110.044 -179.494 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' C' C ' 349' ' ' GLU . . . . . . . . . . . . . 1.3 mm-40 -55.02 -36.02 65.04 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.276 -0.89 . . . . 2.19 109.886 -179.223 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 350' ' ' LEU . . . . . 0.598 HD22 HD13 ' D' ' 350' ' ' LEU . 7.0 tt -63.46 -46.88 84.22 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.355 -0.841 . . . . 0.46 109.894 -179.632 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' C' C ' 351' ' ' LYS . . . . . . . . . . . . . 22.8 tttt -58.32 -40.24 81.55 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.355 -0.841 . . . . 1.35 109.672 -179.66 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 352' ' ' ASP . . . . . . . . . . . . . 52.0 m-20 -57.12 -51.69 68.29 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.361 -0.837 . . . . 1.19 109.925 179.993 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 353' ' ' ALA . . . . . . . . . . . . . . . -66.07 -12.44 55.44 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.154 -0.966 . . . . 0.57 109.923 -179.233 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 354' ' ' GLN . . . . . . . . . . . . . 8.9 tt0 -85.68 -27.46 25.33 Favored 'General case' 0 N--CA 1.488 1.47 0 O-C-N 121.183 -0.948 . . . . 1.47 109.577 179.872 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 355' ' ' ALA . . . . . . . . . . . . . . . -73.16 -4.26 31.7 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.313 -0.867 . . . . 0.93 109.55 179.849 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 356' ' ' GLY . . . . . . . . . . . . . . . -58.72 -59.01 11.58 Favored Glycine 0 N--CA 1.492 2.402 0 N-CA-C 109.697 -1.361 . . . . 1.33 109.697 -179.628 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 357' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -86.12 63.89 8.27 Favored 'General case' 0 N--CA 1.488 1.447 0 O-C-N 121.295 -1.121 . . . . 4.01 109.302 -179.924 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' C' C ' 358' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -51.16 141.19 21.01 Favored Pre-proline 0 N--CA 1.49 1.538 0 O-C-N 121.32 -0.863 . . . . 5.75 109.61 -179.842 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' C' C ' 359' ' ' PRO . . . . . . . . . . . . . 1.7 Cg_endo -63.81 105.01 0.5 Allowed 'Trans proline' 0 C--N 1.312 -1.36 0 C-N-CA 122.156 1.904 . . . . 4.94 110.047 179.915 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 360' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.336 0 N-CA-C 109.639 -1.385 . . . . 6.5 109.639 -179.916 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' D' D ' 319' ' ' LYS . . . . . . . . . . . . . 33.6 mttt . . . . . 0 N--CA 1.49 1.569 0 N-CA-C 109.431 -0.581 . . . . 7.53 109.431 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' D' D ' 320' ' ' LYS . . . . . . . . . . . . . 11.6 mttt 62.36 164.64 0.1 Allowed 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.258 -0.901 . . . . 6.41 109.345 -179.981 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' D' D ' 321' ' ' LYS . . . . . 0.46 ' HG2' ' HD2' ' D' ' 322' ' ' PRO . 0.0 OUTLIER -158.02 137.85 8.66 Favored Pre-proline 0 N--CA 1.489 1.52 0 O-C-N 121.344 -0.847 . . . . 6.11 109.175 179.945 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' D' D ' 322' ' ' PRO . . . . . 0.46 ' HD2' ' HG2' ' D' ' 321' ' ' LYS . 2.2 Cg_endo -62.31 -80.98 0.01 OUTLIER 'Trans proline' 0 C--N 1.311 -1.439 0 C-N-CA 121.934 1.756 . . . . 2.82 110.003 179.908 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' D' D ' 323' ' ' LEU . . . . . . . . . . . . . 34.3 mt -78.92 96.68 5.77 Favored 'General case' 0 N--CA 1.488 1.454 0 O-C-N 121.188 -0.945 . . . . 2.83 109.96 -179.708 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' D' D ' 324' ' ' ASP . . . . . . . . . . . . . 3.5 m-20 -81.01 156.45 25.9 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.283 -0.886 . . . . 1.54 109.41 179.731 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' D' D ' 325' ' ' GLY . . . . . 0.554 ' O ' ' CD2' ' D' ' 327' ' ' TYR . . . -69.5 176.71 31.18 Favored Glycine 0 N--CA 1.491 2.355 0 N-CA-C 109.458 -1.457 . . . . 0.59 109.458 -179.955 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' D' D ' 326' ' ' GLU . . . . . . . . . . . . . 38.1 mm-40 -58.6 168.78 1.08 Allowed 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.26 -1.141 . . . . 2.13 109.237 179.939 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' D' D ' 327' ' ' TYR . . . . . 0.554 ' CD2' ' O ' ' D' ' 325' ' ' GLY . 49.0 m-85 -149.67 111.92 4.67 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.22 -0.925 . . . . 0.47 109.553 179.977 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' D' D ' 328' ' ' PHE . . . . . 0.422 ' O ' HG23 ' D' ' 329' ' ' THR . 50.6 m-85 -112.12 -170.12 1.6 Allowed 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.265 -0.897 . . . . 0.3 109.206 179.856 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' D' D ' 329' ' ' THR . . . . . 0.46 ' HA ' ' O ' ' B' ' 330' ' ' LEU . 9.8 p -153.2 175.7 12.76 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.231 -0.918 . . . . 0.22 109.147 -179.85 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' D' D ' 330' ' ' LEU . . . . . . . . . . . . . 26.0 tp -151.63 134.03 15.35 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.116 -0.99 . . . . 0.28 109.631 -179.762 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' D' D ' 331' ' ' GLN . . . . . . . . . . . . . 1.9 tp60 -85.81 110.28 19.26 Favored 'General case' 0 N--CA 1.488 1.454 0 O-C-N 121.248 -0.907 . . . . 0.93 109.31 179.88 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' D' D ' 332' ' ' ILE . . . . . 0.853 HG21 ' HA ' ' D' ' 338' ' ' PHE . 86.1 mt -102.85 103.37 14.97 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.573 0 O-C-N 121.226 -0.921 . . . . 0.25 109.541 -179.819 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' D' D ' 333' ' ' ARG . . . . . . . . . . . . . 84.9 mtt180 -73.09 143.31 47.44 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.25 -0.906 . . . . 2.93 109.498 179.81 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' D' D ' 334' ' ' GLY . . . . . . . . . . . . . . . 89.16 131.65 4.22 Favored Glycine 0 N--CA 1.49 2.278 0 N-CA-C 109.49 -1.444 . . . . 0.41 109.49 -179.907 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' D' D ' 335' ' ' ARG . . . . . . . . . . . . . 55.9 ttt180 -79.77 -41.71 26.01 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.352 -1.087 . . . . 3.03 109.835 -179.672 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' D' D ' 336' ' ' GLU . . . . . . . . . . . . . 2.8 tt0 -58.26 -58.73 7.19 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.25 -0.906 . . . . 2.26 109.736 -179.724 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' D' D ' 337' ' ' ARG . . . . . 0.954 ' NH2' HD12 ' B' ' 348' ' ' LEU . 0.9 OUTLIER -59.75 -33.25 71.42 Favored 'General case' 0 N--CA 1.489 1.478 0 O-C-N 121.28 -0.887 . . . . 2.92 109.354 -179.965 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' D' D ' 338' ' ' PHE . . . . . 0.853 ' HA ' HG21 ' D' ' 332' ' ' ILE . 45.7 t80 -55.5 -57.03 13.57 Favored 'General case' 0 N--CA 1.489 1.478 0 O-C-N 121.22 -0.925 . . . . 0.37 109.435 179.978 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' D' D ' 339' ' ' GLU . . . . . . . . . . . . . 45.3 mt-10 -51.25 -31.37 20.69 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.229 -0.919 . . . . 1.99 109.726 -179.856 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' D' D ' 340' ' ' MET . . . . . . . . . . . . . 5.3 ttp -62.59 -53.96 46.8 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.223 -0.923 . . . . 0.31 109.859 -179.576 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' D' D ' 341' ' ' PHE . . . . . . . . . . . . . 40.2 m-85 -61.74 -43.38 98.97 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.145 -0.972 . . . . 0.18 109.692 -179.727 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' D' D ' 342' ' ' ARG . . . . . 0.441 ' CG ' HH11 ' D' ' 342' ' ' ARG . 0.1 OUTLIER -49.51 -41.13 40.14 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.268 -0.895 . . . . 2.41 109.608 -179.789 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' D' D ' 343' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -59.36 -48.0 83.3 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.293 -0.88 . . . . 2.35 109.647 -179.862 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' D' D ' 344' ' ' LEU . . . . . . . . . . . . . 57.4 mt -61.99 -30.94 71.28 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.171 -0.956 . . . . 0.19 109.815 -179.777 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' D' D ' 345' ' ' ASN . . . . . . . . . . . . . 10.6 t-20 -57.91 -57.4 12.98 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.157 -0.964 . . . . 1.09 109.559 -179.913 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' D' D ' 346' ' ' GLU . . . . . . . . . . . . . 60.3 tt0 -61.55 -26.63 68.07 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.104 -0.997 . . . . 1.69 109.543 -179.854 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' D' D ' 347' ' ' ALA . . . . . 0.675 ' HB1' ' HB1' ' C' ' 347' ' ' ALA . . . -60.94 -61.58 2.48 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.137 -0.977 . . . . 0.18 110.136 -179.784 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' D' D ' 348' ' ' LEU . . . . . 0.609 HD12 ' CZ ' ' B' ' 337' ' ' ARG . 4.2 mm? -60.03 -44.13 94.83 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.164 -0.96 . . . . 0.31 109.946 -179.495 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' D' D ' 349' ' ' GLU . . . . . . . . . . . . . 92.8 mt-10 -58.08 -33.1 68.7 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.067 -1.02 . . . . 1.95 109.851 -179.542 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' D' D ' 350' ' ' LEU . . . . . 0.598 HD13 HD22 ' C' ' 350' ' ' LEU . 5.9 tt -63.52 -45.99 88.08 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.201 -0.937 . . . . 0.43 109.352 -179.975 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' D' D ' 351' ' ' LYS . . . . . . . . . . . . . 88.1 tttt -59.68 -41.61 91.08 Favored 'General case' 0 N--CA 1.488 1.456 0 O-C-N 121.298 -0.876 . . . . 1.4 109.383 179.957 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' D' D ' 352' ' ' ASP . . . . . . . . . . . . . 20.9 m-20 -58.17 -40.42 81.41 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.399 -0.813 . . . . 1.17 109.881 179.955 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' D' D ' 353' ' ' ALA . . . . . . . . . . . . . . . -67.56 -20.86 65.45 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.203 -0.936 . . . . 0.59 109.602 -179.39 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' D' D ' 354' ' ' GLN . . . . . . . . . . . . . 5.6 tt0 -83.35 -14.27 53.23 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.1 -1.0 . . . . 1.44 109.169 179.708 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' D' D ' 355' ' ' ALA . . . . . . . . . . . . . . . -73.52 -1.82 20.13 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.453 -0.78 . . . . 0.98 109.502 179.47 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' D' D ' 356' ' ' GLY . . . . . . . . . . . . . . . -78.84 -78.98 0.81 Allowed Glycine 0 N--CA 1.49 2.288 0 N-CA-C 110.085 -1.206 . . . . 1.28 110.085 -179.532 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' D' D ' 357' ' ' LYS . . . . . . . . . . . . . 3.0 mttp -86.05 106.12 16.97 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.346 -1.091 . . . . 4.09 109.718 -179.507 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' D' D ' 358' ' ' GLU . . . . . 0.479 ' HB2' ' HD2' ' D' ' 359' ' ' PRO . 17.0 pt-20 -53.44 159.21 2.41 Favored Pre-proline 0 N--CA 1.491 1.58 0 O-C-N 121.414 -0.804 . . . . 5.71 109.433 179.636 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' D' D ' 359' ' ' PRO . . . . . 0.479 ' HD2' ' HB2' ' D' ' 358' ' ' GLU . 2.9 Cg_endo -61.73 -164.31 0.04 OUTLIER 'Trans proline' 0 C--N 1.309 -1.501 0 C-N-CA 121.934 1.756 . . . . 4.97 109.857 179.776 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' D' D ' 360' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.226 0 N-CA-C 109.484 -1.446 . . . . 6.97 109.484 179.745 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 319' ' ' LYS . . . . . . . . . . . . . 31.1 mttm . . . . . 0 N--CA 1.49 1.555 0 N-CA-C 109.528 -0.545 . . . . 7.55 109.528 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 320' ' ' LYS . . . . . 0.462 ' O ' ' HG3' ' A' ' 321' ' ' LYS . 0.4 OUTLIER 53.97 66.41 1.24 Allowed 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.304 -0.872 . . . . 6.43 109.889 179.984 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 321' ' ' LYS . . . . . 0.622 ' CB ' ' HD3' ' A' ' 322' ' ' PRO . 15.9 mttt -162.06 -64.09 0.02 OUTLIER Pre-proline 0 C--N 1.301 -1.53 0 O-C-N 121.133 -0.98 . . . . 6.13 109.739 179.582 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 322' ' ' PRO . . . . . 0.622 ' HD3' ' CB ' ' A' ' 321' ' ' LYS . 3.3 Cg_exo -57.0 -81.18 0.01 OUTLIER 'Trans proline' 0 C--N 1.311 -1.414 0 C-N-CA 121.79 1.66 . . . . 2.83 110.555 179.783 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 323' ' ' LEU . . . . . . . . . . . . . 62.9 mt -78.27 92.73 4.53 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 120.882 -1.136 . . . . 2.83 109.775 -179.592 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 324' ' ' ASP . . . . . . . . . . . . . 70.1 m-20 -80.38 165.75 21.94 Favored 'General case' 0 C--N 1.303 -1.427 0 O-C-N 121.23 -0.919 . . . . 1.53 109.277 179.788 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 325' ' ' GLY . . . . . 0.45 ' O ' ' CE2' ' A' ' 327' ' ' TYR . . . -68.33 174.0 31.69 Favored Glycine 0 N--CA 1.489 2.214 0 N-CA-C 109.232 -1.547 . . . . 0.61 109.232 -179.793 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 326' ' ' GLU . . . . . . . . . . . . . 2.9 mm-40 -57.5 173.64 0.26 Allowed 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.152 -1.205 . . . . 2.13 109.343 -179.773 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 327' ' ' TYR . . . . . 0.45 ' CE2' ' O ' ' A' ' 325' ' ' GLY . 44.0 m-85 -149.61 112.21 4.76 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.24 -0.912 . . . . 0.48 109.643 179.994 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 328' ' ' PHE . . . . . 0.496 ' CE2' ' HB2' ' C' ' 335' ' ' ARG . 95.9 m-85 -114.26 -168.07 1.31 Allowed 'General case' 0 N--CA 1.488 1.465 0 O-C-N 121.236 -0.915 . . . . 0.31 109.316 179.957 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 329' ' ' THR . . . . . . . . . . . . . 40.2 p -152.77 162.14 41.65 Favored 'General case' 0 N--CA 1.489 1.482 0 O-C-N 121.284 -0.885 . . . . 0.22 109.575 179.927 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 330' ' ' LEU . . . . . 0.54 HD21 ' HB2' ' C' ' 345' ' ' ASN . 18.4 tp -150.58 130.52 13.38 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.375 -0.828 . . . . 0.28 109.433 -179.958 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 331' ' ' GLN . . . . . 0.418 ' HG3' ' O ' ' C' ' 328' ' ' PHE . 1.5 tt0 -86.81 118.38 26.17 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.265 -0.897 . . . . 0.91 109.439 179.903 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 332' ' ' ILE . . . . . 0.584 HD12 ' CD1' ' A' ' 338' ' ' PHE . 9.9 mt -103.46 110.6 30.39 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.527 0 O-C-N 121.286 -0.884 . . . . 0.26 109.673 179.988 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 333' ' ' ARG . . . . . 0.572 ' HG2' ' CE2' ' C' ' 327' ' ' TYR . 44.7 mtt180 -72.92 149.31 43.52 Favored 'General case' 0 C--N 1.303 -1.448 0 O-C-N 121.373 -0.83 . . . . 2.92 109.238 179.728 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 334' ' ' GLY . . . . . . . . . . . . . . . 85.65 129.65 2.29 Favored Glycine 0 N--CA 1.49 2.251 0 N-CA-C 109.619 -1.392 . . . . 0.4 109.619 -179.982 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 335' ' ' ARG . . . . . 0.44 ' O ' ' HB3' ' A' ' 338' ' ' PHE . 31.5 ttp180 -78.92 -44.52 22.45 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.361 -1.082 . . . . 3.01 109.758 -179.92 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 336' ' ' GLU . . . . . . . . . . . . . 1.3 tt0 -58.7 -57.34 13.45 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.231 -0.918 . . . . 2.29 109.717 -179.743 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 337' ' ' ARG . . . . . 0.455 ' NH1' ' CG ' ' A' ' 337' ' ' ARG . 0.0 OUTLIER -59.21 -31.3 68.91 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.278 -0.889 . . . . 2.93 109.523 -179.83 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 338' ' ' PHE . . . . . 0.584 ' CD1' HD12 ' A' ' 332' ' ' ILE . 60.2 t80 -54.74 -55.86 25.42 Favored 'General case' 0 N--CA 1.489 1.48 0 O-C-N 121.114 -0.991 . . . . 0.38 109.442 179.993 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 339' ' ' GLU . . . . . . . . . . . . . 13.7 mt-10 -51.41 -35.31 38.58 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.196 -0.94 . . . . 1.97 109.903 -179.798 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 340' ' ' MET . . . . . . . . . . . . . 26.2 ttp -63.11 -50.04 72.06 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.222 -0.923 . . . . 0.31 110.068 -179.474 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 341' ' ' PHE . . . . . 0.482 ' HZ ' HD23 ' C' ' 348' ' ' LEU . 41.1 m-85 -61.21 -46.16 91.6 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.12 -0.988 . . . . 0.18 109.561 -179.806 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 342' ' ' ARG . . . . . 0.47 ' NH1' ' CG ' ' A' ' 342' ' ' ARG . 0.0 OUTLIER -51.03 -37.55 45.95 Favored 'General case' 0 C--N 1.301 -1.506 0 O-C-N 121.278 -0.889 . . . . 2.42 109.627 -179.933 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 343' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -59.49 -51.7 68.74 Favored 'General case' 0 N--CA 1.489 1.483 0 O-C-N 121.257 -0.902 . . . . 2.35 109.694 -179.488 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 344' ' ' LEU . . . . . 0.941 HD22 HD22 ' B' ' 344' ' ' LEU . 53.6 mt -60.9 -33.78 73.65 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.308 -0.87 . . . . 0.18 109.375 179.984 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 345' ' ' ASN . . . . . 0.666 ' HB2' HD21 ' C' ' 330' ' ' LEU . 28.5 t-20 -57.95 -56.31 23.6 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.233 -0.917 . . . . 1.09 109.802 -179.984 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 346' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -61.39 -32.79 72.73 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.278 -0.889 . . . . 1.65 110.034 -179.56 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 347' ' ' ALA . . . . . 0.627 ' HB1' ' HB1' ' B' ' 347' ' ' ALA . . . -58.75 -55.1 39.41 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.061 -1.024 . . . . 0.18 109.948 -179.773 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 348' ' ' LEU . . . . . 0.536 HD22 ' N ' ' A' ' 348' ' ' LEU . 4.1 mm? -60.61 -46.45 90.21 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.125 -0.985 . . . . 0.3 109.594 -179.717 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 349' ' ' GLU . . . . . 0.491 ' HG2' ' NH1' ' C' ' 333' ' ' ARG . 1.7 mt-10 -58.11 -29.87 65.83 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.128 -0.982 . . . . 1.94 110.02 -179.648 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 350' ' ' LEU . . . . . 0.629 ' C ' HD23 ' A' ' 350' ' ' LEU . 6.4 tt -64.09 -48.98 74.06 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.028 -1.045 . . . . 0.46 109.173 179.774 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 351' ' ' LYS . . . . . . . . . . . . . 19.3 tttt -58.98 -41.79 88.45 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.421 -0.799 . . . . 1.4 109.447 179.833 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 352' ' ' ASP . . . . . . . . . . . . . 15.1 m-20 -56.7 -39.23 73.48 Favored 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.399 -0.813 . . . . 1.16 109.537 -179.947 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 353' ' ' ALA . . . . . . . . . . . . . . . -66.73 -32.63 74.05 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.294 -0.879 . . . . 0.63 109.611 -179.875 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 354' ' ' GLN . . . . . . . . . . . . . 7.2 tt0 -81.09 -1.15 43.1 Favored 'General case' 0 C--N 1.303 -1.451 0 O-C-N 121.23 -0.919 . . . . 1.47 109.629 -179.989 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 355' ' ' ALA . . . . . . . . . . . . . . . -70.88 -39.06 73.06 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.162 -0.961 . . . . 1.01 110.126 -179.725 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 356' ' ' GLY . . . . . . . . . . . . . . . -80.06 -8.36 87.71 Favored Glycine 0 N--CA 1.491 2.317 0 N-CA-C 109.956 -1.258 . . . . 1.3 109.956 -179.757 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 357' ' ' LYS . . . . . . . . . . . . . 24.4 mttt -89.32 105.35 17.73 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.164 -1.197 . . . . 4.1 109.315 179.641 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 358' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -49.29 143.72 9.26 Favored Pre-proline 0 N--CA 1.488 1.436 0 O-C-N 121.221 -0.924 . . . . 5.75 109.394 -179.991 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 359' ' ' PRO . . . . . . . . . . . . . 1.1 Cg_endo -65.09 -81.81 0.01 OUTLIER 'Trans proline' 0 C--N 1.309 -1.534 0 C-N-CA 122.264 1.976 . . . . 5.0 110.052 -179.969 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 360' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.229 0 CA-C-O 117.94 -1.478 . . . . 6.97 109.478 179.957 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' B' B ' 319' ' ' LYS . . . . . . . . . . . . . 30.4 mttm . . . . . 0 N--CA 1.49 1.544 0 N-CA-C 109.727 -0.471 . . . . 7.55 109.727 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' B' B ' 320' ' ' LYS . . . . . 0.456 ' O ' ' HG3' ' B' ' 321' ' ' LYS . 0.4 OUTLIER 53.16 66.67 1.16 Allowed 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.023 -1.048 . . . . 6.44 110.071 179.768 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' B' B ' 321' ' ' LYS . . . . . 0.624 ' CB ' ' HD3' ' B' ' 322' ' ' PRO . 16.3 mttt -162.6 -63.95 0.01 OUTLIER Pre-proline 0 N--CA 1.492 1.627 0 O-C-N 120.988 -1.07 . . . . 6.13 109.629 179.289 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 322' ' ' PRO . . . . . 0.624 ' HD3' ' CB ' ' B' ' 321' ' ' LYS . 4.0 Cg_exo -56.69 -80.98 0.01 OUTLIER 'Trans proline' 0 C--N 1.315 -1.224 0 C-N-CA 121.811 1.674 . . . . 2.82 110.763 179.537 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 323' ' ' LEU . . . . . . . . . . . . . 63.5 mt -79.29 92.8 5.18 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 120.971 -1.081 . . . . 2.84 109.655 -179.59 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 324' ' ' ASP . . . . . . . . . . . . . 74.9 m-20 -80.32 164.12 23.39 Favored 'General case' 0 N--CA 1.49 1.525 0 O-C-N 121.272 -0.893 . . . . 1.53 109.416 179.613 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 325' ' ' GLY . . . . . 0.458 ' O ' ' CE2' ' B' ' 327' ' ' TYR . . . -66.19 173.13 24.72 Favored Glycine 0 N--CA 1.493 2.446 0 N-CA-C 109.464 -1.454 . . . . 0.59 109.464 179.841 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 326' ' ' GLU . . . . . . . . . . . . . 3.0 mm-40 -57.14 173.15 0.24 Allowed 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.171 -1.193 . . . . 2.13 109.372 -179.931 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 327' ' ' TYR . . . . . 0.562 ' CE1' ' HG2' ' D' ' 333' ' ' ARG . 42.7 m-85 -149.1 111.57 4.73 Favored 'General case' 0 N--CA 1.488 1.458 0 O-C-N 121.254 -0.904 . . . . 0.48 109.62 -179.834 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 328' ' ' PHE . . . . . 0.542 ' CE2' ' HA ' ' D' ' 335' ' ' ARG . 95.3 m-85 -113.72 -167.65 1.23 Allowed 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.245 -0.909 . . . . 0.32 109.415 179.904 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 329' ' ' THR . . . . . . . . . . . . . 38.9 p -153.5 161.35 42.33 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.174 -0.954 . . . . 0.23 109.601 -179.642 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 330' ' ' LEU . . . . . 0.625 HD21 ' HB2' ' D' ' 345' ' ' ASN . 16.3 tp -150.41 131.46 14.36 Favored 'General case' 0 N--CA 1.488 1.432 0 O-C-N 121.235 -0.916 . . . . 0.28 109.249 179.932 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 331' ' ' GLN . . . . . . . . . . . . . 1.5 tt0 -87.25 118.58 26.77 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.368 -0.832 . . . . 0.91 109.495 -179.917 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 332' ' ' ILE . . . . . 0.576 HD12 ' CD1' ' B' ' 338' ' ' PHE . 10.8 mt -103.59 110.14 29.13 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.496 0 O-C-N 121.166 -0.959 . . . . 0.24 109.7 -179.798 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 333' ' ' ARG . . . . . 0.499 ' HG2' ' CE1' ' D' ' 327' ' ' TYR . 46.6 mtt180 -72.65 148.81 44.42 Favored 'General case' 0 N--CA 1.487 1.381 0 O-C-N 121.19 -0.944 . . . . 2.93 109.323 179.585 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 334' ' ' GLY . . . . . . . . . . . . . . . 86.17 129.4 2.43 Favored Glycine 0 N--CA 1.49 2.277 0 N-CA-C 109.553 -1.419 . . . . 0.4 109.553 179.848 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 335' ' ' ARG . . . . . 0.463 ' O ' ' HB3' ' B' ' 338' ' ' PHE . 31.8 ttp180 -78.5 -45.11 22.78 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.242 -1.152 . . . . 3.01 110.016 -179.844 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 336' ' ' GLU . . . . . . . . . . . . . 1.3 tt0 -58.45 -56.86 16.66 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.153 -0.967 . . . . 2.28 109.651 -179.706 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 337' ' ' ARG . . . . . 0.434 ' CG ' HH11 ' B' ' 337' ' ' ARG . 0.0 OUTLIER -59.09 -31.4 68.87 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.294 -0.879 . . . . 2.93 109.544 -179.793 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' B' B ' 338' ' ' PHE . . . . . 0.576 ' CD1' HD12 ' B' ' 332' ' ' ILE . 60.9 t80 -55.02 -55.82 26.62 Favored 'General case' 0 N--CA 1.488 1.441 0 O-C-N 121.33 -0.856 . . . . 0.37 109.417 179.971 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 339' ' ' GLU . . . . . . . . . . . . . 15.4 mt-10 -51.74 -34.96 41.53 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.333 -0.855 . . . . 1.98 109.789 -179.882 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 340' ' ' MET . . . . . . . . . . . . . 28.8 ttp -63.2 -50.57 69.78 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.105 -0.997 . . . . 0.32 109.909 -179.641 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 341' ' ' PHE . . . . . 0.458 ' HB2' HD13 ' B' ' 332' ' ' ILE . 42.7 m-85 -60.62 -46.32 90.72 Favored 'General case' 0 N--CA 1.494 1.725 0 O-C-N 121.079 -1.013 . . . . 0.18 109.842 -179.906 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 342' ' ' ARG . . . . . 0.465 ' NH1' ' CG ' ' B' ' 342' ' ' ARG . 0.0 OUTLIER -50.86 -38.07 47.13 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.219 -0.926 . . . . 2.42 109.651 -179.862 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' B' B ' 343' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -58.8 -51.83 68.32 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.239 -0.913 . . . . 2.35 109.76 -179.823 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 344' ' ' LEU . . . . . 0.941 HD22 HD22 ' A' ' 344' ' ' LEU . 52.6 mt -61.39 -32.94 72.88 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.182 -0.949 . . . . 0.18 109.53 -179.839 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 345' ' ' ASN . . . . . 0.517 ' HB2' HD21 ' D' ' 330' ' ' LEU . 28.8 t-20 -58.48 -56.58 20.23 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.301 -0.874 . . . . 1.09 109.573 -179.996 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 346' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -61.31 -32.12 71.97 Favored 'General case' 0 C--N 1.301 -1.54 0 O-C-N 121.417 -0.802 . . . . 1.66 110.086 -179.52 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 347' ' ' ALA . . . . . 0.627 ' HB1' ' HB1' ' A' ' 347' ' ' ALA . . . -59.15 -55.18 38.32 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.246 -0.909 . . . . 0.17 109.914 -179.577 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 348' ' ' LEU . . . . . 0.528 HD22 ' N ' ' B' ' 348' ' ' LEU . 4.1 mm? -60.61 -45.71 93.0 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.252 -0.905 . . . . 0.29 109.856 -179.717 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 349' ' ' GLU . . . . . . . . . . . . . 1.8 mt-10 -58.74 -29.84 67.04 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.137 -0.977 . . . . 1.95 109.762 -179.482 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 350' ' ' LEU . . . . . 0.602 HD23 ' C ' ' B' ' 350' ' ' LEU . 6.4 tt -64.11 -48.87 74.42 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.26 -0.9 . . . . 0.45 109.159 179.651 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 351' ' ' LYS . . . . . . . . . . . . . 19.4 tttt -59.54 -41.67 90.59 Favored 'General case' 0 C--N 1.302 -1.462 0 O-C-N 121.348 -0.845 . . . . 1.38 109.437 179.966 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 352' ' ' ASP . . . . . . . . . . . . . 16.7 m-20 -56.55 -39.13 72.91 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.217 -0.927 . . . . 1.16 109.515 179.8 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 353' ' ' ALA . . . . . . . . . . . . . . . -66.76 -33.31 75.35 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.253 -0.904 . . . . 0.61 109.759 -179.91 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 354' ' ' GLN . . . . . . . . . . . . . 7.4 tt0 -80.55 -1.29 41.36 Favored 'General case' 0 N--CA 1.489 1.484 0 O-C-N 121.239 -0.913 . . . . 1.45 109.491 179.927 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 355' ' ' ALA . . . . . . . . . . . . . . . -70.51 -38.52 74.31 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.187 -0.946 . . . . 0.98 110.114 -179.761 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 356' ' ' GLY . . . . . . . . . . . . . . . -80.37 -8.91 87.12 Favored Glycine 0 N--CA 1.491 2.354 0 N-CA-C 109.762 -1.335 . . . . 1.29 109.762 -179.434 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 357' ' ' LYS . . . . . . . . . . . . . 23.5 mttt -89.12 106.15 18.25 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.116 -1.226 . . . . 4.09 109.492 179.854 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 358' ' ' GLU . . . . . 0.404 ' HA ' ' HD3' ' B' ' 359' ' ' PRO . 0.0 OUTLIER -49.49 143.61 10.1 Favored Pre-proline 0 N--CA 1.491 1.611 0 O-C-N 121.314 -0.867 . . . . 5.72 109.569 -179.877 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' B' B ' 359' ' ' PRO . . . . . 0.404 ' HD3' ' HA ' ' B' ' 358' ' ' GLU . 1.3 Cg_endo -65.13 -82.69 0.01 OUTLIER 'Trans proline' 0 C--N 1.311 -1.439 0 C-N-CA 121.895 1.73 . . . . 4.98 109.967 179.935 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 360' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.362 0 CA-C-O 117.984 -1.453 . . . . 6.98 109.481 179.788 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' C' C ' 319' ' ' LYS . . . . . 0.422 ' O ' ' HB2' ' C' ' 320' ' ' LYS . 0.0 OUTLIER . . . . . 0 N--CA 1.493 1.71 0 CA-C-O 121.297 0.57 . . . . 6.82 109.484 . . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' C' C ' 320' ' ' LYS . . . . . 0.422 ' HB2' ' O ' ' C' ' 319' ' ' LYS . 4.5 mtmp? 62.33 -97.64 0.07 Allowed 'General case' 0 N--CA 1.488 1.459 0 O-C-N 121.443 -0.786 . . . . 6.49 109.516 -179.99 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' C' C ' 321' ' ' LYS . . . . . 0.48 ' O ' ' O ' ' C' ' 322' ' ' PRO . 3.2 mtmm -159.32 82.98 2.42 Favored Pre-proline 0 N--CA 1.489 1.513 0 O-C-N 120.967 -1.083 . . . . 6.4 109.744 179.938 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' C' C ' 322' ' ' PRO . . . . . 0.48 ' O ' ' O ' ' C' ' 321' ' ' LYS . 3.5 Cg_exo -56.43 -144.0 0.0 OUTLIER 'Trans proline' 0 C--N 1.309 -1.521 0 C-N-CA 122.311 2.007 . . . . 3.42 109.836 179.537 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' C' C ' 323' ' ' LEU . . . . . . . . . . . . . 78.8 mt -74.94 139.39 42.99 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 120.667 -1.271 . . . . 3.95 108.909 -179.969 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 324' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -77.78 166.15 23.29 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.322 -0.861 . . . . 1.63 109.391 -179.666 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 325' ' ' GLY . . . . . . . . . . . . . . . -66.85 -174.59 6.45 Favored Glycine 0 N--CA 1.49 2.246 0 N-CA-C 109.374 -1.491 . . . . 0.73 109.374 179.97 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 326' ' ' GLU . . . . . . . . . . . . . 16.1 mm-40 -58.82 -169.41 0.01 OUTLIER 'General case' 0 N--CA 1.488 1.458 0 O-C-N 121.343 -1.092 . . . . 2.17 109.56 179.976 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 327' ' ' TYR . . . . . 0.572 ' CE2' ' HG2' ' A' ' 333' ' ' ARG . 46.4 m-85 -148.89 111.85 4.87 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.269 -0.895 . . . . 0.48 109.799 -179.978 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' C' C ' 328' ' ' PHE . . . . . 0.449 ' O ' HG23 ' C' ' 329' ' ' THR . 93.5 m-85 -111.12 -167.03 1.13 Allowed 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.236 -0.915 . . . . 0.33 109.538 -179.924 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' C' C ' 329' ' ' THR . . . . . 0.449 HG23 ' O ' ' C' ' 328' ' ' PHE . 10.8 p -154.11 167.53 29.53 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.283 -0.886 . . . . 0.23 109.705 -179.434 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' C' C ' 330' ' ' LEU . . . . . 0.666 HD21 ' HB2' ' A' ' 345' ' ' ASN . 20.2 tp -152.5 132.06 13.04 Favored 'General case' 0 N--CA 1.489 1.525 0 O-C-N 121.15 -0.969 . . . . 0.28 109.89 179.886 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' C' C ' 331' ' ' GLN . . . . . . . . . . . . . 1.2 tt0 -89.23 116.96 27.85 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.337 -0.852 . . . . 1.48 109.428 179.79 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 332' ' ' ILE . . . . . 0.565 HG21 ' HA ' ' C' ' 338' ' ' PHE . 59.9 mt -103.85 115.96 46.74 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.783 0 O-C-N 121.151 -0.968 . . . . 0.24 109.805 -179.892 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' C' C ' 333' ' ' ARG . . . . . 0.491 ' NH1' ' HG2' ' A' ' 349' ' ' GLU . 0.1 OUTLIER -75.06 144.87 42.77 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.258 -0.901 . . . . 2.74 109.727 179.684 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' C' C ' 334' ' ' GLY . . . . . . . . . . . . . . . 82.53 123.7 0.79 Allowed Glycine 0 N--CA 1.491 2.36 0 C-N-CA 120.005 -1.093 . . . . 0.35 110.472 179.307 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 335' ' ' ARG . . . . . 0.504 ' HG2' ' NH1' ' C' ' 335' ' ' ARG . 0.4 OUTLIER -73.4 -31.19 63.73 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.372 -1.075 . . . . 2.53 109.034 179.438 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' C' C ' 336' ' ' GLU . . . . . 0.459 ' OE1' ' HG3' ' C' ' 337' ' ' ARG . 14.1 tm-20 -59.29 -63.57 1.26 Allowed 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.277 -0.889 . . . . 2.62 109.052 179.747 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' C' C ' 337' ' ' ARG . . . . . 0.459 ' HG3' ' OE1' ' C' ' 336' ' ' GLU . 4.0 mtt180 -60.75 -26.21 67.05 Favored 'General case' 0 N--CA 1.487 1.422 0 O-C-N 121.308 -0.87 . . . . 2.81 109.358 179.65 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' C' C ' 338' ' ' PHE . . . . . 0.565 ' HA ' HG21 ' C' ' 332' ' ' ILE . 86.4 t80 -54.86 -62.2 1.81 Allowed 'General case' 0 C--N 1.305 -1.344 0 O-C-N 121.279 -0.888 . . . . 0.4 109.379 -179.97 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' C' C ' 339' ' ' GLU . . . . . . . . . . . . . 34.2 mt-10 -51.1 -31.58 19.71 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.227 -0.921 . . . . 2.05 110.032 -179.587 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 340' ' ' MET . . . . . 0.434 ' HB3' ' O ' ' C' ' 337' ' ' ARG . 7.1 ttp -63.93 -53.54 48.77 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.213 -0.929 . . . . 0.32 109.841 -179.756 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' C' C ' 341' ' ' PHE . . . . . 0.442 ' HB2' HD13 ' C' ' 332' ' ' ILE . 33.5 m-85 -61.19 -42.53 98.75 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.194 -0.941 . . . . 0.18 109.815 -179.661 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' C' C ' 342' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -46.6 -43.57 17.45 Favored 'General case' 0 C--N 1.301 -1.519 0 O-C-N 121.187 -0.946 . . . . 2.91 109.496 -179.823 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' C' C ' 343' ' ' GLU . . . . . . . . . . . . . 15.8 tp10 -61.45 -40.28 93.9 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 120.988 -1.07 . . . . 2.14 109.635 179.884 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 344' ' ' LEU . . . . . 0.553 ' CD2' HD22 ' D' ' 344' ' ' LEU . 43.6 mt -63.31 -52.93 59.89 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.156 -0.965 . . . . 0.22 109.77 -179.756 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' C' C ' 345' ' ' ASN . . . . . 0.54 ' HB2' HD21 ' A' ' 330' ' ' LEU . 38.2 t30 -53.86 -44.91 70.76 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.277 -0.889 . . . . 1.08 109.656 -179.759 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' C' C ' 346' ' ' GLU . . . . . . . . . . . . . 3.2 tp10 -62.17 -37.58 85.81 Favored 'General case' 0 N--CA 1.488 1.435 0 O-C-N 121.209 -0.932 . . . . 2.21 109.823 -179.93 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 347' ' ' ALA . . . . . 0.721 ' HB1' ' HB1' ' D' ' 347' ' ' ALA . . . -59.35 -47.59 84.86 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.184 -0.948 . . . . 0.18 109.516 -179.662 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' C' C ' 348' ' ' LEU . . . . . 0.541 HD22 ' N ' ' C' ' 348' ' ' LEU . 3.9 mm? -63.66 -42.72 98.05 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.258 -0.901 . . . . 0.32 109.706 179.933 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' C' C ' 349' ' ' GLU . . . . . 0.404 ' OE1' ' CZ ' ' A' ' 333' ' ' ARG . 5.4 mm-40 -57.54 -39.14 75.95 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.046 -1.034 . . . . 2.19 109.341 179.996 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' C' C ' 350' ' ' LEU . . . . . 0.626 HD22 HD13 ' D' ' 350' ' ' LEU . 6.4 tt -61.31 -43.71 98.42 Favored 'General case' 0 N--CA 1.488 1.458 0 O-C-N 121.539 -0.726 . . . . 0.46 109.323 -179.992 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' C' C ' 351' ' ' LYS . . . . . . . . . . . . . 8.9 tttp -60.96 -41.91 97.25 Favored 'General case' 0 C--N 1.304 -1.395 0 O-C-N 121.116 -0.99 . . . . 1.35 109.085 179.867 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 352' ' ' ASP . . . . . . . . . . . . . 77.2 m-20 -52.76 -58.15 7.81 Favored 'General case' 0 N--CA 1.488 1.449 0 O-C-N 121.382 -0.824 . . . . 1.19 109.239 179.898 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 353' ' ' ALA . . . . . . . . . . . . . . . -69.49 -15.49 63.27 Favored 'General case' 0 N--CA 1.489 1.478 0 O-C-N 121.276 -0.89 . . . . 0.57 109.457 -179.956 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 354' ' ' GLN . . . . . 0.56 ' NE2' HD11 ' D' ' 350' ' ' LEU . 0.0 OUTLIER -86.21 -15.43 40.92 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.263 -0.898 . . . . 1.47 109.616 179.991 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' C' C ' 355' ' ' ALA . . . . . . . . . . . . . . . -72.25 -18.97 61.78 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.078 -1.014 . . . . 0.93 109.186 179.697 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 356' ' ' GLY . . . . . . . . . . . . . . . -81.26 -1.46 90.04 Favored Glycine 0 N--CA 1.491 2.363 0 N-CA-C 109.601 -1.399 . . . . 1.33 109.601 179.778 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 357' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -86.91 22.62 1.95 Allowed 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.017 -1.284 . . . . 4.01 109.963 -179.617 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' C' C ' 358' ' ' GLU . . . . . 0.581 ' N ' ' HD2' ' C' ' 359' ' ' PRO . 0.1 OUTLIER -49.12 -53.17 41.43 Favored Pre-proline 0 N--CA 1.489 1.486 0 O-C-N 120.896 -1.127 . . . . 5.75 109.629 179.637 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' C' C ' 359' ' ' PRO . . . . . 0.581 ' HD2' ' N ' ' C' ' 358' ' ' GLU . 5.8 Cg_exo -60.74 -169.05 0.05 OUTLIER 'Trans proline' 0 C--N 1.31 -1.476 0 C-N-CA 121.855 1.703 . . . . 4.94 110.329 -179.898 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' C' C ' 360' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.227 0 CA-C-O 117.951 -1.471 . . . . 6.5 109.68 -179.843 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' D' D ' 319' ' ' LYS . . . . . . . . . . . . . 30.0 mttm . . . . . 0 N--CA 1.491 1.601 0 CA-C-O 121.102 0.477 . . . . 7.53 109.889 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' D' D ' 320' ' ' LYS . . . . . 0.455 ' O ' ' HG3' ' D' ' 321' ' ' LYS . 0.3 OUTLIER 53.4 65.59 1.47 Allowed 'General case' 0 N--CA 1.494 1.742 0 O-C-N 121.138 -0.976 . . . . 6.41 110.227 179.868 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' D' D ' 321' ' ' LYS . . . . . 0.62 ' CB ' ' HD3' ' D' ' 322' ' ' PRO . 16.4 mttt -162.03 -63.73 0.02 OUTLIER Pre-proline 0 N--CA 1.491 1.593 0 O-C-N 121.246 -0.909 . . . . 6.11 109.968 179.25 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' D' D ' 322' ' ' PRO . . . . . 0.62 ' HD3' ' CB ' ' D' ' 321' ' ' LYS . 4.8 Cg_exo -56.43 -80.77 0.01 OUTLIER 'Trans proline' 0 C--N 1.313 -1.32 0 C-N-CA 121.94 1.76 . . . . 2.82 110.716 179.846 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' D' D ' 323' ' ' LEU . . . . . . . . . . . . . 64.6 mt -79.95 93.36 5.69 Favored 'General case' 0 N--CA 1.488 1.456 0 O-C-N 121.096 -1.002 . . . . 2.83 109.417 -179.587 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' D' D ' 324' ' ' ASP . . . . . . . . . . . . . 76.2 m-20 -80.75 165.26 22.1 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.499 -0.751 . . . . 1.54 109.396 179.827 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' D' D ' 325' ' ' GLY . . . . . 0.453 ' O ' ' CE2' ' D' ' 327' ' ' TYR . . . -67.36 173.74 28.53 Favored Glycine 0 N--CA 1.491 2.326 0 N-CA-C 109.615 -1.394 . . . . 0.59 109.615 -179.932 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' D' D ' 326' ' ' GLU . . . . . . . . . . . . . 3.3 mm-40 -57.43 173.5 0.26 Allowed 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.033 -1.275 . . . . 2.13 109.348 -179.769 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' D' D ' 327' ' ' TYR . . . . . 0.499 ' CE1' ' HG2' ' B' ' 333' ' ' ARG . 43.3 m-85 -149.75 111.37 4.51 Favored 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.012 -1.055 . . . . 0.47 109.436 179.959 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' D' D ' 328' ' ' PHE . . . . . 0.453 ' CE2' ' HA ' ' B' ' 335' ' ' ARG . 97.1 m-85 -113.4 -167.67 1.23 Allowed 'General case' 0 N--CA 1.488 1.472 0 O-C-N 121.375 -0.828 . . . . 0.3 109.184 -179.791 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' D' D ' 329' ' ' THR . . . . . . . . . . . . . 37.9 p -153.55 161.68 41.98 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.209 -0.932 . . . . 0.22 109.464 -179.957 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' D' D ' 330' ' ' LEU . . . . . 0.517 HD21 ' HB2' ' B' ' 345' ' ' ASN . 17.7 tp -150.48 130.89 13.78 Favored 'General case' 0 N--CA 1.488 1.474 0 O-C-N 121.464 -0.773 . . . . 0.28 109.473 -179.9 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' D' D ' 331' ' ' GLN . . . . . 0.435 ' HG3' ' O ' ' B' ' 328' ' ' PHE . 1.6 tt0 -86.69 119.87 27.38 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.017 -1.052 . . . . 0.93 109.325 179.835 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' D' D ' 332' ' ' ILE . . . . . 0.574 HD12 ' CD1' ' D' ' 338' ' ' PHE . 12.4 mt -104.4 109.58 27.86 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.564 0 O-C-N 121.094 -1.004 . . . . 0.25 109.636 -179.894 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' D' D ' 333' ' ' ARG . . . . . 0.562 ' HG2' ' CE1' ' B' ' 327' ' ' TYR . 46.1 mtt180 -72.28 149.97 44.01 Favored 'General case' 0 C--N 1.302 -1.465 0 O-C-N 121.106 -0.996 . . . . 2.93 109.209 179.827 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' D' D ' 334' ' ' GLY . . . . . . . . . . . . . . . 85.53 129.63 2.25 Favored Glycine 0 N--CA 1.493 2.486 0 N-CA-C 109.645 -1.382 . . . . 0.41 109.645 -179.911 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' D' D ' 335' ' ' ARG . . . . . 0.542 ' HA ' ' CE2' ' B' ' 328' ' ' PHE . 32.2 ttp180 -78.82 -45.96 19.75 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.007 -1.29 . . . . 3.03 109.647 179.898 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' D' D ' 336' ' ' GLU . . . . . . . . . . . . . 1.3 tt0 -57.65 -56.63 19.48 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.101 -0.999 . . . . 2.26 109.665 -179.821 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' D' D ' 337' ' ' ARG . . . . . 0.422 ' NH1' ' CG ' ' D' ' 337' ' ' ARG . 0.0 OUTLIER -59.32 -31.2 68.94 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.159 -0.963 . . . . 2.92 109.669 -179.769 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' D' D ' 338' ' ' PHE . . . . . 0.574 ' CD1' HD12 ' D' ' 332' ' ' ILE . 61.2 t80 -55.26 -54.98 36.69 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.292 -0.88 . . . . 0.37 109.532 179.923 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' D' D ' 339' ' ' GLU . . . . . . . . . . . . . 17.1 mt-10 -52.36 -34.62 48.47 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.197 -0.94 . . . . 1.99 109.756 -179.687 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' D' D ' 340' ' ' MET . . . . . . . . . . . . . 31.1 ttp -63.52 -49.92 71.61 Favored 'General case' 0 N--CA 1.488 1.466 0 O-C-N 121.23 -0.919 . . . . 0.31 109.966 -179.616 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' D' D ' 341' ' ' PHE . . . . . 0.456 ' HB2' HD13 ' D' ' 332' ' ' ILE . 42.1 m-85 -61.37 -47.05 87.63 Favored 'General case' 0 N--CA 1.488 1.467 0 O-C-N 121.108 -0.995 . . . . 0.18 109.551 -179.687 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' D' D ' 342' ' ' ARG . . . . . 0.459 ' NH1' ' CG ' ' D' ' 342' ' ' ARG . 0.0 OUTLIER -50.24 -37.87 37.78 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.175 -0.953 . . . . 2.41 109.86 -179.876 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' D' D ' 343' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -59.07 -51.58 69.42 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.303 -0.873 . . . . 2.35 109.673 -179.701 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' D' D ' 344' ' ' LEU . . . . . 0.553 HD22 ' CD2' ' C' ' 344' ' ' LEU . 56.1 mt -61.52 -33.03 73.12 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.191 -0.943 . . . . 0.19 109.455 179.959 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' D' D ' 345' ' ' ASN . . . . . 0.625 ' HB2' HD21 ' B' ' 330' ' ' LEU . 29.3 t-20 -58.38 -56.29 24.01 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.258 -0.901 . . . . 1.09 109.718 179.932 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' D' D ' 346' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -61.63 -32.61 72.76 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.421 -0.8 . . . . 1.69 109.92 -179.634 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' D' D ' 347' ' ' ALA . . . . . 0.721 ' HB1' ' HB1' ' C' ' 347' ' ' ALA . . . -58.4 -55.22 37.86 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.053 -1.029 . . . . 0.18 109.827 -179.701 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' D' D ' 348' ' ' LEU . . . . . 0.531 HD22 ' N ' ' D' ' 348' ' ' LEU . 4.2 mm? -61.02 -46.47 90.62 Favored 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.17 -0.956 . . . . 0.31 109.844 -179.46 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' D' D ' 349' ' ' GLU . . . . . 0.42 ' OE2' ' ND2' ' D' ' 345' ' ' ASN . 1.8 mt-10 -57.85 -29.89 65.36 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.184 -0.947 . . . . 1.95 109.736 -179.582 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' D' D ' 350' ' ' LEU . . . . . 0.626 HD13 HD22 ' C' ' 350' ' ' LEU . 6.3 tt -63.88 -49.37 72.97 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.099 -1.001 . . . . 0.43 109.292 179.853 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' D' D ' 351' ' ' LYS . . . . . . . . . . . . . 19.8 tttt -59.19 -42.14 90.15 Favored 'General case' 0 C--N 1.303 -1.449 0 O-C-N 121.47 -0.769 . . . . 1.4 109.403 179.78 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' D' D ' 352' ' ' ASP . . . . . . . . . . . . . 17.8 m-20 -56.1 -38.85 71.3 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.396 -0.815 . . . . 1.17 109.562 179.601 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' D' D ' 353' ' ' ALA . . . . . . . . . . . . . . . -67.19 -33.49 75.5 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.116 -0.99 . . . . 0.59 109.608 -179.909 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' D' D ' 354' ' ' GLN . . . . . . . . . . . . . 7.6 tt0 -80.68 -0.51 38.55 Favored 'General case' 0 N--CA 1.488 1.475 0 O-C-N 121.131 -0.98 . . . . 1.44 109.497 -179.934 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' D' D ' 355' ' ' ALA . . . . . . . . . . . . . . . -71.29 -37.41 71.84 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.197 -0.94 . . . . 0.98 110.116 -179.742 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' D' D ' 356' ' ' GLY . . . . . . . . . . . . . . . -80.86 -8.87 87.0 Favored Glycine 0 N--CA 1.492 2.398 0 N-CA-C 110.02 -1.232 . . . . 1.28 110.02 -179.591 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' D' D ' 357' ' ' LYS . . . . . . . . . . . . . 22.6 mttt -89.34 107.35 19.02 Favored 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.217 -1.167 . . . . 4.09 109.455 179.761 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' D' D ' 358' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -50.19 144.05 11.85 Favored Pre-proline 0 N--CA 1.489 1.505 0 O-C-N 121.288 -0.882 . . . . 5.71 109.483 -179.892 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' D' D ' 359' ' ' PRO . . . . . . . . . . . . . 1.1 Cg_endo -64.85 -82.68 0.01 OUTLIER 'Trans proline' 0 C--N 1.31 -1.462 0 C-N-CA 122.008 1.805 . . . . 4.97 110.008 179.916 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' D' D ' 360' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.255 0 CA-C-O 117.91 -1.495 . . . . 6.97 109.513 179.826 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 319' ' ' LYS . . . . . 0.429 ' O ' ' O ' ' A' ' 320' ' ' LYS . 13.0 mtmt . . . . . 0 N--CA 1.491 1.6 0 N-CA-C 109.365 -0.606 . . . . 7.55 109.365 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 320' ' ' LYS . . . . . 0.429 ' O ' ' O ' ' A' ' 319' ' ' LYS . 6.0 tttp 59.86 114.36 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.232 -0.917 . . . . 6.43 109.593 179.983 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 321' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -158.93 92.06 1.95 Allowed Pre-proline 0 N--CA 1.49 1.558 0 O-C-N 121.254 -0.904 . . . . 6.13 109.474 179.937 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 322' ' ' PRO . . . . . . . . . . . . . 2.2 Cg_endo -62.07 -47.2 10.9 Favored 'Trans proline' 0 C--N 1.31 -1.476 0 C-N-CA 122.113 1.875 . . . . 2.83 109.956 179.982 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 323' ' ' LEU . . . . . . . . . . . . . 19.6 mt -81.33 96.43 7.31 Favored 'General case' 0 N--CA 1.49 1.525 0 O-C-N 121.309 -0.869 . . . . 2.83 109.415 179.903 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 324' ' ' ASP . . . . . . . . . . . . . 8.1 m-20 -80.18 148.82 30.73 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.174 -0.953 . . . . 1.53 109.091 179.839 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 325' ' ' GLY . . . . . 0.466 ' O ' ' CE2' ' A' ' 327' ' ' TYR . . . -67.44 171.87 32.41 Favored Glycine 0 N--CA 1.49 2.273 0 N-CA-C 109.052 -1.619 . . . . 0.61 109.052 179.959 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 326' ' ' GLU . . . . . . . . . . . . . 3.0 mt-10 -56.7 174.36 0.16 Allowed 'General case' 0 N--CA 1.488 1.454 0 O-C-N 121.109 -1.23 . . . . 2.13 109.07 -179.893 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 327' ' ' TYR . . . . . 0.466 ' CE2' ' O ' ' A' ' 325' ' ' GLY . 47.3 m-85 -148.83 111.4 4.75 Favored 'General case' 0 N--CA 1.489 1.476 0 O-C-N 121.256 -0.902 . . . . 0.48 109.527 -179.835 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 328' ' ' PHE . . . . . 0.411 ' CE2' ' HA ' ' C' ' 335' ' ' ARG . 86.4 m-85 -113.87 -168.47 1.35 Allowed 'General case' 0 N--CA 1.488 1.451 0 O-C-N 121.347 -0.845 . . . . 0.31 109.532 -179.808 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 329' ' ' THR . . . . . 0.459 ' HA ' ' O ' ' C' ' 330' ' ' LEU . 24.4 p -153.56 165.21 36.61 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.346 -0.846 . . . . 0.22 109.078 179.94 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 330' ' ' LEU . . . . . 0.587 HD21 HD22 ' C' ' 345' ' ' ASN . 14.7 tp -151.47 131.33 13.29 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.045 -1.034 . . . . 0.28 109.877 -179.803 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 331' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -87.55 120.77 29.19 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.279 -0.888 . . . . 0.91 109.165 179.615 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 332' ' ' ILE . . . . . 0.647 HD12 ' CD1' ' A' ' 338' ' ' PHE . 59.6 mt -103.56 111.1 32.0 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.548 0 O-C-N 121.235 -0.916 . . . . 0.26 109.664 -179.794 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 333' ' ' ARG . . . . . 0.443 ' NH1' ' CG ' ' A' ' 333' ' ' ARG . 0.0 OUTLIER -72.59 139.56 47.51 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.403 -0.811 . . . . 2.92 109.35 179.83 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 334' ' ' GLY . . . . . . . . . . . . . . . 85.76 136.6 4.09 Favored Glycine 0 N--CA 1.49 2.251 0 N-CA-C 109.697 -1.361 . . . . 0.4 109.697 179.878 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 335' ' ' ARG . . . . . 0.492 ' NH1' ' HG3' ' A' ' 335' ' ' ARG . 0.3 OUTLIER -80.11 -36.17 35.74 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.405 -1.056 . . . . 3.01 109.582 -179.921 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 336' ' ' GLU . . . . . . . . . . . . . 52.2 tt0 -58.58 -57.24 13.84 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.238 -0.914 . . . . 2.29 110.052 -179.634 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 337' ' ' ARG . . . . . 0.552 ' HG3' ' NH1' ' A' ' 337' ' ' ARG . 0.6 OUTLIER -60.0 -30.36 69.09 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.117 -0.989 . . . . 2.93 109.815 -179.625 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 338' ' ' PHE . . . . . 0.647 ' CD1' HD12 ' A' ' 332' ' ' ILE . 88.8 t80 -54.34 -62.99 1.29 Allowed 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.214 -0.929 . . . . 0.38 109.756 -179.73 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 339' ' ' GLU . . . . . . . . . . . . . 80.9 mt-10 -51.88 -31.46 28.22 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.211 -0.93 . . . . 1.97 110.205 -179.667 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 340' ' ' MET . . . . . . . . . . . . . 28.0 ttp -63.8 -53.62 47.94 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.134 -0.979 . . . . 0.31 110.121 -179.432 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 341' ' ' PHE . . . . . . . . . . . . . 39.2 m-85 -62.25 -48.59 79.26 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.171 -0.955 . . . . 0.18 110.023 -179.533 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 342' ' ' ARG . . . . . . . . . . . . . 70.3 ttt180 -48.85 -38.38 22.17 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.161 -0.962 . . . . 2.42 109.858 -179.71 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 343' ' ' GLU . . . . . . . . . . . . . 42.5 tt0 -59.42 -49.45 77.77 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.157 -0.964 . . . . 2.35 109.896 -179.705 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 344' ' ' LEU . . . . . 0.458 HD22 ' CD2' ' B' ' 344' ' ' LEU . 42.2 mt -61.32 -37.96 85.14 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.092 -1.005 . . . . 0.18 109.714 -179.597 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 345' ' ' ASN . . . . . 0.446 ' HA ' ' CZ ' ' C' ' 341' ' ' PHE . 60.6 t-20 -57.01 -50.37 72.94 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.165 -0.959 . . . . 1.09 109.675 -179.936 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 346' ' ' GLU . . . . . . . . . . . . . 2.7 tt0 -60.71 -34.44 74.38 Favored 'General case' 0 N--CA 1.489 1.49 0 O-C-N 121.263 -0.898 . . . . 1.65 109.894 -179.755 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 347' ' ' ALA . . . . . 0.878 ' HB1' ' HB1' ' B' ' 347' ' ' ALA . . . -60.84 -51.65 68.42 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.128 -0.982 . . . . 0.18 110.047 -179.771 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 348' ' ' LEU . . . . . 0.541 HD22 ' N ' ' A' ' 348' ' ' LEU . 3.9 mm? -61.41 -44.84 96.44 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.165 -0.96 . . . . 0.3 110.003 -179.508 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 349' ' ' GLU . . . . . . . . . . . . . 39.3 mt-10 -58.02 -40.58 81.17 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.27 -0.894 . . . . 1.94 110.337 -179.281 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 350' ' ' LEU . . . . . 0.614 ' C ' HD23 ' A' ' 350' ' ' LEU . 8.5 tt -63.59 -48.37 77.67 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.16 -0.963 . . . . 0.46 109.977 -179.317 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 351' ' ' LYS . . . . . . . . . . . . . 25.3 tttt -55.43 -41.84 73.35 Favored 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.259 -0.901 . . . . 1.4 109.329 -179.548 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 352' ' ' ASP . . . . . . . . . . . . . 23.0 m-20 -59.36 -48.32 82.07 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.38 -0.825 . . . . 1.16 109.778 179.902 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 353' ' ' ALA . . . . . . . . . . . . . . . -67.49 -9.5 42.82 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.29 -0.881 . . . . 0.63 110.177 -179.419 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 354' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -83.91 -28.23 28.05 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.051 -1.03 . . . . 1.47 109.628 -179.945 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 355' ' ' ALA . . . . . . . . . . . . . . . -73.79 -21.36 60.19 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.256 -0.903 . . . . 1.01 109.545 179.8 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 356' ' ' GLY . . . . . . . . . . . . . . . -81.91 31.04 2.84 Favored Glycine 0 N--CA 1.493 2.48 0 N-CA-C 110.544 -1.022 . . . . 1.3 110.544 179.936 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 357' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -87.28 124.92 33.85 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 120.831 -1.393 . . . . 4.1 109.43 -179.897 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 358' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -49.9 155.68 1.47 Allowed Pre-proline 0 N--CA 1.489 1.51 0 O-C-N 121.22 -0.925 . . . . 5.75 109.403 -179.983 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 359' ' ' PRO . . . . . . . . . . . . . 3.2 Cg_exo -61.84 138.34 73.45 Favored 'Trans proline' 0 C--N 1.309 -1.519 0 C-N-CA 122.257 1.971 . . . . 5.0 110.189 -179.785 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 360' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.244 0 CA-C-O 117.995 -1.447 . . . . 6.97 109.522 179.952 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' B' B ' 319' ' ' LYS . . . . . 0.426 ' O ' ' O ' ' B' ' 320' ' ' LYS . 13.5 mtmt . . . . . 0 N--CA 1.491 1.578 0 N-CA-C 109.518 -0.549 . . . . 7.55 109.518 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 320' ' ' LYS . . . . . 0.426 ' O ' ' O ' ' B' ' 319' ' ' LYS . 6.0 tttp 60.09 114.35 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.318 -0.864 . . . . 6.44 109.513 179.963 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 321' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -158.87 91.94 1.98 Allowed Pre-proline 0 N--CA 1.488 1.455 0 O-C-N 121.222 -0.924 . . . . 6.13 109.457 179.978 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 322' ' ' PRO . . . . . . . . . . . . . 2.2 Cg_endo -61.87 -47.3 11.11 Favored 'Trans proline' 0 C--N 1.309 -1.523 0 C-N-CA 122.147 1.898 . . . . 2.82 110.004 179.927 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 323' ' ' LEU . . . . . . . . . . . . . 19.8 mt -81.22 96.45 7.25 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.289 -0.882 . . . . 2.84 109.472 179.868 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 324' ' ' ASP . . . . . . . . . . . . . 7.3 m-20 -80.36 147.39 31.08 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.211 -0.931 . . . . 1.53 109.264 179.811 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 325' ' ' GLY . . . . . 0.455 ' O ' ' CE2' ' B' ' 327' ' ' TYR . . . -65.55 171.86 24.5 Favored Glycine 0 N--CA 1.49 2.244 0 N-CA-C 109.174 -1.571 . . . . 0.59 109.174 179.798 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 326' ' ' GLU . . . . . . . . . . . . . 2.9 mt-10 -57.09 174.54 0.17 Allowed 'General case' 0 N--CA 1.488 1.465 0 O-C-N 121.092 -1.24 . . . . 2.13 109.093 179.928 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 327' ' ' TYR . . . . . 0.455 ' CE2' ' O ' ' B' ' 325' ' ' GLY . 47.0 m-85 -148.85 111.41 4.75 Favored 'General case' 0 N--CA 1.488 1.44 0 O-C-N 121.203 -0.935 . . . . 0.48 109.531 -179.858 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 328' ' ' PHE . . . . . 0.415 ' CE2' ' HA ' ' D' ' 335' ' ' ARG . 86.3 m-85 -114.01 -168.58 1.37 Allowed 'General case' 0 N--CA 1.489 1.48 0 O-C-N 121.336 -0.852 . . . . 0.32 109.53 -179.845 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 329' ' ' THR . . . . . 0.415 ' HA ' ' O ' ' D' ' 330' ' ' LEU . 23.9 p -153.48 165.23 36.51 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.32 -0.862 . . . . 0.23 109.146 179.989 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 330' ' ' LEU . . . . . 0.537 HD21 HD22 ' D' ' 345' ' ' ASN . 14.8 tp -151.49 131.26 13.2 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.093 -1.004 . . . . 0.28 109.927 -179.739 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 331' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -87.48 120.65 28.99 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.225 -0.922 . . . . 0.91 109.166 179.63 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 332' ' ' ILE . . . . . 0.643 HD12 ' CD1' ' B' ' 338' ' ' PHE . 59.7 mt -103.52 111.1 31.96 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.526 0 O-C-N 121.15 -0.969 . . . . 0.24 109.722 -179.804 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 333' ' ' ARG . . . . . 0.452 ' CG ' HH11 ' B' ' 333' ' ' ARG . 0.0 OUTLIER -72.53 139.56 47.64 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.254 -0.903 . . . . 2.93 109.411 179.852 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 334' ' ' GLY . . . . . . . . . . . . . . . 85.87 136.37 4.08 Favored Glycine 0 N--CA 1.49 2.295 0 N-CA-C 109.655 -1.378 . . . . 0.4 109.655 179.861 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 335' ' ' ARG . . . . . 0.5 ' NH1' ' HG3' ' B' ' 335' ' ' ARG . 0.3 OUTLIER -80.03 -36.15 36.2 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.253 -1.145 . . . . 3.01 109.579 -179.975 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 336' ' ' GLU . . . . . . . . . . . . . 52.5 tt0 -58.56 -57.21 13.97 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.309 -0.87 . . . . 2.28 110.05 -179.719 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 337' ' ' ARG . . . . . 0.54 ' NH1' ' HG3' ' B' ' 337' ' ' ARG . 0.6 OUTLIER -60.04 -30.37 69.14 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.11 -0.994 . . . . 2.93 109.826 -179.548 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 338' ' ' PHE . . . . . 0.643 ' CD1' HD12 ' B' ' 332' ' ' ILE . 88.9 t80 -54.4 -62.86 1.38 Allowed 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.222 -0.924 . . . . 0.37 109.833 -179.751 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 339' ' ' GLU . . . . . . . . . . . . . 81.6 mt-10 -51.97 -31.38 28.92 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.235 -0.916 . . . . 1.98 110.178 -179.666 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 340' ' ' MET . . . . . . . . . . . . . 28.3 ttp -63.73 -53.73 46.56 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.091 -1.005 . . . . 0.32 110.139 -179.491 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 341' ' ' PHE . . . . . . . . . . . . . 39.3 m-85 -62.19 -48.66 79.05 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.167 -0.958 . . . . 0.18 109.978 -179.48 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 342' ' ' ARG . . . . . . . . . . . . . 70.4 ttt180 -48.72 -38.28 21.1 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.2 -0.937 . . . . 2.42 109.964 -179.734 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 343' ' ' GLU . . . . . . . . . . . . . 43.0 tt0 -59.63 -49.3 78.3 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.194 -0.941 . . . . 2.35 109.967 -179.713 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 344' ' ' LEU . . . . . 0.458 ' CD2' HD22 ' A' ' 344' ' ' LEU . 42.6 mt -61.31 -38.03 85.36 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.205 -0.934 . . . . 0.18 109.747 -179.717 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 345' ' ' ASN . . . . . 0.522 HD22 HD21 ' D' ' 330' ' ' LEU . 60.6 t-20 -57.07 -50.15 73.65 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.245 -0.909 . . . . 1.09 109.621 -179.879 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 346' ' ' GLU . . . . . . . . . . . . . 2.7 tt0 -60.87 -34.41 74.58 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.224 -0.922 . . . . 1.66 109.826 -179.709 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 347' ' ' ALA . . . . . 0.878 ' HB1' ' HB1' ' A' ' 347' ' ' ALA . . . -60.9 -51.56 68.77 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.153 -0.967 . . . . 0.17 110.087 -179.693 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 348' ' ' LEU . . . . . 0.541 HD22 ' N ' ' B' ' 348' ' ' LEU . 3.9 mm? -61.41 -44.94 96.27 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.211 -0.931 . . . . 0.29 110.049 -179.561 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 349' ' ' GLU . . . . . . . . . . . . . 39.5 mt-10 -58.08 -40.28 80.69 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.224 -0.922 . . . . 1.95 110.378 -179.343 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 350' ' ' LEU . . . . . 0.61 HD23 ' C ' ' B' ' 350' ' ' LEU . 8.5 tt -63.79 -48.21 77.81 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.256 -0.902 . . . . 0.45 110.067 -179.411 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 351' ' ' LYS . . . . . . . . . . . . . 25.8 tttt -55.61 -41.83 74.02 Favored 'General case' 0 N--CA 1.488 1.441 0 O-C-N 121.198 -0.939 . . . . 1.38 109.27 -179.513 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 352' ' ' ASP . . . . . 0.504 ' OD2' ' NH2' ' D' ' 337' ' ' ARG . 23.3 m-20 -59.27 -48.43 81.66 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.282 -0.886 . . . . 1.16 109.828 179.797 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 353' ' ' ALA . . . . . . . . . . . . . . . -67.46 -9.7 44.46 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.241 -0.912 . . . . 0.61 110.116 -179.469 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 354' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -83.92 -28.38 27.9 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.046 -1.034 . . . . 1.45 109.536 -179.824 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 355' ' ' ALA . . . . . . . . . . . . . . . -73.68 -21.33 60.29 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.239 -0.913 . . . . 0.98 109.431 179.875 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 356' ' ' GLY . . . . . . . . . . . . . . . -81.84 30.93 2.83 Favored Glycine 0 N--CA 1.493 2.496 0 N-CA-C 110.561 -1.015 . . . . 1.29 110.561 -179.96 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 357' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -87.12 124.95 33.81 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 120.911 -1.347 . . . . 4.09 109.487 -179.934 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 358' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -49.96 155.62 1.51 Allowed Pre-proline 0 N--CA 1.491 1.584 0 O-C-N 121.251 -0.906 . . . . 5.72 109.393 179.877 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 359' ' ' PRO . . . . . . . . . . . . . 3.1 Cg_exo -61.65 138.57 75.95 Favored 'Trans proline' 0 C--N 1.31 -1.487 0 C-N-CA 122.224 1.949 . . . . 4.98 110.298 -179.948 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 360' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.258 0 CA-C-O 117.965 -1.464 . . . . 6.98 109.446 179.915 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' C' C ' 319' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.491 1.598 0 CA-C-O 121.297 0.57 . . . . 6.82 109.516 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 320' ' ' LYS . . . . . . . . . . . . . 16.2 mttt 64.16 99.44 0.04 OUTLIER 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.328 -0.858 . . . . 6.49 109.543 179.989 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 321' ' ' LYS . . . . . 0.416 ' O ' ' O ' ' C' ' 322' ' ' PRO . 22.0 mtmt -81.64 153.35 70.55 Favored Pre-proline 0 N--CA 1.488 1.463 0 O-C-N 121.168 -0.958 . . . . 6.4 109.348 179.862 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' C' C ' 322' ' ' PRO . . . . . 0.416 ' O ' ' O ' ' C' ' 321' ' ' LYS . 6.1 Cg_exo -57.89 -150.56 0.01 OUTLIER 'Trans proline' 0 C--N 1.31 -1.48 0 C-N-CA 122.16 1.907 . . . . 3.42 110.101 -179.891 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' C' C ' 323' ' ' LEU . . . . . . . . . . . . . 83.9 mt -78.48 113.39 16.45 Favored 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.087 -1.008 . . . . 3.95 109.139 179.92 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 324' ' ' ASP . . . . . . . . . . . . . 43.3 m-20 -78.32 179.5 6.92 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.268 -0.895 . . . . 1.63 109.481 -179.698 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 325' ' ' GLY . . . . . . . . . . . . . . . -68.41 171.63 36.45 Favored Glycine 0 N--CA 1.488 2.162 0 N-CA-C 109.363 -1.495 . . . . 0.73 109.363 -179.958 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 326' ' ' GLU . . . . . 0.452 ' OE1' ' HB2' ' A' ' 335' ' ' ARG . 1.3 mp0 -57.94 -167.98 0.0 OUTLIER 'General case' 0 N--CA 1.489 1.501 0 O-C-N 121.239 -1.153 . . . . 2.17 109.48 -179.98 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' C' C ' 327' ' ' TYR . . . . . . . . . . . . . 51.6 m-85 -149.66 115.03 5.5 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.33 -0.856 . . . . 0.48 109.394 -179.916 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 328' ' ' PHE . . . . . 0.464 ' CE1' ' HA ' ' A' ' 335' ' ' ARG . 84.4 m-85 -113.36 -169.77 1.56 Allowed 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.319 -0.863 . . . . 0.33 109.562 -179.934 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' C' C ' 329' ' ' THR . . . . . 0.454 ' HA ' ' O ' ' A' ' 330' ' ' LEU . 16.3 p -153.54 162.48 41.22 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.265 -0.897 . . . . 0.23 109.463 -179.873 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' C' C ' 330' ' ' LEU . . . . . 0.459 ' O ' ' HA ' ' A' ' 329' ' ' THR . 14.3 tp -150.26 129.78 13.04 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.206 -0.934 . . . . 0.28 109.782 -179.725 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' C' C ' 331' ' ' GLN . . . . . . . . . . . . . 4.1 tt0 -89.22 119.4 29.68 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.263 -0.898 . . . . 1.48 109.387 179.568 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 332' ' ' ILE . . . . . 0.474 HG21 ' HA ' ' C' ' 338' ' ' PHE . 21.5 mt -103.67 115.58 45.88 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.576 0 O-C-N 121.101 -1.0 . . . . 0.24 109.654 179.811 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' C' C ' 333' ' ' ARG . . . . . 0.565 ' CZ ' ' HB2' ' C' ' 333' ' ' ARG . 5.6 mtm-85 -73.45 151.58 41.05 Favored 'General case' 0 N--CA 1.489 1.493 0 O-C-N 121.348 -0.845 . . . . 2.74 109.375 179.788 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' C' C ' 334' ' ' GLY . . . . . . . . . . . . . . . 71.83 129.99 0.1 OUTLIER Glycine 0 N--CA 1.491 2.305 0 N-CA-C 109.737 -1.345 . . . . 0.35 109.737 179.798 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 335' ' ' ARG . . . . . 0.454 ' NH1' ' CG ' ' C' ' 335' ' ' ARG . 0.2 OUTLIER -73.98 -31.26 62.9 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.273 -1.133 . . . . 2.53 109.358 179.847 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' C' C ' 336' ' ' GLU . . . . . . . . . . . . . 1.7 mp0 -59.22 -57.85 11.21 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.293 -0.88 . . . . 2.62 110.216 -179.768 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 337' ' ' ARG . . . . . 0.524 ' HG2' ' NH1' ' C' ' 337' ' ' ARG . 0.0 OUTLIER -59.03 -32.97 70.21 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.241 -0.912 . . . . 2.81 109.735 -179.471 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' C' C ' 338' ' ' PHE . . . . . 0.474 ' HA ' HG21 ' C' ' 332' ' ' ILE . 80.8 t80 -54.05 -49.53 68.77 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.224 -0.923 . . . . 0.4 109.576 -179.884 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' C' C ' 339' ' ' GLU . . . . . . . . . . . . . 14.5 mt-10 -54.99 -36.67 65.64 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.07 -1.019 . . . . 2.05 110.307 -179.849 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 340' ' ' MET . . . . . . . . . . . . . 19.0 ttp -64.6 -57.7 8.38 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.131 -0.981 . . . . 0.32 110.861 -178.984 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 341' ' ' PHE . . . . . 0.446 ' CZ ' ' HA ' ' A' ' 345' ' ' ASN . 59.1 m-85 -59.74 -51.44 69.75 Favored 'General case' 0 N--CA 1.493 1.713 0 O-C-N 121.091 -1.005 . . . . 0.18 110.246 -178.956 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' C' C ' 342' ' ' ARG . . . . . 0.46 HH11 ' CG ' ' C' ' 342' ' ' ARG . 0.2 OUTLIER -47.21 -45.85 23.58 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.25 -0.906 . . . . 2.91 110.217 -179.374 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' C' C ' 343' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -58.84 -43.19 90.66 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.213 -0.929 . . . . 2.14 109.968 -179.496 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' C' C ' 344' ' ' LEU . . . . . 0.472 ' CD2' HD22 ' D' ' 344' ' ' LEU . 25.6 mt -62.28 -40.66 96.97 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.093 -1.004 . . . . 0.22 109.823 -179.583 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' C' C ' 345' ' ' ASN . . . . . 0.587 HD22 HD21 ' A' ' 330' ' ' LEU . 51.2 t-20 -55.26 -51.79 65.51 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.238 -0.914 . . . . 1.08 109.98 -179.596 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' C' C ' 346' ' ' GLU . . . . . . . . . . . . . 63.1 tt0 -60.14 -31.68 70.31 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.108 -0.995 . . . . 2.21 109.742 -179.602 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 347' ' ' ALA . . . . . 0.793 ' HB1' ' HB1' ' D' ' 347' ' ' ALA . . . -62.7 -48.05 80.95 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.112 -0.993 . . . . 0.18 109.879 -179.998 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' C' C ' 348' ' ' LEU . . . . . 0.538 HD22 ' N ' ' C' ' 348' ' ' LEU . 4.3 mm? -62.16 -53.84 49.64 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.209 -0.932 . . . . 0.32 110.108 -179.637 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' C' C ' 349' ' ' GLU . . . . . . . . . . . . . 6.6 mm-40 -57.65 -34.06 68.96 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.256 -0.902 . . . . 2.19 110.231 -179.097 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 350' ' ' LEU . . . . . 0.725 HD21 HD13 ' D' ' 350' ' ' LEU . 4.2 tt -63.49 -44.04 95.51 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.099 -1.001 . . . . 0.46 109.282 -179.817 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' C' C ' 351' ' ' LYS . . . . . 0.541 ' N ' HD23 ' C' ' 350' ' ' LEU . 41.6 tttp -59.9 -34.43 73.18 Favored 'General case' 0 N--CA 1.488 1.454 0 O-C-N 121.342 -0.849 . . . . 1.35 109.445 -179.923 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' C' C ' 352' ' ' ASP . . . . . . . . . . . . . 3.2 m-20 -56.52 -45.49 81.09 Favored 'General case' 0 N--CA 1.489 1.499 0 O-C-N 121.241 -0.912 . . . . 1.19 109.663 179.978 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 353' ' ' ALA . . . . . . . . . . . . . . . -67.46 -21.01 65.56 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.184 -0.947 . . . . 0.57 109.333 -179.971 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 354' ' ' GLN . . . . . 0.509 ' NE2' ' CD1' ' D' ' 350' ' ' LEU . 0.2 OUTLIER -83.05 -10.85 58.51 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.331 -0.856 . . . . 1.47 109.488 179.921 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' C' C ' 355' ' ' ALA . . . . . . . . . . . . . . . -71.03 -82.09 0.04 OUTLIER 'General case' 0 N--CA 1.488 1.449 0 O-C-N 121.33 -0.856 . . . . 0.93 109.468 179.891 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 356' ' ' GLY . . . . . . . . . . . . . . . -69.92 94.21 0.43 Allowed Glycine 0 N--CA 1.489 2.211 0 N-CA-C 109.625 -1.39 . . . . 1.33 109.625 -179.955 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 357' ' ' LYS . . . . . . . . . . . . . 16.3 mtmm -86.56 136.64 32.99 Favored 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.104 -1.233 . . . . 4.01 109.293 179.844 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 358' ' ' GLU . . . . . . . . . . . . . 7.2 tt0 -47.36 108.71 0.93 Allowed Pre-proline 0 N--CA 1.489 1.516 0 O-C-N 121.253 -0.904 . . . . 5.75 109.434 -179.962 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 359' ' ' PRO . . . . . . . . . . . . . 5.2 Cg_exo -59.2 170.26 3.13 Favored 'Trans proline' 0 C--N 1.313 -1.315 0 C-N-CA 121.958 1.772 . . . . 4.94 110.242 -179.934 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 360' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 2.385 0 N-CA-C 109.429 -1.469 . . . . 6.5 109.429 -179.937 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' D' D ' 319' ' ' LYS . . . . . 0.421 ' O ' ' O ' ' D' ' 320' ' ' LYS . 13.5 mtmt . . . . . 0 N--CA 1.49 1.56 0 N-CA-C 109.449 -0.575 . . . . 7.53 109.449 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' D' D ' 320' ' ' LYS . . . . . 0.421 ' O ' ' O ' ' D' ' 319' ' ' LYS . 5.8 tttp 60.01 114.45 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.24 -0.912 . . . . 6.41 109.526 -179.942 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' D' D ' 321' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -158.88 91.99 1.97 Allowed Pre-proline 0 N--CA 1.49 1.528 0 O-C-N 121.208 -0.933 . . . . 6.11 109.508 179.869 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' D' D ' 322' ' ' PRO . . . . . . . . . . . . . 2.1 Cg_endo -61.95 -47.29 10.97 Favored 'Trans proline' 0 C--N 1.309 -1.546 0 C-N-CA 122.108 1.872 . . . . 2.82 110.016 179.936 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' D' D ' 323' ' ' LEU . . . . . . . . . . . . . 19.5 mt -81.3 96.53 7.32 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.339 -0.851 . . . . 2.83 109.497 179.791 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' D' D ' 324' ' ' ASP . . . . . . . . . . . . . 7.1 m-20 -80.16 148.36 30.95 Favored 'General case' 0 N--CA 1.488 1.467 0 O-C-N 121.244 -0.91 . . . . 1.54 109.194 179.751 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' D' D ' 325' ' ' GLY . . . . . 0.46 ' O ' ' CE2' ' D' ' 327' ' ' TYR . . . -66.85 171.87 30.12 Favored Glycine 0 N--CA 1.49 2.264 0 N-CA-C 109.104 -1.598 . . . . 0.59 109.104 179.927 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' D' D ' 326' ' ' GLU . . . . . . . . . . . . . 3.0 mt-10 -56.84 174.43 0.16 Allowed 'General case' 0 N--CA 1.488 1.441 0 O-C-N 121.121 -1.223 . . . . 2.13 109.07 -179.966 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' D' D ' 327' ' ' TYR . . . . . 0.46 ' CE2' ' O ' ' D' ' 325' ' ' GLY . 47.1 m-85 -148.79 111.53 4.8 Favored 'General case' 0 C--N 1.303 -1.427 0 O-C-N 121.173 -0.954 . . . . 0.47 109.469 -179.818 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' D' D ' 328' ' ' PHE . . . . . 0.413 ' CE2' ' HA ' ' B' ' 335' ' ' ARG . 86.2 m-85 -114.08 -168.64 1.38 Allowed 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.292 -0.88 . . . . 0.3 109.561 -179.842 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' D' D ' 329' ' ' THR . . . . . 0.425 ' HA ' ' O ' ' B' ' 330' ' ' LEU . 23.8 p -153.46 165.07 36.98 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.294 -0.879 . . . . 0.22 109.174 179.931 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' D' D ' 330' ' ' LEU . . . . . 0.522 HD21 HD22 ' B' ' 345' ' ' ASN . 14.9 tp -151.43 131.23 13.23 Favored 'General case' 0 N--CA 1.489 1.476 0 O-C-N 121.134 -0.978 . . . . 0.28 109.869 -179.768 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' D' D ' 331' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -87.39 120.75 29.0 Favored 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.341 -0.849 . . . . 0.93 109.234 179.54 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' D' D ' 332' ' ' ILE . . . . . 0.65 HD12 ' CD1' ' D' ' 338' ' ' PHE . 59.5 mt -103.46 111.26 32.51 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.574 0 O-C-N 121.149 -0.97 . . . . 0.25 109.656 -179.778 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' D' D ' 333' ' ' ARG . . . . . 0.433 ' NH1' ' CG ' ' D' ' 333' ' ' ARG . 0.0 OUTLIER -72.77 139.67 47.24 Favored 'General case' 0 N--CA 1.489 1.49 0 O-C-N 121.334 -0.854 . . . . 2.93 109.454 179.778 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' D' D ' 334' ' ' GLY . . . . . . . . . . . . . . . 85.76 136.62 4.1 Favored Glycine 0 N--CA 1.49 2.283 0 N-CA-C 109.658 -1.377 . . . . 0.41 109.658 179.925 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' D' D ' 335' ' ' ARG . . . . . 0.5 ' NH1' ' HG3' ' D' ' 335' ' ' ARG . 0.3 OUTLIER -80.13 -36.08 35.8 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.31 -1.112 . . . . 3.03 109.623 -179.951 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' D' D ' 336' ' ' GLU . . . . . . . . . . . . . 53.1 tt0 -58.72 -57.14 14.32 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.223 -0.923 . . . . 2.26 110.057 -179.666 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' D' D ' 337' ' ' ARG . . . . . 0.546 ' NH1' ' HG3' ' D' ' 337' ' ' ARG . 0.6 OUTLIER -60.07 -30.27 69.11 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.188 -0.945 . . . . 2.92 109.862 -179.608 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' D' D ' 338' ' ' PHE . . . . . 0.65 ' CD1' HD12 ' D' ' 332' ' ' ILE . 88.7 t80 -54.43 -62.89 1.36 Allowed 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.209 -0.932 . . . . 0.37 109.769 -179.756 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' D' D ' 339' ' ' GLU . . . . . . . . . . . . . 81.7 mt-10 -51.99 -31.32 28.93 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.279 -0.888 . . . . 1.99 110.155 -179.632 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' D' D ' 340' ' ' MET . . . . . . . . . . . . . 28.2 ttp -63.9 -53.6 47.95 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.101 -0.999 . . . . 0.31 110.098 -179.426 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' D' D ' 341' ' ' PHE . . . . . 0.423 ' CZ ' ' HA ' ' B' ' 345' ' ' ASN . 39.8 m-85 -62.17 -48.83 78.3 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.183 -0.948 . . . . 0.18 109.977 -179.532 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' D' D ' 342' ' ' ARG . . . . . . . . . . . . . 70.6 ttt180 -48.6 -38.47 20.87 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.185 -0.947 . . . . 2.41 109.827 -179.73 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' D' D ' 343' ' ' GLU . . . . . . . . . . . . . 43.7 tt0 -59.51 -49.29 78.37 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.218 -0.926 . . . . 2.35 109.927 -179.609 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' D' D ' 344' ' ' LEU . . . . . 0.472 HD22 ' CD2' ' C' ' 344' ' ' LEU . 43.1 mt -61.26 -38.08 85.46 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.256 -0.902 . . . . 0.19 109.738 -179.659 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' D' D ' 345' ' ' ASN . . . . . 0.537 HD22 HD21 ' B' ' 330' ' ' LEU . 60.6 t-20 -57.09 -50.35 73.06 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.178 -0.951 . . . . 1.09 109.61 -179.787 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' D' D ' 346' ' ' GLU . . . . . . . . . . . . . 2.6 tt0 -60.56 -34.52 74.28 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.295 -0.878 . . . . 1.69 109.892 -179.774 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' D' D ' 347' ' ' ALA . . . . . 0.793 ' HB1' ' HB1' ' C' ' 347' ' ' ALA . . . -60.85 -51.48 69.12 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.243 -0.911 . . . . 0.18 110.07 -179.645 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' D' D ' 348' ' ' LEU . . . . . 0.548 HD22 ' N ' ' D' ' 348' ' ' LEU . 3.9 mm? -61.48 -45.05 95.88 Favored 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.158 -0.964 . . . . 0.31 109.948 -179.446 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' D' D ' 349' ' ' GLU . . . . . . . . . . . . . 39.2 mt-10 -57.91 -40.34 80.12 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.275 -0.891 . . . . 1.95 110.351 -179.327 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' D' D ' 350' ' ' LEU . . . . . 0.725 HD13 HD21 ' C' ' 350' ' ' LEU . 8.6 tt -63.73 -48.11 78.35 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.087 -1.008 . . . . 0.43 110.144 -179.369 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' D' D ' 351' ' ' LYS . . . . . . . . . . . . . 25.8 tttt -55.73 -41.8 74.41 Favored 'General case' 0 N--CA 1.488 1.451 0 O-C-N 121.244 -0.91 . . . . 1.4 109.291 -179.665 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' D' D ' 352' ' ' ASP . . . . . 0.433 ' OD2' ' NH2' ' B' ' 337' ' ' ARG . 23.5 m-20 -59.36 -48.35 81.96 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.294 -0.879 . . . . 1.17 109.806 179.802 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' D' D ' 353' ' ' ALA . . . . . . . . . . . . . . . -67.57 -9.56 43.85 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.22 -0.925 . . . . 0.59 110.101 -179.43 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' D' D ' 354' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -83.95 -28.26 27.94 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.063 -1.023 . . . . 1.44 109.532 -179.807 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' D' D ' 355' ' ' ALA . . . . . . . . . . . . . . . -73.79 -21.35 60.19 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.168 -0.957 . . . . 0.98 109.485 179.912 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' D' D ' 356' ' ' GLY . . . . . . . . . . . . . . . -81.97 30.97 2.86 Favored Glycine 0 N--CA 1.494 2.53 0 N-CA-C 110.505 -1.038 . . . . 1.28 110.505 -179.92 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' D' D ' 357' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -87.21 124.9 33.8 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 120.86 -1.377 . . . . 4.09 109.464 -179.964 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' D' D ' 358' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -49.96 155.49 1.55 Allowed Pre-proline 0 N--CA 1.49 1.543 0 O-C-N 121.228 -0.92 . . . . 5.71 109.41 179.911 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' D' D ' 359' ' ' PRO . . . . . . . . . . . . . 3.1 Cg_exo -61.65 138.79 77.34 Favored 'Trans proline' 0 C--N 1.309 -1.534 0 C-N-CA 122.242 1.961 . . . . 4.97 110.31 -179.918 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' D' D ' 360' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.251 0 CA-C-O 117.973 -1.459 . . . . 6.97 109.462 179.885 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 319' ' ' LYS . . . . . . . . . . . . . 17.6 mttm . . . . . 0 N--CA 1.49 1.528 0 CA-C-O 121.297 0.57 . . . . 7.55 109.581 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 320' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 63.21 78.11 0.3 Allowed 'General case' 0 N--CA 1.488 1.453 0 O-C-N 121.167 -0.958 . . . . 6.43 109.833 179.52 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 321' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -158.38 77.6 3.37 Favored Pre-proline 0 C--N 1.302 -1.477 0 O-C-N 121.258 -0.901 . . . . 6.13 109.027 179.482 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 322' ' ' PRO . . . . . . . . . . . . . 4.5 Cg_endo -71.95 19.44 0.29 Allowed 'Trans proline' 0 C--N 1.31 -1.466 0 C-N-CA 122.597 2.198 . . . . 2.83 111.945 -179.634 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 323' ' ' LEU . . . . . . . . . . . . . 24.3 mt -78.45 91.49 4.52 Favored 'General case' 0 N--CA 1.489 1.491 0 O-C-N 120.582 -1.324 . . . . 2.83 109.589 -179.839 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 324' ' ' ASP . . . . . 0.509 ' N ' ' OD1' ' A' ' 324' ' ' ASP . 0.6 OUTLIER -82.58 -150.44 0.09 Allowed 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.355 -0.841 . . . . 1.53 109.814 -179.887 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 325' ' ' GLY . . . . . . . . . . . . . . . -70.11 -159.36 2.55 Favored Glycine 0 N--CA 1.49 2.257 0 N-CA-C 109.732 -1.347 . . . . 0.61 109.732 -179.867 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 326' ' ' GLU . . . . . . . . . . . . . 4.0 mm-40 -58.66 -169.14 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.257 -1.143 . . . . 2.13 109.378 179.768 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 327' ' ' TYR . . . . . 0.54 ' CE2' ' HG2' ' C' ' 333' ' ' ARG . 40.9 m-85 -148.35 111.05 4.76 Favored 'General case' 0 C--N 1.302 -1.464 0 O-C-N 121.412 -0.805 . . . . 0.48 109.553 179.725 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 328' ' ' PHE . . . . . 0.437 ' O ' ' OE1' ' C' ' 331' ' ' GLN . 59.5 m-85 -113.08 -172.75 2.12 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.431 -0.793 . . . . 0.31 109.291 -179.936 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 329' ' ' THR . . . . . . . . . . . . . 60.0 p -152.92 171.74 17.85 Favored 'General case' 0 C--N 1.302 -1.461 0 O-C-N 121.196 -0.94 . . . . 0.22 108.895 179.847 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 330' ' ' LEU . . . . . . . . . . . . . 24.1 tp -151.86 130.17 12.05 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.378 -0.826 . . . . 0.28 109.71 -179.721 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 331' ' ' GLN . . . . . . . . . . . . . 1.5 tp60 -87.18 111.96 21.5 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.25 -0.906 . . . . 0.91 109.679 179.932 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 332' ' ' ILE . . . . . 0.597 HG21 ' HA ' ' A' ' 338' ' ' PHE . 63.6 mt -103.2 103.1 14.59 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.587 0 O-C-N 121.107 -0.996 . . . . 0.26 109.291 179.891 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 333' ' ' ARG . . . . . 0.6 ' HG2' ' CE2' ' C' ' 327' ' ' TYR . 0.0 OUTLIER -72.45 147.58 45.98 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.253 -0.904 . . . . 2.92 109.41 -179.879 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 334' ' ' GLY . . . . . . . . . . . . . . . 82.0 130.59 1.3 Allowed Glycine 0 N--CA 1.493 2.436 0 N-CA-C 109.452 -1.459 . . . . 0.4 109.452 -179.961 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 335' ' ' ARG . . . . . 0.433 ' HA ' ' CE2' ' C' ' 328' ' ' PHE . 0.2 OUTLIER -76.44 -31.42 57.85 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.133 -1.216 . . . . 3.01 110.022 -179.938 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 336' ' ' GLU . . . . . . . . . . . . . 4.8 tp10 -57.45 -62.88 1.47 Allowed 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.048 -1.033 . . . . 2.29 109.667 -179.627 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 337' ' ' ARG . . . . . 0.429 ' HG3' HH11 ' A' ' 337' ' ' ARG . 8.3 mtm-85 -59.99 -31.43 69.91 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.249 -0.907 . . . . 2.93 109.508 -179.765 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 338' ' ' PHE . . . . . 0.597 ' HA ' HG21 ' A' ' 332' ' ' ILE . 73.1 t80 -56.35 -56.02 26.23 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.304 -0.872 . . . . 0.38 109.851 -179.97 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 339' ' ' GLU . . . . . . . . . . . . . 93.6 mt-10 -52.74 -37.17 58.87 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.151 -0.968 . . . . 1.97 110.446 -179.568 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 340' ' ' MET . . . . . 0.443 ' SD ' ' OE1' ' D' ' 343' ' ' GLU . 28.2 ttp -63.76 -47.99 78.74 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.024 -1.047 . . . . 0.31 110.162 -179.238 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 341' ' ' PHE . . . . . . . . . . . . . 52.4 m-85 -62.43 -40.41 96.48 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.148 -0.97 . . . . 0.18 109.684 -179.515 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 342' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -51.12 -43.68 61.19 Favored 'General case' 0 N--CA 1.488 1.47 0 O-C-N 121.399 -0.813 . . . . 2.42 109.823 -179.939 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 343' ' ' GLU . . . . . 0.559 ' OE2' HD11 ' B' ' 348' ' ' LEU . 1.8 tt0 -57.94 -46.84 84.43 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.374 -0.829 . . . . 2.35 109.706 -179.646 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 344' ' ' LEU . . . . . . . . . . . . . 41.4 mt -61.59 -33.71 74.36 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.176 -0.953 . . . . 0.18 109.247 179.906 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 345' ' ' ASN . . . . . 0.421 ' O ' ' HG3' ' A' ' 349' ' ' GLU . 13.3 t-20 -57.96 -55.68 31.77 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.558 -0.714 . . . . 1.09 109.517 179.979 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 346' ' ' GLU . . . . . . . . . . . . . 65.2 tt0 -63.63 -29.28 70.54 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.224 -0.922 . . . . 1.65 110.205 -179.756 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 347' ' ' ALA . . . . . 0.85 ' HB1' ' HB1' ' B' ' 347' ' ' ALA . . . -60.85 -61.44 2.58 Favored 'General case' 0 N--CA 1.494 1.759 0 O-C-N 120.983 -1.073 . . . . 0.18 109.983 -179.613 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 348' ' ' LEU . . . . . 0.587 HD22 ' N ' ' A' ' 348' ' ' LEU . 3.9 mm? -61.74 -40.47 95.2 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.256 -0.903 . . . . 0.3 109.546 -179.789 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 349' ' ' GLU . . . . . 0.421 ' HG3' ' O ' ' A' ' 345' ' ' ASN . 93.4 mt-10 -58.56 -34.13 70.69 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.244 -0.91 . . . . 1.94 110.15 -179.446 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 350' ' ' LEU . . . . . 0.804 ' O ' HD23 ' A' ' 350' ' ' LEU . 4.1 tt -65.35 -47.08 77.71 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.179 -0.951 . . . . 0.46 109.661 -179.833 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 351' ' ' LYS . . . . . . . . . . . . . 14.4 tttm -58.96 -41.77 88.27 Favored 'General case' 0 N--CA 1.489 1.497 0 O-C-N 121.166 -0.959 . . . . 1.4 109.845 -179.453 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 352' ' ' ASP . . . . . . . . . . . . . 48.2 m-20 -53.45 -40.29 65.12 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.035 -1.041 . . . . 1.16 109.505 -179.837 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 353' ' ' ALA . . . . . . . . . . . . . . . -67.5 -31.45 71.59 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.161 -0.962 . . . . 0.63 109.727 -179.888 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 354' ' ' GLN . . . . . . . . . . . . . 3.7 tt0 -81.72 2.71 28.54 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.255 -0.903 . . . . 1.47 109.818 -179.767 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 355' ' ' ALA . . . . . 0.488 ' O ' ' N ' ' A' ' 357' ' ' LYS . . . -69.62 -87.27 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.06 -1.025 . . . . 1.01 109.501 179.965 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 356' ' ' GLY . . . . . . . . . . . . . . . -53.98 88.53 0.01 OUTLIER Glycine 0 N--CA 1.491 2.358 0 N-CA-C 109.593 -1.403 . . . . 1.3 109.593 179.923 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 357' ' ' LYS . . . . . 0.488 ' N ' ' O ' ' A' ' 355' ' ' ALA . 0.9 OUTLIER -88.81 18.36 4.83 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.11 -1.229 . . . . 4.1 109.552 179.997 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 358' ' ' GLU . . . . . . . . . . . . . 2.4 tt0 -49.27 135.49 16.35 Favored Pre-proline 0 N--CA 1.493 1.709 0 O-C-N 121.189 -0.945 . . . . 5.75 109.432 -179.822 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 359' ' ' PRO . . . . . . . . . . . . . 2.4 Cg_endo -61.94 -154.23 0.02 OUTLIER 'Trans proline' 0 C--N 1.313 -1.314 0 C-N-CA 121.933 1.755 . . . . 5.0 110.184 -179.987 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 360' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.296 0 CA-C-O 117.998 -1.446 . . . . 6.97 109.524 179.897 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' B' B ' 319' ' ' LYS . . . . . . . . . . . . . 16.5 mttm . . . . . 0 N--CA 1.49 1.527 0 N-CA-C 109.485 -0.561 . . . . 7.55 109.485 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' B' B ' 320' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 62.72 77.58 0.32 Allowed 'General case' 0 C--N 1.304 -1.412 0 O-C-N 121.251 -0.906 . . . . 6.44 109.811 179.373 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 321' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -158.11 78.01 3.43 Favored Pre-proline 0 N--CA 1.49 1.54 0 O-C-N 121.394 -0.816 . . . . 6.13 109.069 179.607 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 322' ' ' PRO . . . . . . . . . . . . . 5.7 Cg_endo -72.03 19.87 0.29 Allowed 'Trans proline' 0 C--N 1.314 -1.262 0 C-N-CA 122.899 2.399 . . . . 2.82 111.957 -179.562 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 323' ' ' LEU . . . . . . . . . . . . . 27.1 mt -78.7 92.18 4.75 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 120.499 -1.375 . . . . 2.84 109.43 -179.96 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 324' ' ' ASP . . . . . 0.477 ' N ' ' OD1' ' B' ' 324' ' ' ASP . 0.5 OUTLIER -83.08 -149.19 0.09 Allowed 'General case' 0 N--CA 1.488 1.436 0 O-C-N 121.171 -0.956 . . . . 1.53 109.837 -179.874 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 325' ' ' GLY . . . . . . . . . . . . . . . -71.74 -158.99 3.69 Favored Glycine 0 N--CA 1.49 2.272 0 N-CA-C 109.539 -1.424 . . . . 0.59 109.539 -179.829 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 326' ' ' GLU . . . . . . . . . . . . . 3.4 mm-40 -58.52 -169.36 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.173 -1.192 . . . . 2.13 109.354 179.911 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 327' ' ' TYR . . . . . 0.541 ' CE2' ' HG2' ' D' ' 333' ' ' ARG . 42.0 m-85 -148.13 111.51 4.96 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.373 -0.829 . . . . 0.48 109.446 179.637 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 328' ' ' PHE . . . . . . . . . . . . . 62.8 m-85 -113.08 -173.37 2.24 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.362 -0.836 . . . . 0.32 109.243 -179.904 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 329' ' ' THR . . . . . 0.498 ' HA ' ' O ' ' D' ' 330' ' ' LEU . 77.2 p -152.12 170.77 19.14 Favored 'General case' 0 C--N 1.302 -1.479 0 O-C-N 121.348 -0.845 . . . . 0.23 109.099 179.824 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 330' ' ' LEU . . . . . 0.457 ' O ' ' HA ' ' D' ' 329' ' ' THR . 28.3 tp -151.13 130.31 12.71 Favored 'General case' 0 C--N 1.303 -1.449 0 O-C-N 121.025 -1.047 . . . . 0.28 109.71 -179.661 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 331' ' ' GLN . . . . . . . . . . . . . 1.5 tp60 -87.48 112.28 22.04 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.384 -0.823 . . . . 0.91 109.641 -179.891 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 332' ' ' ILE . . . . . 0.607 HG21 ' HA ' ' B' ' 338' ' ' PHE . 63.6 mt -103.49 103.23 14.83 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.478 0 O-C-N 121.118 -0.989 . . . . 0.24 109.195 179.834 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 333' ' ' ARG . . . . . 0.535 ' HG2' ' NH1' ' B' ' 333' ' ' ARG . 0.0 OUTLIER -72.69 146.56 46.43 Favored 'General case' 0 N--CA 1.488 1.475 0 O-C-N 121.178 -0.951 . . . . 2.93 109.472 -179.924 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 334' ' ' GLY . . . . . . . . . . . . . . . 82.88 130.81 1.57 Allowed Glycine 0 N--CA 1.492 2.428 0 N-CA-C 109.583 -1.407 . . . . 0.4 109.583 179.995 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 335' ' ' ARG . . . . . 0.423 ' HG3' HH11 ' B' ' 335' ' ' ARG . 0.2 OUTLIER -76.37 -31.54 58.09 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.35 -1.088 . . . . 3.01 109.773 -179.657 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 336' ' ' GLU . . . . . . . . . . . . . 4.8 tp10 -57.01 -63.37 1.23 Allowed 'General case' 0 N--CA 1.488 1.454 0 O-C-N 121.092 -1.005 . . . . 2.28 109.881 -179.743 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 337' ' ' ARG . . . . . 0.416 HH11 ' HG3' ' B' ' 337' ' ' ARG . 9.1 mtm-85 -60.1 -31.42 70.02 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.233 -0.917 . . . . 2.93 109.686 -179.712 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 338' ' ' PHE . . . . . 0.607 ' HA ' HG21 ' B' ' 332' ' ' ILE . 72.4 t80 -56.37 -55.72 30.06 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.218 -0.926 . . . . 0.37 109.826 -179.903 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 339' ' ' GLU . . . . . . . . . . . . . 94.1 mt-10 -52.96 -37.33 61.05 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.256 -0.903 . . . . 1.98 110.426 -179.265 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 340' ' ' MET . . . . . . . . . . . . . 29.3 ttp -63.57 -47.88 79.7 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.133 -0.98 . . . . 0.32 110.041 -179.404 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 341' ' ' PHE . . . . . . . . . . . . . 50.9 m-85 -62.03 -40.95 97.47 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 120.963 -1.086 . . . . 0.18 109.818 -179.762 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 342' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -50.7 -43.29 57.66 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.287 -0.883 . . . . 2.42 109.904 -179.859 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 343' ' ' GLU . . . . . . . . . . . . . 1.7 tt0 -58.42 -46.5 86.36 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.303 -0.873 . . . . 2.35 109.665 -179.518 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 344' ' ' LEU . . . . . . . . . . . . . 39.5 mt -61.57 -33.55 74.07 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.324 -0.86 . . . . 0.18 109.07 179.966 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 345' ' ' ASN . . . . . . . . . . . . . 13.0 t-20 -57.88 -56.62 19.61 Favored 'General case' 0 N--CA 1.49 1.525 0 O-C-N 121.413 -0.805 . . . . 1.09 109.686 179.999 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 346' ' ' GLU . . . . . . . . . . . . . 61.9 tt0 -63.31 -29.06 70.45 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.239 -0.913 . . . . 1.66 110.199 -179.783 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 347' ' ' ALA . . . . . 0.85 ' HB1' ' HB1' ' A' ' 347' ' ' ALA . . . -60.76 -62.07 2.13 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 120.86 -1.15 . . . . 0.17 109.922 -179.622 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 348' ' ' LEU . . . . . 0.599 HD22 ' N ' ' B' ' 348' ' ' LEU . 3.9 mm? -61.2 -40.25 93.24 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.076 -1.015 . . . . 0.29 109.764 -179.651 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 349' ' ' GLU . . . . . . . . . . . . . 96.9 mt-10 -59.01 -33.97 71.33 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.295 -0.878 . . . . 1.95 110.077 -179.453 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 350' ' ' LEU . . . . . 0.8 ' O ' HD23 ' B' ' 350' ' ' LEU . 4.0 tt -65.2 -47.09 78.11 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.278 -0.889 . . . . 0.45 109.641 -179.78 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 351' ' ' LYS . . . . . . . . . . . . . 16.2 tttm -58.77 -41.75 87.34 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.303 -0.873 . . . . 1.38 109.788 -179.666 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 352' ' ' ASP . . . . . . . . . . . . . 45.5 m-20 -54.22 -40.1 67.35 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.163 -0.961 . . . . 1.16 109.513 -179.667 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 353' ' ' ALA . . . . . . . . . . . . . . . -67.02 -31.66 72.35 Favored 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.266 -0.897 . . . . 0.61 109.501 179.928 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 354' ' ' GLN . . . . . . . . . . . . . 3.6 tt0 -82.01 3.45 26.59 Favored 'General case' 0 N--CA 1.488 1.455 0 O-C-N 121.159 -0.963 . . . . 1.45 109.891 -179.906 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 355' ' ' ALA . . . . . 0.476 ' O ' ' N ' ' B' ' 357' ' ' LYS . . . -69.8 -85.95 0.02 OUTLIER 'General case' 0 N--CA 1.489 1.486 0 O-C-N 121.09 -1.006 . . . . 0.98 109.552 -179.948 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 356' ' ' GLY . . . . . . . . . . . . . . . -55.25 89.02 0.01 OUTLIER Glycine 0 N--CA 1.491 2.329 0 N-CA-C 109.602 -1.399 . . . . 1.29 109.602 -179.887 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 357' ' ' LYS . . . . . 0.476 ' N ' ' O ' ' B' ' 355' ' ' ALA . 0.5 OUTLIER -89.34 18.36 5.27 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.225 -1.162 . . . . 4.09 109.694 179.992 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 358' ' ' GLU . . . . . . . . . . . . . 2.5 tt0 -49.46 137.16 16.82 Favored Pre-proline 0 N--CA 1.489 1.49 0 O-C-N 121.162 -0.961 . . . . 5.72 109.444 -179.782 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 359' ' ' PRO . . . . . . . . . . . . . 2.0 Cg_endo -62.64 -153.67 0.02 OUTLIER 'Trans proline' 0 C--N 1.311 -1.399 0 C-N-CA 122.014 1.81 . . . . 4.98 110.122 -179.792 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 360' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.334 0 N-CA-C 109.411 -1.476 . . . . 6.98 109.411 179.944 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' C' C ' 319' ' ' LYS . . . . . . . . . . . . . 3.2 mttm . . . . . 0 N--CA 1.49 1.553 0 CA-C-O 121.368 0.604 . . . . 6.82 109.657 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' C' C ' 320' ' ' LYS . . . . . 0.591 ' CB ' ' HD2' ' C' ' 322' ' ' PRO . 2.9 mtpt 55.37 -179.18 0.04 OUTLIER 'General case' 0 N--CA 1.488 1.472 0 O-C-N 121.316 -0.865 . . . . 6.49 110.048 179.406 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' C' C ' 321' ' ' LYS . . . . . 0.711 ' N ' ' CD ' ' C' ' 322' ' ' PRO . 1.9 ptmt -89.18 -23.7 0.28 Allowed Pre-proline 0 N--CA 1.5 2.064 0 N-CA-C 113.844 1.053 . . . . 6.4 113.844 -178.781 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' C' C ' 322' ' ' PRO . . . . . 0.711 ' CD ' ' N ' ' C' ' 321' ' ' LYS . 5.6 Cg_exo -60.11 -80.95 0.01 OUTLIER 'Trans proline' 0 C--N 1.323 -0.813 0 C-N-CA 121.009 1.14 . . . . 3.42 110.96 -178.766 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' C' C ' 323' ' ' LEU . . . . . . . . . . . . . 20.1 mt -80.35 83.52 6.17 Favored 'General case' 0 N--CA 1.488 1.441 0 O-C-N 120.779 -1.2 . . . . 3.95 109.287 -179.692 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 324' ' ' ASP . . . . . 0.425 ' OD1' ' O ' ' C' ' 321' ' ' LYS . 15.3 m-20 -82.76 -170.65 3.1 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.241 -0.912 . . . . 1.63 109.943 179.944 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' C' C ' 325' ' ' GLY . . . . . . . . . . . . . . . -73.41 -157.27 4.3 Favored Glycine 0 N--CA 1.491 2.361 0 N-CA-C 110.175 -1.17 . . . . 0.73 110.175 -179.971 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 326' ' ' GLU . . . . . 0.481 ' O ' ' CD1' ' C' ' 327' ' ' TYR . 1.7 mm-40 -59.91 -165.41 0.01 OUTLIER 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.503 -0.998 . . . . 2.17 109.645 179.999 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' C' C ' 327' ' ' TYR . . . . . 0.6 ' CE2' ' HG2' ' A' ' 333' ' ' ARG . 37.4 m-85 -150.41 113.61 4.87 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.341 -0.849 . . . . 0.48 109.678 179.745 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' C' C ' 328' ' ' PHE . . . . . 0.433 ' CE2' ' HA ' ' A' ' 335' ' ' ARG . 96.3 m-85 -113.62 -170.39 1.69 Allowed 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.317 -0.864 . . . . 0.33 109.356 179.695 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' C' C ' 329' ' ' THR . . . . . 0.415 HG23 ' O ' ' C' ' 328' ' ' PHE . 12.8 p -153.31 167.17 30.28 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.168 -0.957 . . . . 0.23 109.71 -179.748 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' C' C ' 330' ' ' LEU . . . . . . . . . . . . . 56.9 tp -148.57 130.35 15.11 Favored 'General case' 0 N--CA 1.488 1.452 0 O-C-N 121.148 -0.97 . . . . 0.28 109.518 -179.97 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 331' ' ' GLN . . . . . 0.437 ' OE1' ' O ' ' A' ' 328' ' ' PHE . 7.4 tp-100 -87.32 111.24 20.87 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.383 -0.823 . . . . 1.48 109.538 -179.922 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' C' C ' 332' ' ' ILE . . . . . 0.664 HG21 ' HA ' ' C' ' 338' ' ' PHE . 31.1 mt -103.7 101.43 12.23 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.624 0 O-C-N 121.009 -1.057 . . . . 0.24 109.615 179.858 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' C' C ' 333' ' ' ARG . . . . . 0.54 ' HG2' ' CE2' ' A' ' 327' ' ' TYR . 0.0 OUTLIER -73.67 137.23 43.98 Favored 'General case' 0 N--CA 1.489 1.476 0 O-C-N 121.151 -0.968 . . . . 2.74 109.113 179.539 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' C' C ' 334' ' ' GLY . . . . . . . . . . . . . . . 96.33 128.62 5.79 Favored Glycine 0 N--CA 1.488 2.131 0 N-CA-C 109.571 -1.412 . . . . 0.35 109.571 -179.985 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 335' ' ' ARG . . . . . 0.436 ' HD3' ' CZ ' ' A' ' 328' ' ' PHE . 3.6 ttp180 -75.87 -36.59 59.49 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.363 -1.081 . . . . 2.53 109.309 -179.983 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' C' C ' 336' ' ' GLU . . . . . . . . . . . . . 1.3 mt-10 -58.95 -60.28 4.11 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.218 -0.926 . . . . 2.62 109.875 -179.748 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 337' ' ' ARG . . . . . 0.478 ' NE ' ' HA ' ' C' ' 337' ' ' ARG . 10.5 mmm180 -60.04 -35.23 74.66 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.187 -0.946 . . . . 2.81 109.678 -179.731 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' C' C ' 338' ' ' PHE . . . . . 0.664 ' HA ' HG21 ' C' ' 332' ' ' ILE . 16.8 t80 -56.44 -48.66 76.56 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.242 -0.911 . . . . 0.4 109.803 -179.816 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' C' C ' 339' ' ' GLU . . . . . . . . . . . . . 2.2 mt-10 -53.57 -37.52 63.01 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.056 -1.027 . . . . 2.05 110.44 -179.237 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 340' ' ' MET . . . . . . . . . . . . . 32.5 ttp -63.75 -47.32 81.49 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.062 -1.024 . . . . 0.32 109.84 -179.485 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 341' ' ' PHE . . . . . . . . . . . . . 56.8 m-85 -61.75 -45.05 95.59 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.1 -1.0 . . . . 0.18 109.982 -179.523 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 342' ' ' ARG . . . . . 0.436 HH11 ' CG ' ' C' ' 342' ' ' ARG . 0.0 OUTLIER -50.09 -42.34 50.03 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.255 -0.903 . . . . 2.91 109.962 -179.842 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' C' C ' 343' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -59.98 -51.71 68.5 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.262 -0.899 . . . . 2.14 110.173 -179.522 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' C' C ' 344' ' ' LEU . . . . . . . . . . . . . 42.1 mt -60.18 -30.99 69.71 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.128 -0.983 . . . . 0.22 109.68 -179.559 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 345' ' ' ASN . . . . . . . . . . . . . 14.3 t-20 -57.84 -56.61 19.69 Favored 'General case' 0 N--CA 1.488 1.428 0 O-C-N 121.242 -0.911 . . . . 1.08 109.442 179.93 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 346' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -62.05 -29.27 70.18 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.399 -0.813 . . . . 2.21 109.92 -179.898 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' C' C ' 347' ' ' ALA . . . . . 0.717 ' HB1' ' HB1' ' D' ' 347' ' ' ALA . . . -61.1 -60.33 3.94 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.206 -0.934 . . . . 0.18 110.104 -179.695 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' C' C ' 348' ' ' LEU . . . . . 0.547 HD22 ' N ' ' C' ' 348' ' ' LEU . 4.1 mm? -59.4 -48.54 81.26 Favored 'General case' 0 N--CA 1.495 1.795 0 O-C-N 121.017 -1.052 . . . . 0.32 109.872 -179.561 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' C' C ' 349' ' ' GLU . . . . . . . . . . . . . 5.3 mm-40 -57.85 -28.66 64.32 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.196 -0.94 . . . . 2.19 109.354 -179.845 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 350' ' ' LEU . . . . . 1.041 HD22 HD13 ' D' ' 350' ' ' LEU . 5.2 tt -64.1 -46.53 83.82 Favored 'General case' 0 N--CA 1.489 1.501 0 O-C-N 121.207 -0.933 . . . . 0.46 108.928 179.689 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' C' C ' 351' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -59.56 -45.55 91.5 Favored 'General case' 0 N--CA 1.487 1.379 0 O-C-N 121.576 -0.703 . . . . 1.35 109.132 179.83 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' C' C ' 352' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -56.86 -32.5 65.89 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.477 -0.764 . . . . 1.19 109.417 179.729 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 353' ' ' ALA . . . . . . . . . . . . . . . -66.2 -32.36 73.75 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.27 -0.893 . . . . 0.57 109.328 -179.992 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 354' ' ' GLN . . . . . . . . . . . . . 26.4 mt-30 -82.21 -11.92 58.41 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.181 -0.95 . . . . 1.47 108.923 179.324 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 355' ' ' ALA . . . . . . . . . . . . . . . -72.65 -8.18 54.04 Favored 'General case' 0 N--CA 1.489 1.479 0 O-C-N 121.319 -0.863 . . . . 0.93 109.538 -179.874 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 356' ' ' GLY . . . . . . . . . . . . . . . -70.46 -55.17 9.03 Favored Glycine 0 N--CA 1.49 2.282 0 N-CA-C 109.336 -1.506 . . . . 1.33 109.336 -179.84 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 357' ' ' LYS . . . . . . . . . . . . . 2.2 mttt -85.4 98.99 10.89 Favored 'General case' 0 C--N 1.304 -1.397 0 O-C-N 121.335 -1.097 . . . . 4.01 109.115 -179.953 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 358' ' ' GLU . . . . . 0.406 ' HA ' ' HD3' ' C' ' 359' ' ' PRO . 0.6 OUTLIER -46.07 132.7 7.2 Favored Pre-proline 0 N--CA 1.49 1.541 0 O-C-N 121.317 -0.864 . . . . 5.75 109.526 -179.705 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' C' C ' 359' ' ' PRO . . . . . 0.406 ' HD3' ' HA ' ' C' ' 358' ' ' GLU . 2.3 Cg_endo -63.79 94.04 0.18 Allowed 'Trans proline' 0 C--N 1.311 -1.442 0 C-N-CA 121.997 1.798 . . . . 4.94 110.206 179.999 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' C' C ' 360' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.207 0 CA-C-O 118.094 -1.392 . . . . 6.5 109.65 -179.913 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' D' D ' 319' ' ' LYS . . . . . . . . . . . . . 14.7 mttm . . . . . 0 N--CA 1.491 1.62 0 CA-C-O 121.235 0.54 . . . . 7.53 109.735 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' D' D ' 320' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 61.86 79.33 0.26 Allowed 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.242 -0.911 . . . . 6.41 109.642 179.648 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' D' D ' 321' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -158.97 78.54 3.01 Favored Pre-proline 0 C--N 1.301 -1.518 0 O-C-N 121.334 -0.854 . . . . 6.11 108.769 179.734 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' D' D ' 322' ' ' PRO . . . . . . . . . . . . . 5.7 Cg_endo -72.52 20.97 0.3 Allowed 'Trans proline' 0 C--N 1.309 -1.529 0 C-N-CA 122.838 2.359 . . . . 2.82 111.707 -179.454 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' D' D ' 323' ' ' LEU . . . . . . . . . . . . . 30.1 mt -79.41 92.27 5.2 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 120.511 -1.368 . . . . 2.83 109.333 -179.876 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' D' D ' 324' ' ' ASP . . . . . 0.474 ' OD1' ' N ' ' D' ' 324' ' ' ASP . 0.5 OUTLIER -83.82 -150.78 0.11 Allowed 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.291 -0.88 . . . . 1.54 109.69 -179.898 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' D' D ' 325' ' ' GLY . . . . . . . . . . . . . . . -69.98 -159.68 2.58 Favored Glycine 0 N--CA 1.489 2.217 0 N-CA-C 109.79 -1.324 . . . . 0.59 109.79 -179.896 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' D' D ' 326' ' ' GLU . . . . . . . . . . . . . 3.1 mm-40 -58.33 -169.29 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.306 -1.114 . . . . 2.13 109.428 -179.974 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' D' D ' 327' ' ' TYR . . . . . 0.453 ' CE2' ' HG2' ' B' ' 333' ' ' ARG . 42.6 m-85 -148.54 112.09 5.03 Favored 'General case' 0 N--CA 1.488 1.453 0 O-C-N 121.409 -0.807 . . . . 0.47 109.267 179.675 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' D' D ' 328' ' ' PHE . . . . . . . . . . . . . 58.0 m-85 -113.6 -173.25 2.23 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.533 -0.73 . . . . 0.3 109.281 -179.901 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' D' D ' 329' ' ' THR . . . . . 0.457 ' HA ' ' O ' ' B' ' 330' ' ' LEU . 76.5 p -152.28 170.57 19.72 Favored 'General case' 0 N--CA 1.488 1.472 0 O-C-N 121.276 -0.89 . . . . 0.22 109.004 -179.938 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' D' D ' 330' ' ' LEU . . . . . 0.498 ' O ' ' HA ' ' B' ' 329' ' ' THR . 32.2 tp -150.65 130.65 13.41 Favored 'General case' 0 C--N 1.302 -1.463 0 O-C-N 121.068 -1.02 . . . . 0.28 109.522 -179.901 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' D' D ' 331' ' ' GLN . . . . . . . . . . . . . 1.5 tp60 -87.83 112.27 22.29 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.263 -0.898 . . . . 0.93 109.545 179.968 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' D' D ' 332' ' ' ILE . . . . . 0.611 HG21 ' HA ' ' D' ' 338' ' ' PHE . 64.4 mt -103.33 102.85 14.25 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.45 0 O-C-N 121.217 -0.927 . . . . 0.25 109.415 179.835 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' D' D ' 333' ' ' ARG . . . . . 0.541 ' HG2' ' CE2' ' B' ' 327' ' ' TYR . 0.0 OUTLIER -72.33 144.42 48.31 Favored 'General case' 0 N--CA 1.488 1.463 0 O-C-N 121.361 -0.837 . . . . 2.93 109.724 -179.981 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' D' D ' 334' ' ' GLY . . . . . . . . . . . . . . . 84.75 130.98 2.21 Favored Glycine 0 N--CA 1.492 2.398 0 N-CA-C 109.605 -1.398 . . . . 0.41 109.605 179.933 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' D' D ' 335' ' ' ARG . . . . . 0.445 ' HG3' HH11 ' D' ' 335' ' ' ARG . 0.2 OUTLIER -76.47 -31.79 57.99 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.291 -1.123 . . . . 3.03 109.873 -179.93 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' D' D ' 336' ' ' GLU . . . . . . . . . . . . . 4.5 tp10 -57.13 -62.95 1.4 Allowed 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.107 -0.996 . . . . 2.26 109.651 -179.635 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' D' D ' 337' ' ' ARG . . . . . 0.418 HH11 ' HG3' ' D' ' 337' ' ' ARG . 7.9 mtm-85 -60.23 -31.93 70.64 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.353 -0.842 . . . . 2.92 109.732 -179.824 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' D' D ' 338' ' ' PHE . . . . . 0.611 ' HA ' HG21 ' D' ' 332' ' ' ILE . 72.2 t80 -56.47 -55.74 29.92 Favored 'General case' 0 C--N 1.302 -1.459 0 O-C-N 121.132 -0.98 . . . . 0.37 109.992 -179.858 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' D' D ' 339' ' ' GLU . . . . . . . . . . . . . 96.5 mt-10 -52.16 -37.97 56.18 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.291 -0.881 . . . . 1.99 110.335 -179.399 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' D' D ' 340' ' ' MET . . . . . 0.457 ' SD ' ' OE1' ' A' ' 343' ' ' GLU . 28.3 ttp -62.84 -47.95 81.18 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.208 -0.932 . . . . 0.31 110.199 -179.292 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' D' D ' 341' ' ' PHE . . . . . . . . . . . . . 50.3 m-85 -62.69 -40.75 98.1 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.195 -0.941 . . . . 0.18 109.747 -179.755 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' D' D ' 342' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -50.86 -43.38 59.4 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.219 -0.925 . . . . 2.41 109.926 -179.882 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' D' D ' 343' ' ' GLU . . . . . 0.479 ' OE2' HD11 ' C' ' 348' ' ' LEU . 1.6 tt0 -58.14 -46.87 84.9 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.378 -0.826 . . . . 2.35 109.672 -179.618 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' D' D ' 344' ' ' LEU . . . . . . . . . . . . . 34.5 mt -61.35 -33.15 73.16 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.14 -0.975 . . . . 0.19 109.176 179.96 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' D' D ' 345' ' ' ASN . . . . . . . . . . . . . 12.2 t-20 -57.99 -56.31 23.62 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.449 -0.782 . . . . 1.09 109.723 179.972 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' D' D ' 346' ' ' GLU . . . . . . . . . . . . . 56.8 tt0 -63.63 -28.6 70.03 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.163 -0.96 . . . . 1.69 110.161 -179.518 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' D' D ' 347' ' ' ALA . . . . . 0.717 ' HB1' ' HB1' ' C' ' 347' ' ' ALA . . . -61.16 -61.65 2.41 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.051 -1.031 . . . . 0.18 109.846 -179.674 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' D' D ' 348' ' ' LEU . . . . . 0.589 HD22 ' N ' ' D' ' 348' ' ' LEU . 3.9 mm? -61.74 -40.9 96.73 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.17 -0.956 . . . . 0.31 109.896 -179.695 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' D' D ' 349' ' ' GLU . . . . . . . . . . . . . 96.8 mt-10 -58.49 -34.39 70.87 Favored 'General case' 0 N--CA 1.495 1.787 0 O-C-N 121.281 -0.887 . . . . 1.95 109.895 -179.737 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' D' D ' 350' ' ' LEU . . . . . 1.041 HD13 HD22 ' C' ' 350' ' ' LEU . 3.8 tt -64.75 -46.84 80.48 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.229 -0.919 . . . . 0.43 109.672 -179.688 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' D' D ' 351' ' ' LYS . . . . . . . . . . . . . 18.6 tttm -59.08 -41.97 89.3 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.317 -0.864 . . . . 1.4 109.987 -179.641 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' D' D ' 352' ' ' ASP . . . . . . . . . . . . . 38.3 m-20 -53.83 -39.67 65.77 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.155 -0.966 . . . . 1.17 109.42 179.921 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' D' D ' 353' ' ' ALA . . . . . . . . . . . . . . . -67.24 -31.97 72.69 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.217 -0.927 . . . . 0.59 109.586 -179.995 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' D' D ' 354' ' ' GLN . . . . . . . . . . . . . 3.5 tt0 -82.1 3.64 26.18 Favored 'General case' 0 N--CA 1.488 1.463 0 O-C-N 121.209 -0.932 . . . . 1.44 109.667 -179.862 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' D' D ' 355' ' ' ALA . . . . . 0.471 ' O ' ' N ' ' D' ' 357' ' ' LYS . . . -69.48 -86.22 0.02 OUTLIER 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.176 -0.952 . . . . 0.98 109.597 179.946 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' D' D ' 356' ' ' GLY . . . . . . . . . . . . . . . -55.68 88.63 0.01 OUTLIER Glycine 0 N--CA 1.491 2.364 0 N-CA-C 109.518 -1.433 . . . . 1.28 109.518 -179.881 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' D' D ' 357' ' ' LYS . . . . . 0.471 ' N ' ' O ' ' D' ' 355' ' ' ALA . 0.1 OUTLIER -89.14 18.86 4.63 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.218 -1.166 . . . . 4.09 109.688 -179.996 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' D' D ' 358' ' ' GLU . . . . . . . . . . . . . 2.3 tt0 -49.51 137.83 16.55 Favored Pre-proline 0 N--CA 1.49 1.567 0 O-C-N 121.226 -0.921 . . . . 5.71 109.343 -179.92 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' D' D ' 359' ' ' PRO . . . . . . . . . . . . . 2.1 Cg_endo -63.02 -153.84 0.02 OUTLIER 'Trans proline' 0 C--N 1.311 -1.405 0 C-N-CA 122.068 1.845 . . . . 4.97 110.091 -179.982 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' D' D ' 360' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.3 0 N-CA-C 109.298 -1.521 . . . . 6.97 109.298 179.868 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 319' ' ' LYS . . . . . . . . . . . . . 64.2 mttt . . . . . 0 N--CA 1.489 1.498 0 N-CA-C 109.168 -0.679 . . . . 7.55 109.168 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 320' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 55.66 73.31 0.43 Allowed 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.234 -0.916 . . . . 6.43 109.091 -179.657 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 321' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -81.94 126.98 73.78 Favored Pre-proline 0 N--CA 1.49 1.566 0 O-C-N 121.415 -0.803 . . . . 6.13 109.383 -179.844 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 322' ' ' PRO . . . . . . . . . . . . . 1.3 Cg_endo -64.12 -80.97 0.01 OUTLIER 'Trans proline' 0 C--N 1.31 -1.455 0 C-N-CA 122.026 1.817 . . . . 2.83 110.295 179.837 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 323' ' ' LEU . . . . . 0.456 HD23 ' HA ' ' A' ' 323' ' ' LEU . 61.1 mt -79.72 102.05 8.78 Favored 'General case' 0 N--CA 1.488 1.445 0 O-C-N 121.338 -0.851 . . . . 2.83 109.832 -179.324 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 324' ' ' ASP . . . . . . . . . . . . . 5.7 m-20 -81.44 -152.43 0.09 Allowed 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.184 -0.948 . . . . 1.53 109.285 179.683 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 325' ' ' GLY . . . . . . . . . . . . . . . -68.58 -178.93 17.92 Favored Glycine 0 N--CA 1.49 2.251 0 N-CA-C 109.422 -1.471 . . . . 0.61 109.422 179.76 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 326' ' ' GLU . . . . . . . . . . . . . 2.8 mt-10 -59.62 176.2 0.29 Allowed 'General case' 0 N--CA 1.488 1.454 0 O-C-N 121.163 -1.198 . . . . 2.13 109.397 -179.986 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 327' ' ' TYR . . . . . 0.535 ' CE1' ' HG2' ' C' ' 333' ' ' ARG . 41.0 m-85 -150.54 112.68 4.6 Favored 'General case' 0 C--N 1.303 -1.449 0 O-C-N 121.071 -1.018 . . . . 0.48 109.56 179.753 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 328' ' ' PHE . . . . . 0.416 ' HB2' ' CD1' ' C' ' 338' ' ' PHE . 69.6 m-85 -112.99 -171.53 1.88 Allowed 'General case' 0 N--CA 1.488 1.475 0 O-C-N 121.386 -0.821 . . . . 0.31 109.083 179.952 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 329' ' ' THR . . . . . . . . . . . . . 35.3 p -152.39 168.88 24.04 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.254 -0.904 . . . . 0.22 109.387 179.908 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 330' ' ' LEU . . . . . 0.463 ' O ' ' HA ' ' C' ' 329' ' ' THR . 23.3 tp -152.15 132.54 13.75 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.207 -0.933 . . . . 0.28 109.679 -179.71 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 331' ' ' GLN . . . . . 0.42 ' OE1' ' O ' ' C' ' 328' ' ' PHE . 9.2 tp-100 -87.05 114.09 23.36 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.15 -0.969 . . . . 0.91 109.325 179.692 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 332' ' ' ILE . . . . . 0.758 HG21 ' HA ' ' A' ' 338' ' ' PHE . 57.9 mt -103.96 103.9 15.92 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.59 0 O-C-N 121.22 -0.925 . . . . 0.26 109.97 -179.572 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 333' ' ' ARG . . . . . 0.488 ' HG3' ' CD2' ' C' ' 327' ' ' TYR . 5.5 mpt_? -74.19 150.96 40.1 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.191 -0.943 . . . . 2.92 109.508 179.477 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 334' ' ' GLY . . . . . . . . . . . . . . . 74.39 131.25 0.22 Allowed Glycine 0 N--CA 1.491 2.349 0 N-CA-C 109.902 -1.279 . . . . 0.4 109.902 179.519 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 335' ' ' ARG . . . . . 0.494 ' NH1' ' HG2' ' A' ' 335' ' ' ARG . 1.9 ttt-85 -79.39 -27.96 41.86 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.47 -1.018 . . . . 3.01 109.585 179.976 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 336' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -58.13 -66.95 0.4 Allowed 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.344 -0.847 . . . . 2.29 109.781 -179.953 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 337' ' ' ARG . . . . . 0.48 ' NH2' ' OD1' ' C' ' 352' ' ' ASP . 3.0 mtt180 -60.17 -29.57 68.77 Favored 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.091 -1.006 . . . . 2.93 109.456 -179.817 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 338' ' ' PHE . . . . . 0.758 ' HA ' HG21 ' A' ' 332' ' ' ILE . 54.9 t80 -55.56 -60.09 3.92 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.129 -0.982 . . . . 0.38 109.802 -179.901 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 339' ' ' GLU . . . . . . . . . . . . . 1.6 mm-40 -50.41 -34.88 26.06 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.291 -0.881 . . . . 1.97 109.701 -179.609 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 340' ' ' MET . . . . . . . . . . . . . 41.8 ttp -63.3 -48.4 78.23 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.155 -0.966 . . . . 0.31 109.751 -179.83 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 341' ' ' PHE . . . . . . . . . . . . . 44.6 m-85 -62.21 -53.15 59.39 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.213 -0.929 . . . . 0.18 109.704 -179.956 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 342' ' ' ARG . . . . . 0.458 ' NH1' ' CG ' ' A' ' 342' ' ' ARG . 0.0 OUTLIER -45.68 -41.27 10.24 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.351 -0.843 . . . . 2.42 109.832 -179.881 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 343' ' ' GLU . . . . . . . . . . . . . 8.8 tp10 -59.37 -46.65 88.07 Favored 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.2 -0.937 . . . . 2.35 109.661 -179.816 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 344' ' ' LEU . . . . . 0.681 HD22 HD22 ' B' ' 344' ' ' LEU . 56.9 mt -62.06 -44.49 96.58 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.153 -0.967 . . . . 0.18 110.112 -179.586 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 345' ' ' ASN . . . . . 0.614 HD22 HD11 ' C' ' 330' ' ' LEU . 41.5 t-20 -55.68 -43.15 76.09 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.176 -0.953 . . . . 1.09 109.626 -179.625 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 346' ' ' GLU . . . . . . . . . . . . . 43.4 tt0 -61.13 -38.69 87.25 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.085 -1.009 . . . . 1.65 109.362 -179.921 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 347' ' ' ALA . . . . . 1.003 ' HB1' ' HB1' ' B' ' 347' ' ' ALA . . . -60.03 -50.27 74.39 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.305 -0.872 . . . . 0.18 109.898 -179.758 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 348' ' ' LEU . . . . . 0.559 HD22 ' N ' ' A' ' 348' ' ' LEU . 3.9 mm? -61.05 -47.3 86.99 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.235 -0.916 . . . . 0.3 110.065 -179.413 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 349' ' ' GLU . . . . . . . . . . . . . 1.6 mm-40 -57.54 -36.27 71.4 Favored 'General case' 0 N--CA 1.489 1.485 0 O-C-N 121.213 -0.929 . . . . 1.94 109.821 -179.347 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 350' ' ' LEU . . . . . 0.696 HD13 HD22 ' B' ' 350' ' ' LEU . 5.2 tt -62.07 -44.71 96.09 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.13 -0.981 . . . . 0.46 109.073 -179.992 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 351' ' ' LYS . . . . . . . . . . . . . 26.1 tttp -58.21 -44.83 88.35 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.31 -0.869 . . . . 1.4 109.239 179.762 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 352' ' ' ASP . . . . . . . . . . . . . 5.4 m-20 -56.46 -41.16 76.03 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.256 -0.903 . . . . 1.16 109.461 179.893 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 353' ' ' ALA . . . . . . . . . . . . . . . -67.45 -32.83 73.95 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.35 -0.844 . . . . 0.63 109.32 -179.963 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 354' ' ' GLN . . . . . . . . . . . . . 7.4 tt0 -81.42 6.16 15.42 Favored 'General case' 0 N--CA 1.489 1.489 0 O-C-N 121.179 -0.951 . . . . 1.47 109.167 179.693 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 355' ' ' ALA . . . . . 0.446 ' O ' ' HE3' ' A' ' 357' ' ' LYS . . . -69.2 -91.0 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.048 -1.033 . . . . 1.01 109.626 -179.807 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 356' ' ' GLY . . . . . . . . . . . . . . . -74.41 105.58 1.88 Allowed Glycine 0 N--CA 1.493 2.457 0 N-CA-C 109.96 -1.256 . . . . 1.3 109.96 -179.688 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 357' ' ' LYS . . . . . 0.446 ' HE3' ' O ' ' A' ' 355' ' ' ALA . 0.0 OUTLIER -88.77 136.74 32.85 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.174 -1.192 . . . . 4.1 109.318 179.825 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 358' ' ' GLU . . . . . 0.573 ' CB ' ' HD3' ' A' ' 359' ' ' PRO . 3.0 mt-10 -52.5 -57.23 16.45 Favored Pre-proline 0 N--CA 1.489 1.513 0 O-C-N 121.097 -1.002 . . . . 5.75 109.751 179.896 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 359' ' ' PRO . . . . . 0.573 ' HD3' ' CB ' ' A' ' 358' ' ' GLU . 2.3 Cg_endo -61.38 112.79 1.53 Allowed 'Trans proline' 0 C--N 1.312 -1.355 0 C-N-CA 121.937 1.758 . . . . 5.0 110.343 -179.989 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 360' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.345 0 N-CA-C 109.613 -1.395 . . . . 6.97 109.613 179.899 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' B' B ' 319' ' ' LYS . . . . . . . . . . . . . 60.6 mttt . . . . . 0 N--CA 1.488 1.474 0 N-CA-C 109.456 -0.572 . . . . 7.55 109.456 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' B' B ' 320' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 55.58 71.97 0.51 Allowed 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.197 -0.939 . . . . 6.44 109.365 179.982 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 321' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -80.65 127.49 75.23 Favored Pre-proline 0 N--CA 1.49 1.54 0 O-C-N 121.525 -0.734 . . . . 6.13 109.531 -179.881 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 322' ' ' PRO . . . . . . . . . . . . . 1.0 OUTLIER -64.86 -80.99 0.01 OUTLIER 'Trans proline' 0 C--N 1.313 -1.314 0 C-N-CA 122.082 1.855 . . . . 2.82 110.232 179.935 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 323' ' ' LEU . . . . . 0.466 HD23 ' HA ' ' B' ' 323' ' ' LEU . 63.3 mt -79.76 101.35 8.41 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.215 -0.928 . . . . 2.84 109.923 -179.494 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 324' ' ' ASP . . . . . . . . . . . . . 5.6 m-20 -80.43 -154.25 0.1 Allowed 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.26 -0.9 . . . . 1.53 109.368 179.511 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 325' ' ' GLY . . . . . . . . . . . . . . . -67.46 -179.21 13.25 Favored Glycine 0 N--CA 1.492 2.373 0 N-CA-C 109.417 -1.473 . . . . 0.59 109.417 179.769 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 326' ' ' GLU . . . . . . . . . . . . . 2.7 mt-10 -59.52 176.02 0.3 Allowed 'General case' 0 N--CA 1.489 1.489 0 O-C-N 121.147 -1.207 . . . . 2.13 109.631 -179.923 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 327' ' ' TYR . . . . . . . . . . . . . 41.3 m-85 -149.91 112.65 4.78 Favored 'General case' 0 N--CA 1.489 1.491 0 O-C-N 121.089 -1.007 . . . . 0.48 109.635 179.751 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 328' ' ' PHE . . . . . 0.446 ' O ' ' OE1' ' D' ' 331' ' ' GLN . 67.7 m-85 -113.57 -172.75 2.13 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.439 -0.788 . . . . 0.32 109.244 179.879 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 329' ' ' THR . . . . . . . . . . . . . 37.1 p -151.81 168.95 23.48 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.134 -0.979 . . . . 0.23 109.515 -179.799 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 330' ' ' LEU . . . . . . . . . . . . . 20.8 tp -152.29 132.66 13.71 Favored 'General case' 0 C--N 1.304 -1.398 0 O-C-N 121.039 -1.038 . . . . 0.28 109.532 -179.726 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 331' ' ' GLN . . . . . . . . . . . . . 9.0 tp-100 -87.03 114.01 23.27 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.33 -0.856 . . . . 0.91 109.354 179.727 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 332' ' ' ILE . . . . . 0.753 HG21 ' HA ' ' B' ' 338' ' ' PHE . 57.4 mt -103.94 103.54 15.37 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.633 0 O-C-N 121.151 -0.968 . . . . 0.24 110.11 -179.598 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 333' ' ' ARG . . . . . 0.494 ' CG ' ' CE1' ' D' ' 327' ' ' TYR . 5.7 mpt_? -73.65 150.8 41.07 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.193 -0.942 . . . . 2.93 109.399 179.798 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 334' ' ' GLY . . . . . . . . . . . . . . . 74.8 131.07 0.24 Allowed Glycine 0 N--CA 1.49 2.264 0 N-CA-C 109.857 -1.297 . . . . 0.4 109.857 179.417 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 335' ' ' ARG . . . . . 0.507 ' HG2' ' NH1' ' B' ' 335' ' ' ARG . 1.9 ttt-85 -79.46 -27.48 41.6 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.442 -1.034 . . . . 3.01 109.605 -179.976 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 336' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -58.42 -66.84 0.42 Allowed 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.341 -0.849 . . . . 2.28 109.63 -179.902 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 337' ' ' ARG . . . . . . . . . . . . . 3.0 mtt180 -60.23 -29.4 68.73 Favored 'General case' 0 N--CA 1.489 1.492 0 O-C-N 121.202 -0.936 . . . . 2.93 109.653 -179.841 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 338' ' ' PHE . . . . . 0.753 ' HA ' HG21 ' B' ' 332' ' ' ILE . 58.5 t80 -55.53 -60.0 4.04 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.257 -0.902 . . . . 0.37 109.872 -179.877 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 339' ' ' GLU . . . . . . . . . . . . . 1.9 mm-40 -50.66 -35.16 29.38 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.347 -0.845 . . . . 1.98 109.687 -179.615 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 340' ' ' MET . . . . . . . . . . . . . 43.4 ttp -63.19 -48.49 78.14 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.164 -0.96 . . . . 0.32 109.722 -179.702 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 341' ' ' PHE . . . . . . . . . . . . . 45.4 m-85 -62.56 -52.31 63.91 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.124 -0.985 . . . . 0.18 109.81 179.933 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 342' ' ' ARG . . . . . 0.439 ' CG ' HH11 ' B' ' 342' ' ' ARG . 0.0 OUTLIER -46.26 -40.98 12.4 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.266 -0.896 . . . . 2.42 109.693 -179.803 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' B' B ' 343' ' ' GLU . . . . . . . . . . . . . 8.9 tp10 -59.52 -46.47 88.75 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.255 -0.903 . . . . 2.35 109.611 -179.816 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 344' ' ' LEU . . . . . 0.681 HD22 HD22 ' A' ' 344' ' ' LEU . 57.7 mt -62.18 -44.88 95.62 Favored 'General case' 0 N--CA 1.49 1.525 0 O-C-N 121.177 -0.952 . . . . 0.18 110.219 -179.608 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 345' ' ' ASN . . . . . 0.535 HD22 HD11 ' D' ' 330' ' ' LEU . 43.1 t-20 -55.59 -42.64 75.08 Favored 'General case' 0 N--CA 1.489 1.476 0 O-C-N 121.177 -0.952 . . . . 1.09 109.694 -179.532 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 346' ' ' GLU . . . . . . . . . . . . . 40.9 tt0 -61.06 -39.02 88.28 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.251 -0.905 . . . . 1.66 109.391 -179.894 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 347' ' ' ALA . . . . . 1.003 ' HB1' ' HB1' ' A' ' 347' ' ' ALA . . . -60.21 -50.17 74.71 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.324 -0.86 . . . . 0.17 109.964 -179.857 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 348' ' ' LEU . . . . . 0.56 HD22 ' N ' ' B' ' 348' ' ' LEU . 3.9 mm? -60.81 -47.53 85.91 Favored 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.285 -0.884 . . . . 0.29 109.973 -179.369 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 349' ' ' GLU . . . . . . . . . . . . . 1.5 mm-40 -57.65 -35.56 70.69 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.222 -0.923 . . . . 1.95 109.983 -179.574 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 350' ' ' LEU . . . . . 0.696 HD22 HD13 ' A' ' 350' ' ' LEU . 5.2 tt -62.67 -44.69 95.6 Favored 'General case' 0 N--CA 1.489 1.505 0 O-C-N 120.968 -1.083 . . . . 0.45 108.999 179.799 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 351' ' ' LYS . . . . . . . . . . . . . 28.2 tttp -58.82 -44.69 90.9 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.195 -0.941 . . . . 1.38 109.428 179.647 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 352' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 -56.44 -41.85 77.15 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.261 -0.899 . . . . 1.16 109.286 179.659 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 353' ' ' ALA . . . . . . . . . . . . . . . -66.63 -32.77 74.31 Favored 'General case' 0 N--CA 1.494 1.749 0 O-C-N 121.27 -0.894 . . . . 0.61 109.47 179.656 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 354' ' ' GLN . . . . . 0.424 ' NE2' HD11 ' A' ' 350' ' ' LEU . 7.8 tt0 -80.96 5.26 16.83 Favored 'General case' 0 C--N 1.304 -1.387 0 O-C-N 121.222 -0.924 . . . . 1.45 109.38 179.951 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 355' ' ' ALA . . . . . 0.434 ' O ' ' HE3' ' B' ' 357' ' ' LYS . . . -68.96 -91.61 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.102 -0.999 . . . . 0.98 109.851 -179.698 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 356' ' ' GLY . . . . . . . . . . . . . . . -72.89 105.0 1.65 Allowed Glycine 0 N--CA 1.49 2.25 0 N-CA-C 109.911 -1.276 . . . . 1.29 109.911 -179.619 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 357' ' ' LYS . . . . . 0.434 ' HE3' ' O ' ' B' ' 355' ' ' ALA . 0.0 OUTLIER -88.79 136.13 33.16 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.382 -1.07 . . . . 4.09 109.37 179.84 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' B' B ' 358' ' ' GLU . . . . . 0.573 ' CB ' ' HD3' ' B' ' 359' ' ' PRO . 2.7 mt-10 -52.13 -57.07 16.54 Favored Pre-proline 0 N--CA 1.489 1.504 0 O-C-N 121.168 -0.958 . . . . 5.72 109.866 179.934 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 359' ' ' PRO . . . . . 0.573 ' HD3' ' CB ' ' B' ' 358' ' ' GLU . 2.3 Cg_endo -61.46 115.2 2.6 Favored 'Trans proline' 0 C--N 1.311 -1.413 0 C-N-CA 121.979 1.786 . . . . 4.98 110.349 -179.834 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 360' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.276 0 CA-C-O 117.979 -1.456 . . . . 6.98 109.491 179.892 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' C' C ' 319' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.488 1.446 0 N-CA-C 109.498 -0.556 . . . . 6.82 109.498 . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' C' C ' 320' ' ' LYS . . . . . 0.452 ' O ' ' O ' ' C' ' 321' ' ' LYS . 0.1 OUTLIER -81.72 -19.12 42.14 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.416 -0.803 . . . . 6.49 109.742 -179.951 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' C' C ' 321' ' ' LYS . . . . . 0.452 ' O ' ' O ' ' C' ' 320' ' ' LYS . 11.8 mmtm 60.58 121.04 0.02 OUTLIER Pre-proline 0 N--CA 1.492 1.656 0 O-C-N 121.269 -0.894 . . . . 6.4 109.769 179.871 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' C' C ' 322' ' ' PRO . . . . . . . . . . . . . 1.0 OUTLIER -64.06 -80.98 0.01 OUTLIER 'Trans proline' 0 C--N 1.315 -1.208 0 C-N-CA 122.138 1.892 . . . . 3.42 110.551 179.824 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' C' C ' 323' ' ' LEU . . . . . . . . . . . . . 58.8 mt -79.87 95.21 6.0 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.107 -0.995 . . . . 3.95 109.419 -179.766 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' C' C ' 324' ' ' ASP . . . . . 0.47 ' N ' ' OD1' ' C' ' 324' ' ' ASP . 1.1 m-20 -79.33 -144.7 0.04 OUTLIER 'General case' 0 C--N 1.304 -1.405 0 O-C-N 121.174 -0.953 . . . . 1.63 108.858 179.8 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' C' C ' 325' ' ' GLY . . . . . 0.532 ' O ' ' CE1' ' C' ' 327' ' ' TYR . . . -68.72 175.12 31.07 Favored Glycine 0 N--CA 1.49 2.273 0 N-CA-C 109.711 -1.356 . . . . 0.73 109.711 -179.97 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' C' C ' 326' ' ' GLU . . . . . . . . . . . . . 11.6 mm-40 -58.13 -176.52 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.189 -1.183 . . . . 2.17 109.578 -179.993 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' C' C ' 327' ' ' TYR . . . . . 0.532 ' CE1' ' O ' ' C' ' 325' ' ' GLY . 59.5 m-85 -150.85 103.21 3.05 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.176 -0.953 . . . . 0.48 109.698 -179.877 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' C' C ' 328' ' ' PHE . . . . . 0.439 ' C ' HG23 ' C' ' 329' ' ' THR . 38.3 m-85 -102.13 -169.13 1.63 Allowed 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.294 -0.879 . . . . 0.33 109.432 -179.984 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' C' C ' 329' ' ' THR . . . . . 0.463 ' HA ' ' O ' ' A' ' 330' ' ' LEU . 68.1 p -154.41 170.4 21.46 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.107 -0.996 . . . . 0.23 109.259 179.991 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' C' C ' 330' ' ' LEU . . . . . 0.614 HD11 HD22 ' A' ' 345' ' ' ASN . 22.6 tp -151.31 124.76 8.91 Favored 'General case' 0 N--CA 1.489 1.495 0 O-C-N 121.272 -0.893 . . . . 0.28 109.746 -179.692 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' C' C ' 331' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -87.24 112.49 22.07 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.289 -0.882 . . . . 1.48 109.189 179.522 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' C' C ' 332' ' ' ILE . . . . . 0.541 HG21 ' HA ' ' C' ' 338' ' ' PHE . 94.2 mt -103.84 111.12 32.28 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.528 0 O-C-N 121.105 -0.997 . . . . 0.24 109.632 -179.895 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' C' C ' 333' ' ' ARG . . . . . 0.535 ' HG2' ' CE1' ' A' ' 327' ' ' TYR . 61.2 mtm180 -74.24 141.78 45.36 Favored 'General case' 0 C--N 1.301 -1.503 0 O-C-N 121.458 -0.776 . . . . 2.74 109.517 179.718 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' C' C ' 334' ' ' GLY . . . . . . . . . . . . . . . 86.73 132.85 3.43 Favored Glycine 0 N--CA 1.492 2.381 0 N-CA-C 109.667 -1.373 . . . . 0.35 109.667 179.921 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' C' C ' 335' ' ' ARG . . . . . . . . . . . . . 6.6 ttm180 -78.28 -27.21 47.36 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.264 -1.139 . . . . 2.53 109.437 179.889 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' C' C ' 336' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -58.02 -70.76 0.13 Allowed 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.411 -0.805 . . . . 2.62 110.126 -179.864 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' C' C ' 337' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -57.98 -30.66 66.21 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.328 -0.857 . . . . 2.81 109.677 -179.372 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' C' C ' 338' ' ' PHE . . . . . 0.541 ' HA ' HG21 ' C' ' 332' ' ' ILE . 77.8 t80 -53.38 -60.39 3.36 Favored 'General case' 0 C--N 1.303 -1.438 0 O-C-N 121.167 -0.958 . . . . 0.4 109.545 -179.797 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' C' C ' 339' ' ' GLU . . . . . . . . . . . . . 51.5 mt-10 -51.22 -32.41 23.94 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.391 -0.818 . . . . 2.05 109.954 -179.64 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' C' C ' 340' ' ' MET . . . . . . . . . . . . . 59.2 ttp -64.16 -51.12 65.38 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.222 -0.923 . . . . 0.32 109.643 -179.944 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' C' C ' 341' ' ' PHE . . . . . . . . . . . . . 49.3 m-85 -62.08 -49.86 74.25 Favored 'General case' 0 N--CA 1.489 1.495 0 O-C-N 121.184 -0.948 . . . . 0.18 110.022 -179.597 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' C' C ' 342' ' ' ARG . . . . . 0.419 ' O ' ' HB3' ' C' ' 345' ' ' ASN . 22.7 tpt180 -49.32 -37.41 24.21 Favored 'General case' 0 N--CA 1.488 1.451 0 O-C-N 121.09 -1.006 . . . . 2.91 109.552 -179.879 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' C' C ' 343' ' ' GLU . . . . . . . . . . . . . 1.1 tp10 -59.18 -52.33 66.16 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.233 -0.917 . . . . 2.14 109.566 179.868 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' C' C ' 344' ' ' LEU . . . . . 0.626 HD22 HD22 ' D' ' 344' ' ' LEU . 60.0 mt -62.59 -25.5 68.11 Favored 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.157 -0.964 . . . . 0.22 109.242 179.803 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' C' C ' 345' ' ' ASN . . . . . 0.419 ' HB3' ' O ' ' C' ' 342' ' ' ARG . 16.2 t-20 -57.86 -56.8 17.28 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.414 -0.803 . . . . 1.08 109.383 -179.896 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' C' C ' 346' ' ' GLU . . . . . . . . . . . . . 20.8 tt0 -62.03 -29.45 70.29 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.34 -0.85 . . . . 2.21 110.042 -179.641 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' C' C ' 347' ' ' ALA . . . . . 0.996 ' HB1' ' HB1' ' D' ' 347' ' ' ALA . . . -61.29 -54.54 42.75 Favored 'General case' 0 N--CA 1.494 1.74 0 O-C-N 121.018 -1.051 . . . . 0.18 110.199 -179.311 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' C' C ' 348' ' ' LEU . . . . . 0.568 HD22 ' N ' ' C' ' 348' ' ' LEU . 4.2 mm? -61.7 -51.49 68.18 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.318 -0.864 . . . . 0.32 110.463 -179.402 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' C' C ' 349' ' ' GLU . . . . . . . . . . . . . 11.5 mt-10 -57.41 -33.37 67.79 Favored 'General case' 0 N--CA 1.494 1.757 0 O-C-N 121.11 -0.994 . . . . 2.19 110.244 -179.352 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' C' C ' 350' ' ' LEU . . . . . 0.809 HD22 HD13 ' D' ' 350' ' ' LEU . 9.3 tt -62.9 -42.86 99.93 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.116 -0.99 . . . . 0.46 109.365 -179.758 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' C' C ' 351' ' ' LYS . . . . . 0.521 ' HA ' ' HG2' ' C' ' 354' ' ' GLN . 38.4 tttp -60.14 -51.62 68.82 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.288 -0.882 . . . . 1.35 109.445 179.547 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' C' C ' 352' ' ' ASP . . . . . 0.48 ' OD1' ' NH2' ' A' ' 337' ' ' ARG . 18.1 m-20 -55.46 -37.91 68.37 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.297 -0.877 . . . . 1.19 109.84 179.887 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' C' C ' 353' ' ' ALA . . . . . . . . . . . . . . . -66.96 -38.91 86.98 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.298 -0.876 . . . . 0.57 109.958 -179.581 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' C' C ' 354' ' ' GLN . . . . . 0.521 ' HG2' ' HA ' ' C' ' 351' ' ' LYS . 10.9 pt20 -81.83 -11.6 58.89 Favored 'General case' 0 N--CA 1.489 1.484 0 O-C-N 121.186 -0.946 . . . . 1.47 109.708 -179.592 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' C' C ' 355' ' ' ALA . . . . . . . . . . . . . . . -72.52 -35.39 68.07 Favored 'General case' 0 N--CA 1.489 1.491 0 O-C-N 121.182 -0.949 . . . . 0.93 109.682 179.921 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' C' C ' 356' ' ' GLY . . . . . . . . . . . . . . . -80.57 9.76 48.51 Favored Glycine 0 N--CA 1.492 2.374 0 N-CA-C 110.177 -1.169 . . . . 1.33 110.177 -179.787 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' C' C ' 357' ' ' LYS . . . . . . . . . . . . . 3.4 tttp -84.78 100.85 11.8 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.131 -1.217 . . . . 4.01 109.254 179.784 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' C' C ' 358' ' ' GLU . . . . . . . . . . . . . 3.6 mt-10 -49.64 149.88 4.01 Favored Pre-proline 0 N--CA 1.49 1.572 0 O-C-N 121.195 -0.94 . . . . 5.75 109.019 179.93 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' C' C ' 359' ' ' PRO . . . . . . . . . . . . . 2.0 Cg_endo -67.05 -5.92 14.77 Favored 'Trans proline' 0 C--N 1.31 -1.468 0 C-N-CA 122.393 2.062 . . . . 4.94 110.301 -179.866 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' C' C ' 360' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.28 0 N-CA-C 109.327 -1.509 . . . . 6.5 109.327 179.887 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' D' D ' 319' ' ' LYS . . . . . . . . . . . . . 54.6 mttt . . . . . 0 N--CA 1.492 1.647 0 N-CA-C 109.532 -0.544 . . . . 7.53 109.532 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' D' D ' 320' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 57.11 71.78 0.55 Allowed 'General case' 0 N--CA 1.489 1.478 0 O-C-N 121.249 -0.907 . . . . 6.41 109.279 -179.909 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' D' D ' 321' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -80.94 126.59 77.12 Favored Pre-proline 0 N--CA 1.493 1.682 0 O-C-N 121.386 -0.821 . . . . 6.11 109.35 -179.667 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' D' D ' 322' ' ' PRO . . . . . . . . . . . . . 0.9 OUTLIER -64.52 -80.87 0.01 OUTLIER 'Trans proline' 0 C--N 1.314 -1.276 0 C-N-CA 122.168 1.912 . . . . 2.82 110.101 -179.878 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' D' D ' 323' ' ' LEU . . . . . 0.444 ' HA ' HD23 ' D' ' 323' ' ' LEU . 62.6 mt -79.18 100.99 7.71 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.272 -0.893 . . . . 2.83 109.905 -179.779 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' D' D ' 324' ' ' ASP . . . . . . . . . . . . . 5.5 m-20 -80.41 -153.34 0.09 Allowed 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.284 -0.885 . . . . 1.54 109.359 179.635 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' D' D ' 325' ' ' GLY . . . . . . . . . . . . . . . -68.77 -178.84 18.56 Favored Glycine 0 N--CA 1.491 2.33 0 N-CA-C 109.443 -1.463 . . . . 0.59 109.443 -179.956 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' D' D ' 326' ' ' GLU . . . . . . . . . . . . . 2.6 mt-10 -59.29 176.46 0.24 Allowed 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.029 -1.277 . . . . 2.13 109.469 -179.934 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' D' D ' 327' ' ' TYR . . . . . 0.494 ' CE1' ' CG ' ' B' ' 333' ' ' ARG . 42.5 m-85 -150.53 112.49 4.55 Favored 'General case' 0 N--CA 1.488 1.442 0 O-C-N 121.204 -0.935 . . . . 0.47 109.421 179.913 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' D' D ' 328' ' ' PHE . . . . . 0.411 ' HB2' ' CD1' ' B' ' 338' ' ' PHE . 69.7 m-85 -114.06 -173.02 2.2 Favored 'General case' 0 N--CA 1.489 1.52 0 N-CA-C 108.985 -0.746 . . . . 0.3 108.985 179.802 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' D' D ' 329' ' ' THR . . . . . . . . . . . . . 39.7 p -151.44 169.65 21.52 Favored 'General case' 0 C--N 1.302 -1.473 0 O-C-N 121.288 -0.883 . . . . 0.22 109.379 -179.916 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' D' D ' 330' ' ' LEU . . . . . 0.535 HD11 HD22 ' B' ' 345' ' ' ASN . 19.5 tp -152.4 132.4 13.41 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.311 -0.868 . . . . 0.28 109.706 -179.767 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' D' D ' 331' ' ' GLN . . . . . 0.446 ' OE1' ' O ' ' B' ' 328' ' ' PHE . 9.0 tp-100 -86.83 113.77 22.92 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.313 -0.867 . . . . 0.93 109.306 179.639 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' D' D ' 332' ' ' ILE . . . . . 0.747 HG21 ' HA ' ' D' ' 338' ' ' PHE . 54.3 mt -103.72 102.97 14.46 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.746 0 O-C-N 121.242 -0.911 . . . . 0.25 110.235 -179.593 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' D' D ' 333' ' ' ARG . . . . . . . . . . . . . 5.6 mpt_? -73.45 150.92 41.31 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.027 -1.045 . . . . 2.93 109.639 179.615 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' D' D ' 334' ' ' GLY . . . . . . . . . . . . . . . 74.86 130.73 0.24 Allowed Glycine 0 N--CA 1.491 2.33 0 N-CA-C 109.836 -1.305 . . . . 0.41 109.836 179.57 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' D' D ' 335' ' ' ARG . . . . . 0.507 ' HG2' ' NH1' ' D' ' 335' ' ' ARG . 1.9 ttt-85 -79.06 -27.88 43.14 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.299 -1.118 . . . . 3.03 109.642 -179.997 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' D' D ' 336' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -57.71 -66.54 0.45 Allowed 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.21 -0.931 . . . . 2.26 109.695 -179.937 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' D' D ' 337' ' ' ARG . . . . . . . . . . . . . 2.9 mpt_? -60.73 -29.29 69.28 Favored 'General case' 0 N--CA 1.489 1.486 0 O-C-N 121.223 -0.923 . . . . 2.92 109.386 -179.772 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' D' D ' 338' ' ' PHE . . . . . 0.747 ' HA ' HG21 ' D' ' 332' ' ' ILE . 57.1 t80 -55.52 -60.55 3.26 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.19 -0.944 . . . . 0.37 109.611 -179.785 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' D' D ' 339' ' ' GLU . . . . . . . . . . . . . 2.2 mm-40 -49.91 -34.9 21.8 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.259 -0.901 . . . . 1.99 109.898 -179.745 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' D' D ' 340' ' ' MET . . . . . . . . . . . . . 42.0 ttp -63.36 -48.87 76.15 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.144 -0.972 . . . . 0.31 109.796 -179.663 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' D' D ' 341' ' ' PHE . . . . . . . . . . . . . 45.9 m-85 -62.39 -52.64 62.81 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.137 -0.977 . . . . 0.18 109.583 -179.875 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' D' D ' 342' ' ' ARG . . . . . 0.457 ' CG ' HH11 ' D' ' 342' ' ' ARG . 0.0 OUTLIER -45.78 -40.58 9.8 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.24 -0.913 . . . . 2.41 109.638 -179.896 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' D' D ' 343' ' ' GLU . . . . . . . . . . . . . 9.1 tp10 -59.67 -46.56 88.67 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.171 -0.956 . . . . 2.35 109.724 -179.835 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' D' D ' 344' ' ' LEU . . . . . 0.626 HD22 HD22 ' C' ' 344' ' ' LEU . 57.1 mt -62.5 -44.92 95.19 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.289 -0.882 . . . . 0.19 110.186 -179.374 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' D' D ' 345' ' ' ASN . . . . . . . . . . . . . 44.9 t-20 -55.52 -42.47 74.58 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.176 -0.953 . . . . 1.09 109.632 -179.622 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' D' D ' 346' ' ' GLU . . . . . . . . . . . . . 33.7 tt0 -60.86 -39.49 89.36 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.204 -0.935 . . . . 1.69 109.614 -179.962 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' D' D ' 347' ' ' ALA . . . . . 0.996 ' HB1' ' HB1' ' C' ' 347' ' ' ALA . . . -60.5 -49.62 76.83 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.393 -0.817 . . . . 0.18 109.97 -179.861 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' D' D ' 348' ' ' LEU . . . . . 0.555 HD22 ' N ' ' D' ' 348' ' ' LEU . 3.9 mm? -60.93 -47.18 87.62 Favored 'General case' 0 N--CA 1.493 1.711 0 O-C-N 121.237 -0.914 . . . . 0.31 110.024 -179.327 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' D' D ' 349' ' ' GLU . . . . . . . . . . . . . 1.4 mm-40 -58.12 -36.01 72.32 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.11 -0.994 . . . . 1.95 109.796 -179.66 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' D' D ' 350' ' ' LEU . . . . . 0.809 HD13 HD22 ' C' ' 350' ' ' LEU . 5.2 tt -62.32 -44.54 96.26 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.124 -0.985 . . . . 0.43 109.01 -179.971 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' D' D ' 351' ' ' LYS . . . . . . . . . . . . . 28.4 tttp -59.09 -44.64 91.93 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.292 -0.88 . . . . 1.4 109.289 179.767 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' D' D ' 352' ' ' ASP . . . . . . . . . . . . . 4.2 m-20 -56.66 -41.2 76.81 Favored 'General case' 0 N--CA 1.488 1.434 0 O-C-N 121.343 -0.848 . . . . 1.17 109.255 179.823 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' D' D ' 353' ' ' ALA . . . . . . . . . . . . . . . -67.63 -31.81 72.08 Favored 'General case' 0 N--CA 1.488 1.447 0 O-C-N 121.22 -0.925 . . . . 0.59 109.31 -179.799 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' D' D ' 354' ' ' GLN . . . . . . . . . . . . . 7.6 tt0 -81.51 5.35 18.11 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.442 -0.786 . . . . 1.44 109.485 179.897 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' D' D ' 355' ' ' ALA . . . . . 0.458 ' O ' ' HE3' ' D' ' 357' ' ' LYS . . . -69.47 -92.63 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.259 -0.901 . . . . 0.98 109.624 -179.781 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' D' D ' 356' ' ' GLY . . . . . . . . . . . . . . . -71.51 104.62 1.48 Allowed Glycine 0 N--CA 1.495 2.613 0 N-CA-C 109.911 -1.276 . . . . 1.28 109.911 -179.686 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' D' D ' 357' ' ' LYS . . . . . 0.458 ' HE3' ' O ' ' D' ' 355' ' ' ALA . 0.0 OUTLIER -88.42 136.08 33.16 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.125 -1.22 . . . . 4.09 109.239 179.622 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' D' D ' 358' ' ' GLU . . . . . 0.57 ' CB ' ' HD3' ' D' ' 359' ' ' PRO . 2.9 mt-10 -52.23 -56.7 19.76 Favored Pre-proline 0 N--CA 1.491 1.609 0 O-C-N 121.08 -1.013 . . . . 5.71 109.669 -179.915 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' D' D ' 359' ' ' PRO . . . . . 0.57 ' HD3' ' CB ' ' D' ' 358' ' ' GLU . 2.5 Cg_endo -61.47 117.01 3.78 Favored 'Trans proline' 0 C--N 1.312 -1.374 0 C-N-CA 121.96 1.773 . . . . 4.97 110.377 -179.894 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' D' D ' 360' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.286 0 CA-C-O 117.977 -1.457 . . . . 6.97 109.546 179.789 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 319' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.49 1.534 0 N-CA-C 109.521 -0.548 . . . . 7.55 109.521 . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 320' ' ' LYS . . . . . 0.47 ' O ' ' HD3' ' A' ' 322' ' ' PRO . 0.7 OUTLIER 64.53 43.21 4.54 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.293 -0.88 . . . . 6.43 109.721 179.818 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 321' ' ' LYS . . . . . . . . . . . . . 33.8 mttt -82.05 114.19 48.89 Favored Pre-proline 0 N--CA 1.492 1.64 0 O-C-N 121.23 -0.919 . . . . 6.13 109.28 179.753 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 322' ' ' PRO . . . . . 0.47 ' HD3' ' O ' ' A' ' 320' ' ' LYS . 2.3 Cg_endo -68.54 -3.72 11.64 Favored 'Trans proline' 0 C--N 1.313 -1.291 0 C-N-CA 121.904 1.736 . . . . 2.83 110.514 -179.892 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 323' ' ' LEU . . . . . 0.416 ' HA ' HD23 ' A' ' 323' ' ' LEU . 42.4 mt -82.12 92.06 6.79 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.106 -0.996 . . . . 2.83 109.512 179.95 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 324' ' ' ASP . . . . . . . . . . . . . 3.5 m-20 -81.55 127.76 33.19 Favored 'General case' 0 N--CA 1.489 1.499 0 O-C-N 121.277 -0.889 . . . . 1.53 109.223 179.823 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 325' ' ' GLY . . . . . 0.5 ' O ' ' CD1' ' A' ' 327' ' ' TYR . . . -67.55 176.57 23.79 Favored Glycine 0 N--CA 1.49 2.273 0 N-CA-C 109.145 -1.582 . . . . 0.61 109.145 179.988 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 326' ' ' GLU . . . . . . . . . . . . . 19.9 mm-40 -56.87 171.52 0.33 Allowed 'General case' 0 N--CA 1.487 1.422 0 O-C-N 121.102 -1.234 . . . . 2.13 109.217 -179.882 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 327' ' ' TYR . . . . . 0.606 ' CE2' ' HG2' ' C' ' 333' ' ' ARG . 42.4 m-85 -148.14 109.24 4.29 Favored 'General case' 0 C--N 1.302 -1.499 0 O-C-N 121.317 -0.864 . . . . 0.48 109.318 -179.938 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 328' ' ' PHE . . . . . 0.417 ' C ' HG23 ' A' ' 329' ' ' THR . 81.5 m-85 -110.65 -170.22 1.6 Allowed 'General case' 0 N--CA 1.488 1.446 0 O-C-N 121.356 -0.84 . . . . 0.31 109.344 -179.901 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 329' ' ' THR . . . . . 0.417 HG23 ' C ' ' A' ' 328' ' ' PHE . 73.2 p -153.7 162.22 41.43 Favored 'General case' 0 C--N 1.302 -1.462 0 O-C-N 121.267 -0.896 . . . . 0.22 109.3 -179.905 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 330' ' ' LEU . . . . . 0.481 ' O ' ' HA ' ' C' ' 329' ' ' THR . 15.8 tp -149.32 130.06 14.14 Favored 'General case' 0 N--CA 1.488 1.434 0 O-C-N 121.166 -0.959 . . . . 0.28 109.367 -179.752 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 331' ' ' GLN . . . . . . . . . . . . . 2.0 tp60 -86.03 121.64 28.93 Favored 'General case' 0 N--CA 1.489 1.482 0 O-C-N 121.35 -0.844 . . . . 0.91 109.54 -179.906 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 332' ' ' ILE . . . . . 0.875 HG21 ' HA ' ' A' ' 338' ' ' PHE . 72.1 mt -103.45 103.73 15.59 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.561 0 O-C-N 121.238 -0.914 . . . . 0.26 109.425 -179.999 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 333' ' ' ARG . . . . . 0.559 ' HG2' ' CE1' ' C' ' 327' ' ' TYR . 0.3 OUTLIER -72.68 146.24 46.66 Favored 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.258 -0.901 . . . . 2.92 109.461 -179.985 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 334' ' ' GLY . . . . . . . . . . . . . . . 75.68 119.67 0.13 Allowed Glycine 0 N--CA 1.491 2.319 0 N-CA-C 109.621 -1.392 . . . . 0.4 109.621 179.993 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 335' ' ' ARG . . . . . 0.456 ' O ' ' HB3' ' A' ' 338' ' ' PHE . 1.8 ttt180 -65.6 -27.31 68.31 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.308 -1.113 . . . . 3.01 109.612 179.951 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 336' ' ' GLU . . . . . . . . . . . . . 23.4 tt0 -57.37 -63.79 1.11 Allowed 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.198 -0.939 . . . . 2.29 109.656 -179.941 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 337' ' ' ARG . . . . . 0.54 ' HG3' ' NH1' ' A' ' 337' ' ' ARG . 0.6 OUTLIER -60.03 -27.15 66.68 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.193 -0.942 . . . . 2.93 109.376 -179.93 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 338' ' ' PHE . . . . . 0.875 ' HA ' HG21 ' A' ' 332' ' ' ILE . 83.8 t80 -55.31 -61.61 2.22 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.38 -0.825 . . . . 0.38 109.841 -179.808 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 339' ' ' GLU . . . . . . . . . . . . . 18.0 mt-10 -51.54 -33.62 32.89 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.26 -0.9 . . . . 1.97 110.164 -179.543 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 340' ' ' MET . . . . . . . . . . . . . 38.0 ttp -64.38 -52.7 56.96 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.126 -0.984 . . . . 0.31 110.453 -179.353 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 341' ' ' PHE . . . . . . . . . . . . . 42.5 m-85 -62.1 -46.22 90.02 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.164 -0.96 . . . . 0.18 110.142 -179.284 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 342' ' ' ARG . . . . . 0.451 ' CG ' HH11 ' A' ' 342' ' ' ARG . 0.0 OUTLIER -48.17 -38.51 18.27 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.054 -1.029 . . . . 2.42 109.883 -179.678 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 343' ' ' GLU . . . . . . . . . . . . . 33.3 tt0 -59.76 -51.27 70.5 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.113 -0.992 . . . . 2.35 109.833 -179.757 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 344' ' ' LEU . . . . . 0.652 HD22 HD22 ' B' ' 344' ' ' LEU . 34.9 mt -61.57 -31.39 71.43 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.154 -0.966 . . . . 0.18 109.556 -179.817 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 345' ' ' ASN . . . . . . . . . . . . . 13.2 t-20 -57.82 -60.3 3.91 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.297 -0.877 . . . . 1.09 109.72 -179.868 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 346' ' ' GLU . . . . . . . . . . . . . 26.1 tt0 -61.25 -26.45 67.77 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.295 -0.878 . . . . 1.65 109.916 -179.723 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 347' ' ' ALA . . . . . 0.879 ' HB1' ' HB1' ' B' ' 347' ' ' ALA . . . -61.11 -58.98 6.12 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.196 -0.94 . . . . 0.18 109.966 -179.81 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 348' ' ' LEU . . . . . 0.784 HD12 ' NH2' ' C' ' 337' ' ' ARG . 3.8 mm? -62.22 -42.19 99.08 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.237 -0.914 . . . . 0.3 109.974 -179.541 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 349' ' ' GLU . . . . . . . . . . . . . 31.5 mt-10 -57.67 -37.51 73.54 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.209 -0.932 . . . . 1.94 110.209 -179.287 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 350' ' ' LEU . . . . . 0.699 HD13 HD22 ' B' ' 350' ' ' LEU . 6.0 tt -64.37 -44.38 91.58 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.142 -0.974 . . . . 0.46 109.943 -179.573 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 351' ' ' LYS . . . . . . . . . . . . . 40.1 tttp -57.96 -37.67 74.6 Favored 'General case' 0 N--CA 1.488 1.466 0 O-C-N 121.093 -1.004 . . . . 1.4 109.508 -179.676 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 352' ' ' ASP . . . . . . . . . . . . . 11.3 m-20 -55.34 -41.44 72.51 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.278 -0.889 . . . . 1.16 109.42 179.868 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 353' ' ' ALA . . . . . . . . . . . . . . . -67.81 -30.76 70.26 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.282 -0.886 . . . . 0.63 109.707 -179.866 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 354' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -80.55 1.56 29.08 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.154 -0.966 . . . . 1.47 109.631 -179.948 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 355' ' ' ALA . . . . . . . . . . . . . . . -69.13 -83.74 0.03 OUTLIER 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.24 -0.913 . . . . 1.01 109.334 179.96 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 356' ' ' GLY . . . . . . . . . . . . . . . -62.69 99.48 0.26 Allowed Glycine 0 N--CA 1.49 2.288 0 N-CA-C 109.54 -1.424 . . . . 1.3 109.54 179.996 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 357' ' ' LYS . . . . . . . . . . . . . 16.6 mttt -86.1 150.29 24.53 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.312 -1.11 . . . . 4.1 109.344 179.956 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 358' ' ' GLU . . . . . 0.416 ' HG2' ' HD2' ' A' ' 359' ' ' PRO . 2.8 mt-10 -49.5 161.86 0.47 Allowed Pre-proline 0 N--CA 1.49 1.538 0 O-C-N 121.166 -0.959 . . . . 5.75 109.533 -179.961 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 359' ' ' PRO . . . . . 0.416 ' HD2' ' HG2' ' A' ' 358' ' ' GLU . 3.1 Cg_exo -61.21 -156.1 0.02 OUTLIER 'Trans proline' 0 C--N 1.311 -1.427 0 C-N-CA 122.199 1.932 . . . . 5.0 110.351 -179.918 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 360' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.313 0 CA-C-O 117.992 -1.449 . . . . 6.97 109.545 -179.936 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' B' B ' 319' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.49 1.554 0 CA-C-O 121.277 0.56 . . . . 7.55 109.492 . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 320' ' ' LYS . . . . . 0.473 ' O ' ' HD3' ' B' ' 322' ' ' PRO . 0.7 OUTLIER 64.35 43.37 4.73 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.303 -0.873 . . . . 6.44 109.762 179.934 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' B' B ' 321' ' ' LYS . . . . . . . . . . . . . 33.8 mttt -82.21 114.24 49.63 Favored Pre-proline 0 N--CA 1.492 1.632 0 O-C-N 121.166 -0.958 . . . . 6.13 109.2 179.796 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 322' ' ' PRO . . . . . 0.473 ' HD3' ' O ' ' B' ' 320' ' ' LYS . 2.3 Cg_endo -68.59 -3.6 11.44 Favored 'Trans proline' 0 C--N 1.312 -1.355 0 C-N-CA 121.941 1.761 . . . . 2.82 110.53 -179.853 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 323' ' ' LEU . . . . . 0.466 ' HA ' HD23 ' B' ' 323' ' ' LEU . 42.7 mt -82.2 92.19 6.85 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.141 -0.974 . . . . 2.84 109.523 179.916 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 324' ' ' ASP . . . . . . . . . . . . . 3.6 m-20 -81.86 126.48 31.94 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.295 -0.878 . . . . 1.53 109.367 179.892 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 325' ' ' GLY . . . . . 0.501 ' O ' ' CD2' ' B' ' 327' ' ' TYR . . . -65.78 176.58 15.4 Favored Glycine 0 N--CA 1.489 2.209 0 N-CA-C 109.233 -1.547 . . . . 0.59 109.233 179.801 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 326' ' ' GLU . . . . . . . . . . . . . 20.0 mm-40 -57.16 171.82 0.35 Allowed 'General case' 0 N--CA 1.487 1.421 0 O-C-N 121.101 -1.235 . . . . 2.13 109.138 179.982 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 327' ' ' TYR . . . . . 0.501 ' CD2' ' O ' ' B' ' 325' ' ' GLY . 41.7 m-85 -148.4 109.24 4.24 Favored 'General case' 0 N--CA 1.488 1.471 0 O-C-N 121.24 -0.913 . . . . 0.48 109.345 179.988 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 328' ' ' PHE . . . . . 0.413 ' C ' HG23 ' B' ' 329' ' ' THR . 81.3 m-85 -110.56 -170.23 1.6 Allowed 'General case' 0 N--CA 1.489 1.488 0 O-C-N 121.287 -0.883 . . . . 0.32 109.374 -179.869 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 329' ' ' THR . . . . . 0.413 HG23 ' C ' ' B' ' 328' ' ' PHE . 73.6 p -153.68 162.17 41.48 Favored 'General case' 0 N--CA 1.488 1.443 0 O-C-N 121.254 -0.904 . . . . 0.23 109.312 -179.99 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 330' ' ' LEU . . . . . . . . . . . . . 15.9 tp -149.13 130.18 14.42 Favored 'General case' 0 N--CA 1.488 1.469 0 O-C-N 121.288 -0.883 . . . . 0.28 109.476 -179.869 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 331' ' ' GLN . . . . . . . . . . . . . 2.0 tp60 -86.02 121.52 28.76 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.283 -0.885 . . . . 0.91 109.563 -179.957 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 332' ' ' ILE . . . . . 0.873 HG21 ' HA ' ' B' ' 338' ' ' PHE . 71.7 mt -103.37 103.7 15.53 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.526 0 O-C-N 121.248 -0.907 . . . . 0.24 109.519 179.889 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 333' ' ' ARG . . . . . 0.5 ' HG2' ' CE1' ' D' ' 327' ' ' TYR . 0.3 OUTLIER -72.6 146.22 46.81 Favored 'General case' 0 N--CA 1.489 1.487 0 O-C-N 121.219 -0.925 . . . . 2.93 109.527 179.941 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' B' B ' 334' ' ' GLY . . . . . . . . . . . . . . . 75.78 119.56 0.13 Allowed Glycine 0 N--CA 1.49 2.242 0 N-CA-C 109.63 -1.388 . . . . 0.4 109.63 179.992 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 335' ' ' ARG . . . . . 0.483 ' HG3' ' CZ ' ' D' ' 328' ' ' PHE . 1.8 ttt180 -65.61 -27.39 68.37 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.267 -1.137 . . . . 3.01 109.462 -179.961 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 336' ' ' GLU . . . . . . . . . . . . . 23.5 tt0 -57.38 -63.73 1.13 Allowed 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.264 -0.897 . . . . 2.28 109.615 -179.873 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 337' ' ' ARG . . . . . 0.562 ' NH1' ' HG3' ' B' ' 337' ' ' ARG . 0.5 OUTLIER -59.88 -27.24 66.53 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.237 -0.914 . . . . 2.93 109.417 179.937 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' B' B ' 338' ' ' PHE . . . . . 0.873 ' HA ' HG21 ' B' ' 332' ' ' ILE . 84.4 t80 -55.38 -61.48 2.31 Favored 'General case' 0 N--CA 1.488 1.455 0 O-C-N 121.273 -0.892 . . . . 0.37 109.865 -179.722 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 339' ' ' GLU . . . . . . . . . . . . . 18.0 mt-10 -51.67 -33.48 34.03 Favored 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.176 -0.953 . . . . 1.98 110.171 -179.533 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 340' ' ' MET . . . . . . . . . . . . . 38.1 ttp -64.5 -52.75 56.23 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.08 -1.012 . . . . 0.32 110.388 -179.312 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 341' ' ' PHE . . . . . . . . . . . . . 42.2 m-85 -61.96 -46.42 89.35 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.115 -0.99 . . . . 0.18 110.08 -179.285 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 342' ' ' ARG . . . . . 0.455 ' NH1' ' CG ' ' B' ' 342' ' ' ARG . 0.0 OUTLIER -47.98 -38.83 17.78 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.202 -0.936 . . . . 2.42 109.868 -179.691 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' B' B ' 343' ' ' GLU . . . . . . . . . . . . . 33.1 tt0 -59.45 -51.35 70.26 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.139 -0.976 . . . . 2.35 109.818 -179.731 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 344' ' ' LEU . . . . . 0.652 HD22 HD22 ' A' ' 344' ' ' LEU . 34.3 mt -61.57 -31.5 71.55 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.144 -0.972 . . . . 0.18 109.586 -179.757 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 345' ' ' ASN . . . . . . . . . . . . . 13.1 t-20 -57.86 -60.14 4.16 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.302 -0.874 . . . . 1.09 109.747 -179.849 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 346' ' ' GLU . . . . . . . . . . . . . 26.1 tt0 -61.28 -26.63 67.9 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.34 -0.85 . . . . 1.66 109.745 -179.736 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 347' ' ' ALA . . . . . 0.879 ' HB1' ' HB1' ' A' ' 347' ' ' ALA . . . -60.93 -59.17 5.8 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.125 -0.984 . . . . 0.17 109.934 -179.702 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 348' ' ' LEU . . . . . 0.578 HD22 ' N ' ' B' ' 348' ' ' LEU . 3.8 mm? -62.01 -42.15 98.85 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.212 -0.93 . . . . 0.29 110.042 -179.526 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 349' ' ' GLU . . . . . . . . . . . . . 31.6 mt-10 -57.81 -37.38 73.68 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.145 -0.972 . . . . 1.95 110.246 -179.303 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 350' ' ' LEU . . . . . 0.699 HD22 HD13 ' A' ' 350' ' ' LEU . 6.0 tt -64.45 -44.28 91.59 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.163 -0.96 . . . . 0.45 109.969 -179.565 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 351' ' ' LYS . . . . . . . . . . . . . 40.1 tttp -58.01 -37.73 74.85 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.161 -0.962 . . . . 1.38 109.43 -179.704 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 352' ' ' ASP . . . . . . . . . . . . . 11.4 m-20 -55.3 -41.44 72.34 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.219 -0.926 . . . . 1.16 109.45 179.829 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 353' ' ' ALA . . . . . . . . . . . . . . . -67.78 -30.75 70.27 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.29 -0.881 . . . . 0.61 109.705 -179.891 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 354' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -80.75 1.67 29.39 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.18 -0.95 . . . . 1.45 109.577 -179.863 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 355' ' ' ALA . . . . . . . . . . . . . . . -69.14 -83.69 0.03 OUTLIER 'General case' 0 N--CA 1.489 1.491 0 O-C-N 121.096 -1.003 . . . . 0.98 109.401 179.841 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 356' ' ' GLY . . . . . . . . . . . . . . . -62.6 99.32 0.24 Allowed Glycine 0 N--CA 1.49 2.29 0 N-CA-C 109.584 -1.407 . . . . 1.29 109.584 179.939 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 357' ' ' LYS . . . . . . . . . . . . . 16.7 mttt -86.1 150.24 24.57 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.232 -1.158 . . . . 4.09 109.321 179.976 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 358' ' ' GLU . . . . . 0.415 ' HG2' ' HD2' ' B' ' 359' ' ' PRO . 2.8 mt-10 -49.51 162.09 0.45 Allowed Pre-proline 0 N--CA 1.491 1.587 0 O-C-N 121.202 -0.937 . . . . 5.72 109.546 -179.889 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 359' ' ' PRO . . . . . 0.415 ' HD2' ' HG2' ' B' ' 358' ' ' GLU . 3.2 Cg_exo -61.23 -156.3 0.02 OUTLIER 'Trans proline' 0 C--N 1.31 -1.498 0 C-N-CA 122.236 1.958 . . . . 4.98 110.322 -179.909 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 360' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.229 0 CA-C-O 118.016 -1.436 . . . . 6.98 109.556 179.854 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' C' C ' 319' ' ' LYS . . . . . 0.436 ' O ' ' HB2' ' C' ' 320' ' ' LYS . 0.2 OUTLIER . . . . . 0 N--CA 1.49 1.548 0 N-CA-C 109.48 -0.563 . . . . 6.82 109.48 . . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' C' C ' 320' ' ' LYS . . . . . 0.436 ' HB2' ' O ' ' C' ' 319' ' ' LYS . 0.0 OUTLIER 60.34 150.33 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.286 -0.884 . . . . 6.49 109.628 179.824 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' C' C ' 321' ' ' LYS . . . . . 0.56 ' N ' ' HD3' ' C' ' 322' ' ' PRO . 0.0 OUTLIER -158.02 57.09 1.15 Allowed Pre-proline 0 N--CA 1.489 1.49 0 O-C-N 121.288 -0.882 . . . . 6.4 109.671 179.832 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' C' C ' 322' ' ' PRO . . . . . 0.56 ' HD3' ' N ' ' C' ' 321' ' ' LYS . 2.9 Cg_endo -60.71 -151.47 0.01 OUTLIER 'Trans proline' 0 C--N 1.311 -1.424 0 C-N-CA 122.07 1.846 . . . . 3.42 109.914 179.653 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' C' C ' 323' ' ' LEU . . . . . . . . . . . . . 71.6 mt -78.68 117.03 19.44 Favored 'General case' 0 N--CA 1.488 1.458 0 O-C-N 121.108 -0.995 . . . . 3.95 109.012 179.733 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' C' C ' 324' ' ' ASP . . . . . . . . . . . . . 91.7 m-20 -78.95 142.34 36.78 Favored 'General case' 0 N--CA 1.488 1.47 0 O-C-N 121.276 -0.89 . . . . 1.63 109.664 -179.629 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' C' C ' 325' ' ' GLY . . . . . . . . . . . . . . . -68.1 176.74 25.7 Favored Glycine 0 N--CA 1.489 2.172 0 N-CA-C 109.284 -1.526 . . . . 0.73 109.284 179.872 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' C' C ' 326' ' ' GLU . . . . . . . . . . . . . 9.9 mm-40 -57.32 -177.65 0.03 OUTLIER 'General case' 0 N--CA 1.488 1.47 0 O-C-N 121.129 -1.218 . . . . 2.17 109.241 -179.976 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' C' C ' 327' ' ' TYR . . . . . 0.559 ' CE1' ' HG2' ' A' ' 333' ' ' ARG . 41.1 m-85 -148.95 108.16 3.92 Favored 'General case' 0 N--CA 1.488 1.464 0 O-C-N 121.395 -0.816 . . . . 0.48 109.257 179.906 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' C' C ' 328' ' ' PHE . . . . . 0.551 ' CD1' ' N ' ' C' ' 328' ' ' PHE . 5.0 m-85 -112.95 -168.41 1.32 Allowed 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.374 -0.829 . . . . 0.33 109.251 -179.887 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' C' C ' 329' ' ' THR . . . . . 0.481 ' HA ' ' O ' ' A' ' 330' ' ' LEU . 57.0 p -151.65 174.59 13.29 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.202 -0.936 . . . . 0.23 109.376 -179.926 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' C' C ' 330' ' ' LEU . . . . . . . . . . . . . 14.8 tp -151.28 125.93 9.59 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.186 -0.946 . . . . 0.28 109.695 -179.736 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' C' C ' 331' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -87.91 114.49 24.57 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.246 -0.909 . . . . 1.48 108.999 179.636 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' C' C ' 332' ' ' ILE . . . . . 0.52 HD13 ' CD2' ' C' ' 341' ' ' PHE . 11.2 mt -103.36 112.36 36.55 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.566 0 O-C-N 121.15 -0.969 . . . . 0.24 110.006 -179.73 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' C' C ' 333' ' ' ARG . . . . . 0.606 ' HG2' ' CE2' ' A' ' 327' ' ' TYR . 0.7 OUTLIER -72.6 154.46 40.75 Favored 'General case' 0 N--CA 1.488 1.44 0 O-C-N 121.283 -0.886 . . . . 2.74 109.127 179.443 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' C' C ' 334' ' ' GLY . . . . . . . . . . . . . . . 73.84 128.17 0.14 Allowed Glycine 0 N--CA 1.489 2.223 0 N-CA-C 109.552 -1.419 . . . . 0.35 109.552 179.956 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' C' C ' 335' ' ' ARG . . . . . 0.414 ' HA ' ' CE1' ' A' ' 328' ' ' PHE . 9.0 ttt180 -73.64 -40.0 64.08 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.324 -1.103 . . . . 2.53 109.656 -179.853 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' C' C ' 336' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -56.97 -48.84 77.45 Favored 'General case' 0 N--CA 1.494 1.739 0 O-C-N 121.262 -0.899 . . . . 2.62 109.684 -179.789 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' C' C ' 337' ' ' ARG . . . . . 0.784 ' NH2' HD12 ' A' ' 348' ' ' LEU . 0.0 OUTLIER -62.9 -37.76 88.24 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.139 -0.976 . . . . 2.81 109.502 179.822 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' C' C ' 338' ' ' PHE . . . . . . . . . . . . . 82.2 t80 -55.16 -51.18 67.3 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.35 -0.844 . . . . 0.4 109.861 -179.73 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' C' C ' 339' ' ' GLU . . . . . . . . . . . . . 10.3 mt-10 -52.55 -36.64 56.18 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.113 -0.992 . . . . 2.05 110.38 -179.557 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' C' C ' 340' ' ' MET . . . . . . . . . . . . . 35.5 ttp -63.77 -51.52 64.45 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.073 -1.017 . . . . 0.32 110.402 -179.262 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' C' C ' 341' ' ' PHE . . . . . 0.52 ' CD2' HD13 ' C' ' 332' ' ' ILE . 40.2 m-85 -61.84 -41.24 97.56 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.146 -0.971 . . . . 0.18 110.1 -179.281 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' C' C ' 342' ' ' ARG . . . . . . . . . . . . . 1.4 ttt180 -52.24 -40.97 62.36 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.093 -1.004 . . . . 2.91 109.526 179.934 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' C' C ' 343' ' ' GLU . . . . . . . . . . . . . 25.2 tt0 -58.95 -53.87 53.49 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.25 -0.906 . . . . 2.14 109.59 -179.743 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' C' C ' 344' ' ' LEU . . . . . 0.512 HD22 HD22 ' D' ' 344' ' ' LEU . 30.6 mt -59.87 -26.08 65.58 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.217 -0.927 . . . . 0.22 108.939 179.915 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' C' C ' 345' ' ' ASN . . . . . . . . . . . . . 6.4 t-20 -59.52 -64.09 1.07 Allowed 'General case' 0 N--CA 1.488 1.453 0 O-C-N 121.414 -0.804 . . . . 1.08 109.534 179.823 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' C' C ' 346' ' ' GLU . . . . . . . . . . . . . 9.1 tp10 -62.77 -25.42 68.21 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.396 -0.815 . . . . 2.21 109.972 -179.743 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' C' C ' 347' ' ' ALA . . . . . 0.683 ' HB1' ' HB1' ' D' ' 347' ' ' ALA . . . -60.58 -57.32 13.21 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.185 -0.947 . . . . 0.18 109.862 -179.687 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' C' C ' 348' ' ' LEU . . . . . 0.529 HD22 ' N ' ' C' ' 348' ' ' LEU . 3.6 mm? -62.57 -45.0 94.93 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.184 -0.948 . . . . 0.32 110.045 -179.503 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' C' C ' 349' ' ' GLU . . . . . 0.42 ' O ' ' HB2' ' C' ' 352' ' ' ASP . 97.7 mt-10 -57.37 -34.4 68.79 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.267 -0.895 . . . . 2.19 110.157 -179.312 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' C' C ' 350' ' ' LEU . . . . . 0.814 HD22 HD13 ' D' ' 350' ' ' LEU . 7.9 tt -63.23 -44.55 94.93 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.067 -1.021 . . . . 0.46 109.209 -179.929 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' C' C ' 351' ' ' LYS . . . . . . . . . . . . . 62.9 tttm -60.65 -33.29 72.58 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.323 -0.861 . . . . 1.35 109.576 179.955 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' C' C ' 352' ' ' ASP . . . . . 0.42 ' HB2' ' O ' ' C' ' 349' ' ' GLU . 4.0 m-20 -52.75 -50.76 62.83 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.164 -0.96 . . . . 1.19 109.172 -179.979 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' C' C ' 353' ' ' ALA . . . . . . . . . . . . . . . -68.4 -23.3 64.63 Favored 'General case' 0 N--CA 1.488 1.447 0 O-C-N 121.316 -0.865 . . . . 0.57 108.968 179.564 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' C' C ' 354' ' ' GLN . . . . . . . . . . . . . 7.4 tt0 -83.06 1.83 38.18 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.413 -0.804 . . . . 1.47 109.87 -179.873 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' C' C ' 355' ' ' ALA . . . . . . . . . . . . . . . -67.35 -91.48 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.057 -1.027 . . . . 0.93 109.311 -179.885 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' C' C ' 356' ' ' GLY . . . . . . . . . . . . . . . -61.26 104.12 0.64 Allowed Glycine 0 N--CA 1.489 2.209 0 N-CA-C 109.288 -1.525 . . . . 1.33 109.288 179.83 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' C' C ' 357' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -86.16 101.95 13.46 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.175 -1.191 . . . . 4.01 109.562 -179.86 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' C' C ' 358' ' ' GLU . . . . . . . . . . . . . 4.6 mm-40 -49.91 119.64 10.36 Favored Pre-proline 0 N--CA 1.49 1.526 0 O-C-N 121.35 -0.843 . . . . 5.75 109.495 -179.993 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' C' C ' 359' ' ' PRO . . . . . . . . . . . . . 4.1 Cg_exo -59.8 -153.58 0.01 OUTLIER 'Trans proline' 0 C--N 1.313 -1.305 0 C-N-CA 121.928 1.752 . . . . 4.94 110.079 179.939 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' C' C ' 360' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.29 0 N-CA-C 109.525 -1.43 . . . . 6.5 109.525 179.991 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' D' D ' 319' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.49 1.531 0 N-CA-C 109.492 -0.558 . . . . 7.53 109.492 . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' D' D ' 320' ' ' LYS . . . . . 0.48 ' O ' ' HD3' ' D' ' 322' ' ' PRO . 0.7 OUTLIER 64.57 43.19 4.5 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.367 -0.833 . . . . 6.41 109.692 179.827 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' D' D ' 321' ' ' LYS . . . . . . . . . . . . . 33.8 mttt -82.02 114.18 48.75 Favored Pre-proline 0 N--CA 1.49 1.56 0 O-C-N 121.264 -0.898 . . . . 6.11 109.282 179.739 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' D' D ' 322' ' ' PRO . . . . . 0.48 ' HD3' ' O ' ' D' ' 320' ' ' LYS . 2.3 Cg_endo -68.53 -3.61 11.42 Favored 'Trans proline' 0 C--N 1.313 -1.324 0 C-N-CA 121.903 1.735 . . . . 2.82 110.524 -179.865 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' D' D ' 323' ' ' LEU . . . . . 0.446 HD23 ' HA ' ' D' ' 323' ' ' LEU . 42.7 mt -82.13 92.03 6.78 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.119 -0.988 . . . . 2.83 109.432 179.939 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' D' D ' 324' ' ' ASP . . . . . . . . . . . . . 3.6 m-20 -81.67 127.36 32.83 Favored 'General case' 0 N--CA 1.489 1.489 0 O-C-N 121.211 -0.93 . . . . 1.54 109.195 179.818 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' D' D ' 325' ' ' GLY . . . . . 0.501 ' O ' ' CD2' ' D' ' 327' ' ' TYR . . . -67.04 176.79 21.3 Favored Glycine 0 N--CA 1.489 2.207 0 N-CA-C 109.167 -1.573 . . . . 0.59 109.167 179.908 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' D' D ' 326' ' ' GLU . . . . . . . . . . . . . 20.0 mm-40 -57.06 171.63 0.35 Allowed 'General case' 0 N--CA 1.487 1.418 0 O-C-N 121.159 -1.201 . . . . 2.13 109.229 -179.904 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' D' D ' 327' ' ' TYR . . . . . 0.501 ' CD2' ' O ' ' D' ' 325' ' ' GLY . 42.1 m-85 -148.23 109.28 4.28 Favored 'General case' 0 C--N 1.303 -1.453 0 O-C-N 121.339 -0.85 . . . . 0.47 109.368 -179.998 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' D' D ' 328' ' ' PHE . . . . . 0.483 ' CZ ' ' HG3' ' B' ' 335' ' ' ARG . 81.6 m-85 -110.59 -170.11 1.58 Allowed 'General case' 0 N--CA 1.489 1.487 0 O-C-N 121.346 -0.846 . . . . 0.3 109.319 -179.867 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' D' D ' 329' ' ' THR . . . . . 0.42 HG23 ' C ' ' D' ' 328' ' ' PHE . 73.4 p -153.8 162.14 41.49 Favored 'General case' 0 N--CA 1.488 1.449 0 O-C-N 121.222 -0.924 . . . . 0.22 109.271 -179.963 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' D' D ' 330' ' ' LEU . . . . . . . . . . . . . 16.0 tp -149.05 130.24 14.55 Favored 'General case' 0 N--CA 1.489 1.491 0 O-C-N 121.295 -0.878 . . . . 0.28 109.43 -179.753 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' D' D ' 331' ' ' GLN . . . . . . . . . . . . . 2.0 tp60 -86.24 121.6 29.06 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.251 -0.906 . . . . 0.93 109.474 -179.92 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' D' D ' 332' ' ' ILE . . . . . 0.848 HG21 ' HA ' ' D' ' 338' ' ' PHE . 71.9 mt -103.5 103.54 15.31 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.537 0 O-C-N 121.263 -0.898 . . . . 0.25 109.461 179.969 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' D' D ' 333' ' ' ARG . . . . . 0.466 ' HG2' ' CE1' ' B' ' 327' ' ' TYR . 0.3 OUTLIER -72.5 146.35 46.9 Favored 'General case' 0 N--CA 1.489 1.495 0 O-C-N 121.241 -0.912 . . . . 2.93 109.407 179.976 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' D' D ' 334' ' ' GLY . . . . . . . . . . . . . . . 75.76 119.39 0.13 Allowed Glycine 0 N--CA 1.491 2.364 0 N-CA-C 109.574 -1.411 . . . . 0.41 109.574 179.921 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' D' D ' 335' ' ' ARG . . . . . 0.449 ' O ' ' HB3' ' D' ' 338' ' ' PHE . 1.8 ttt180 -65.49 -27.49 68.52 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.245 -1.15 . . . . 3.03 109.513 179.911 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' D' D ' 336' ' ' GLU . . . . . . . . . . . . . 23.2 tt0 -57.24 -63.75 1.12 Allowed 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.209 -0.932 . . . . 2.26 109.643 -179.897 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' D' D ' 337' ' ' ARG . . . . . 0.561 ' NH1' ' HG3' ' D' ' 337' ' ' ARG . 0.6 OUTLIER -60.04 -27.16 66.7 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.225 -0.922 . . . . 2.92 109.374 179.999 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' D' D ' 338' ' ' PHE . . . . . 0.848 ' HA ' HG21 ' D' ' 332' ' ' ILE . 83.8 t80 -55.39 -61.6 2.23 Favored 'General case' 0 N--CA 1.488 1.474 0 O-C-N 121.351 -0.843 . . . . 0.37 109.893 -179.8 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' D' D ' 339' ' ' GLU . . . . . . . . . . . . . 17.8 mt-10 -51.5 -33.72 32.8 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.173 -0.955 . . . . 1.99 110.131 -179.551 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' D' D ' 340' ' ' MET . . . . . . . . . . . . . 37.9 ttp -64.24 -52.85 56.75 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.143 -0.973 . . . . 0.31 110.382 -179.336 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' D' D ' 341' ' ' PHE . . . . . . . . . . . . . 42.5 m-85 -62.01 -46.16 90.44 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.223 -0.923 . . . . 0.18 110.147 -179.228 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' D' D ' 342' ' ' ARG . . . . . 0.455 ' CG ' HH11 ' D' ' 342' ' ' ARG . 0.0 OUTLIER -48.28 -38.63 19.26 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.113 -0.992 . . . . 2.41 109.869 -179.676 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' D' D ' 343' ' ' GLU . . . . . . . . . . . . . 33.1 tt0 -59.7 -51.32 70.27 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.121 -0.987 . . . . 2.35 109.779 -179.705 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' D' D ' 344' ' ' LEU . . . . . 0.512 HD22 HD22 ' C' ' 344' ' ' LEU . 34.1 mt -61.45 -31.35 71.3 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.176 -0.953 . . . . 0.19 109.667 -179.911 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' D' D ' 345' ' ' ASN . . . . . . . . . . . . . 13.0 t-20 -57.91 -60.21 4.06 Favored 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.297 -0.877 . . . . 1.09 109.758 -179.907 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' D' D ' 346' ' ' GLU . . . . . . . . . . . . . 25.9 tt0 -61.19 -26.76 67.94 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.279 -0.888 . . . . 1.69 109.782 -179.741 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' D' D ' 347' ' ' ALA . . . . . 0.683 ' HB1' ' HB1' ' C' ' 347' ' ' ALA . . . -60.83 -59.1 5.91 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.127 -0.983 . . . . 0.18 110.016 -179.743 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' D' D ' 348' ' ' LEU . . . . . 0.586 HD22 ' N ' ' D' ' 348' ' ' LEU . 3.8 mm? -62.17 -42.04 98.89 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.166 -0.959 . . . . 0.31 110.016 -179.533 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' D' D ' 349' ' ' GLU . . . . . . . . . . . . . 30.9 mt-10 -57.89 -37.31 73.76 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.195 -0.941 . . . . 1.95 110.182 -179.249 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' D' D ' 350' ' ' LEU . . . . . 0.814 HD13 HD22 ' C' ' 350' ' ' LEU . 6.0 tt -64.58 -44.28 91.19 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.106 -0.996 . . . . 0.43 109.904 -179.563 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' D' D ' 351' ' ' LYS . . . . . . . . . . . . . 40.1 tttp -57.95 -37.82 74.85 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.208 -0.932 . . . . 1.4 109.501 -179.746 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' D' D ' 352' ' ' ASP . . . . . . . . . . . . . 11.6 m-20 -55.22 -41.5 72.14 Favored 'General case' 0 N--CA 1.489 1.49 0 O-C-N 121.22 -0.925 . . . . 1.17 109.433 179.834 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' D' D ' 353' ' ' ALA . . . . . . . . . . . . . . . -67.89 -30.71 70.12 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.316 -0.865 . . . . 0.59 109.692 -179.837 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' D' D ' 354' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -80.67 1.7 28.96 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.112 -0.993 . . . . 1.44 109.59 -179.94 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' D' D ' 355' ' ' ALA . . . . . . . . . . . . . . . -69.14 -83.58 0.03 OUTLIER 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.173 -0.954 . . . . 0.98 109.354 179.873 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' D' D ' 356' ' ' GLY . . . . . . . . . . . . . . . -62.72 99.45 0.26 Allowed Glycine 0 N--CA 1.489 2.204 0 N-CA-C 109.577 -1.409 . . . . 1.28 109.577 179.979 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' D' D ' 357' ' ' LYS . . . . . . . . . . . . . 16.7 mttt -86.25 150.21 24.53 Favored 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.282 -1.128 . . . . 4.09 109.381 179.929 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' D' D ' 358' ' ' GLU . . . . . 0.412 ' HG2' ' HD2' ' D' ' 359' ' ' PRO . 2.8 mt-10 -49.5 161.97 0.46 Allowed Pre-proline 0 N--CA 1.49 1.556 0 O-C-N 121.266 -0.896 . . . . 5.71 109.56 -179.882 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' D' D ' 359' ' ' PRO . . . . . 0.412 ' HD2' ' HG2' ' D' ' 358' ' ' GLU . 3.1 Cg_exo -61.19 -156.21 0.02 OUTLIER 'Trans proline' 0 C--N 1.31 -1.457 0 C-N-CA 122.168 1.912 . . . . 4.97 110.388 -179.985 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' D' D ' 360' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.264 0 CA-C-O 117.958 -1.468 . . . . 6.97 109.502 -179.942 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 319' ' ' LYS . . . . . 0.441 ' O ' ' N ' ' A' ' 321' ' ' LYS . 0.0 OUTLIER . . . . . 0 N--CA 1.488 1.472 0 N-CA-C 109.017 -0.735 . . . . 7.55 109.017 . . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 320' ' ' LYS . . . . . 0.401 ' CG ' ' N ' ' A' ' 321' ' ' LYS . 2.8 tptt 55.51 -92.63 0.03 OUTLIER 'General case' 0 N--CA 1.488 1.474 0 O-C-N 121.031 -1.043 . . . . 6.43 109.17 179.99 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 321' ' ' LYS . . . . . 0.441 ' N ' ' O ' ' A' ' 319' ' ' LYS . 0.2 OUTLIER -159.02 82.45 2.55 Favored Pre-proline 0 N--CA 1.491 1.596 0 O-C-N 121.349 -0.844 . . . . 6.13 109.642 179.64 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 322' ' ' PRO . . . . . . . . . . . . . 1.9 Cg_endo -66.9 -4.33 11.13 Favored 'Trans proline' 0 C--N 1.309 -1.543 0 C-N-CA 122.481 2.121 . . . . 2.83 110.597 179.863 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 323' ' ' LEU . . . . . 0.471 ' HA ' HD23 ' A' ' 323' ' ' LEU . 47.1 mt -84.95 59.74 5.8 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.329 -0.857 . . . . 2.83 109.671 179.985 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 324' ' ' ASP . . . . . 0.426 ' OD1' ' N ' ' A' ' 324' ' ' ASP . 2.9 m-20 -81.23 -142.16 0.04 OUTLIER 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.217 -0.927 . . . . 1.53 109.52 -179.715 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 325' ' ' GLY . . . . . . . . . . . . . . . -66.88 -172.86 5.43 Favored Glycine 0 N--CA 1.49 2.296 0 N-CA-C 109.39 -1.484 . . . . 0.61 109.39 -179.936 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 326' ' ' GLU . . . . . 0.443 ' HB2' ' CE1' ' A' ' 328' ' ' PHE . 30.6 mm-40 -60.74 178.99 0.19 Allowed 'General case' 0 N--CA 1.489 1.489 0 O-C-N 121.404 -1.057 . . . . 2.13 109.779 -179.769 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 327' ' ' TYR . . . . . 0.632 ' CE2' ' CG ' ' C' ' 333' ' ' ARG . 44.2 m-85 -148.87 107.16 3.75 Favored 'General case' 0 N--CA 1.489 1.485 0 O-C-N 121.326 -0.859 . . . . 0.48 109.523 -179.967 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 328' ' ' PHE . . . . . 0.443 ' CE1' ' HB2' ' A' ' 326' ' ' GLU . 5.5 m-85 -112.93 -166.17 1.06 Allowed 'General case' 0 N--CA 1.488 1.45 0 O-C-N 121.533 -0.729 . . . . 0.31 109.081 -179.891 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 329' ' ' THR . . . . . 0.444 ' HA ' ' O ' ' C' ' 330' ' ' LEU . 36.5 p -155.32 178.5 10.15 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.109 -0.995 . . . . 0.22 109.552 179.768 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 330' ' ' LEU . . . . . 0.465 ' O ' ' HA ' ' C' ' 329' ' ' THR . 67.8 tp -151.98 130.15 11.94 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.241 -0.912 . . . . 0.28 109.024 179.937 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 331' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -87.54 109.2 19.45 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.365 -0.834 . . . . 0.91 109.688 -179.724 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 332' ' ' ILE . . . . . 0.522 HG21 ' HA ' ' A' ' 338' ' ' PHE . 52.7 mt -102.25 110.7 29.69 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.521 0 O-C-N 120.941 -1.099 . . . . 0.26 109.577 179.794 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 333' ' ' ARG . . . . . 0.533 ' HG2' ' CE1' ' C' ' 327' ' ' TYR . 0.0 OUTLIER -73.33 142.74 47.09 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.461 -0.774 . . . . 2.92 109.632 179.523 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 334' ' ' GLY . . . . . . . . . . . . . . . 82.64 132.78 1.8 Allowed Glycine 0 N--CA 1.488 2.106 0 N-CA-C 109.653 -1.379 . . . . 0.4 109.653 179.815 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 335' ' ' ARG . . . . . . . . . . . . . 10.2 ttp180 -79.95 -26.14 40.17 Favored 'General case' 0 C--N 1.302 -1.493 0 O-C-N 121.416 -1.049 . . . . 3.01 109.002 179.696 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 336' ' ' GLU . . . . . . . . . . . . . 2.2 tt0 -58.2 -68.77 0.22 Allowed 'General case' 0 N--CA 1.488 1.467 0 O-C-N 121.14 -0.975 . . . . 2.29 109.649 -179.732 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 337' ' ' ARG . . . . . . . . . . . . . 2.8 mmt180 -60.17 -27.45 67.12 Favored 'General case' 0 N--CA 1.489 1.481 0 O-C-N 121.115 -0.991 . . . . 2.93 109.421 179.752 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 338' ' ' PHE . . . . . 0.522 ' HA ' HG21 ' A' ' 332' ' ' ILE . 47.1 t80 -54.79 -58.72 6.45 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.254 -0.904 . . . . 0.38 109.604 179.914 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 339' ' ' GLU . . . . . . . . . . . . . 11.4 mt-10 -53.42 -31.82 46.93 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.176 -0.953 . . . . 1.97 109.996 -179.675 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 340' ' ' MET . . . . . . . . . . . . . 9.4 ttp -64.19 -50.64 67.32 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.249 -0.907 . . . . 0.31 109.953 -179.781 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 341' ' ' PHE . . . . . . . . . . . . . 48.2 m-85 -63.58 -50.38 69.68 Favored 'General case' 0 C--N 1.3 -1.57 0 O-C-N 121.246 -0.909 . . . . 0.18 110.001 -179.327 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 342' ' ' ARG . . . . . . . . . . . . . 71.5 ttt180 -48.87 -40.39 29.5 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.142 -0.974 . . . . 2.42 110.041 -179.373 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 343' ' ' GLU . . . . . . . . . . . . . 3.2 tt0 -61.57 -43.68 98.41 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.121 -0.987 . . . . 2.35 110.038 -179.441 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 344' ' ' LEU . . . . . 0.995 HD22 HD22 ' B' ' 344' ' ' LEU . 45.9 mt -63.4 -41.69 98.74 Favored 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.084 -1.01 . . . . 0.18 109.587 179.985 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 345' ' ' ASN . . . . . 0.494 HD22 HD11 ' C' ' 330' ' ' LEU . 46.4 t30 -56.45 -49.19 75.31 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.149 -0.969 . . . . 1.09 109.932 -179.746 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 346' ' ' GLU . . . . . . . . . . . . . 11.5 tt0 -61.27 -30.16 70.3 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.177 -0.952 . . . . 1.65 109.686 -179.702 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 347' ' ' ALA . . . . . 1.023 ' HB1' ' HB1' ' B' ' 347' ' ' ALA . . . -63.28 -49.21 74.96 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.333 -0.854 . . . . 0.18 109.745 -179.983 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 348' ' ' LEU . . . . . 0.584 HD22 ' N ' ' A' ' 348' ' ' LEU . 4.3 mm? -62.66 -51.44 67.23 Favored 'General case' 0 N--CA 1.494 1.754 0 O-C-N 121.444 -0.785 . . . . 0.3 109.833 -179.789 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 349' ' ' GLU . . . . . . . . . . . . . 26.2 mt-10 -58.09 -30.83 66.55 Favored 'General case' 0 N--CA 1.488 1.446 0 O-C-N 121.352 -0.842 . . . . 1.94 109.738 -179.406 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 350' ' ' LEU . . . . . 0.845 ' O ' HD23 ' A' ' 350' ' ' LEU . 4.1 tt -63.93 -41.62 97.58 Favored 'General case' 0 C--N 1.304 -1.393 0 O-C-N 121.271 -0.893 . . . . 0.46 109.064 179.972 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 351' ' ' LYS . . . . . . . . . . . . . 15.8 tttt -60.41 -41.8 94.66 Favored 'General case' 0 N--CA 1.486 1.37 0 O-C-N 121.336 -0.853 . . . . 1.4 109.5 -179.863 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 352' ' ' ASP . . . . . . . . . . . . . 94.9 m-20 -55.71 -39.45 71.08 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.083 -1.01 . . . . 1.16 109.951 -179.8 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 353' ' ' ALA . . . . . . . . . . . . . . . -66.05 -40.13 90.7 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.079 -1.013 . . . . 0.63 109.815 -179.669 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 354' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -80.32 -7.31 59.0 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.127 -0.983 . . . . 1.47 109.573 -179.722 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 355' ' ' ALA . . . . . . . . . . . . . . . -70.92 -83.8 0.03 OUTLIER 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.032 -1.043 . . . . 1.01 109.822 -179.969 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 356' ' ' GLY . . . . . . . . . . . . . . . -71.05 89.96 0.41 Allowed Glycine 0 N--CA 1.49 2.283 0 N-CA-C 109.94 -1.264 . . . . 1.3 109.94 -179.779 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 357' ' ' LYS . . . . . . . . . . . . . 2.7 mttt -89.26 41.08 1.02 Allowed 'General case' 0 N--CA 1.487 1.38 0 O-C-N 121.403 -1.057 . . . . 4.1 109.11 179.601 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 358' ' ' GLU . . . . . . . . . . . . . 65.6 tt0 -47.91 108.43 0.91 Allowed Pre-proline 0 N--CA 1.49 1.567 0 O-C-N 121.167 -0.958 . . . . 5.75 109.562 -179.927 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 359' ' ' PRO . . . . . . . . . . . . . 2.7 Cg_endo -62.31 113.79 2.07 Favored 'Trans proline' 0 C--N 1.313 -1.318 0 C-N-CA 121.879 1.719 . . . . 5.0 109.74 179.634 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 360' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.488 2.165 0 CA-C-O 118.016 -1.436 . . . . 6.97 109.737 -179.928 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' B' B ' 319' ' ' LYS . . . . . 0.413 ' O ' ' HD3' ' B' ' 322' ' ' PRO . 0.0 OUTLIER . . . . . 0 N--CA 1.491 1.615 0 N-CA-C 109.45 -0.574 . . . . 7.55 109.45 . . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 320' ' ' LYS . . . . . . . . . . . . . 1.9 tptt 56.07 -93.23 0.04 OUTLIER 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.326 -0.859 . . . . 6.44 109.345 179.783 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 321' ' ' LYS . . . . . 0.404 ' N ' ' O ' ' B' ' 319' ' ' LYS . 0.1 OUTLIER -159.15 81.11 2.64 Favored Pre-proline 0 N--CA 1.494 1.729 0 O-C-N 121.169 -0.957 . . . . 6.13 109.783 179.689 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' B' B ' 322' ' ' PRO . . . . . 0.413 ' HD3' ' O ' ' B' ' 319' ' ' LYS . 2.0 Cg_endo -63.92 -4.07 6.82 Favored 'Trans proline' 0 C--N 1.313 -1.299 0 C-N-CA 122.428 2.085 . . . . 2.82 110.96 179.834 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 323' ' ' LEU . . . . . 0.452 ' HA ' HD23 ' B' ' 323' ' ' LEU . 55.5 mt -84.69 61.66 6.88 Favored 'General case' 0 N--CA 1.489 1.525 0 O-C-N 121.067 -1.021 . . . . 2.84 109.835 -179.733 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 324' ' ' ASP . . . . . 0.424 ' N ' ' OD1' ' B' ' 324' ' ' ASP . 2.5 m-20 -82.03 -144.65 0.06 Allowed 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.261 -0.9 . . . . 1.53 109.352 179.792 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 325' ' ' GLY . . . . . 0.402 ' O ' ' CE1' ' B' ' 327' ' ' TYR . . . -65.35 -175.98 5.56 Favored Glycine 0 N--CA 1.487 2.053 0 N-CA-C 109.252 -1.539 . . . . 0.59 109.252 179.791 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 326' ' ' GLU . . . . . 0.429 ' HB2' ' CE1' ' B' ' 328' ' ' PHE . 26.2 mm-40 -59.02 178.12 0.13 Allowed 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.179 -1.189 . . . . 2.13 109.846 -179.809 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 327' ' ' TYR . . . . . 0.518 ' CE2' ' HG2' ' D' ' 333' ' ' ARG . 42.0 m-85 -147.38 108.04 4.14 Favored 'General case' 0 N--CA 1.488 1.457 0 O-C-N 121.149 -0.969 . . . . 0.48 109.699 -179.934 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 328' ' ' PHE . . . . . 0.433 ' O ' HG23 ' B' ' 329' ' ' THR . 4.9 m-85 -113.04 -166.46 1.08 Allowed 'General case' 0 N--CA 1.488 1.438 0 O-C-N 121.441 -0.787 . . . . 0.32 109.486 179.772 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 329' ' ' THR . . . . . 0.459 ' HA ' ' O ' ' D' ' 330' ' ' LEU . 28.8 p -155.27 178.66 9.97 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.003 -1.061 . . . . 0.23 109.847 179.917 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 330' ' ' LEU . . . . . 0.458 HD21 ' HB2' ' D' ' 345' ' ' ASN . 62.9 tp -151.24 129.98 12.36 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.557 -0.714 . . . . 0.28 109.396 179.823 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 331' ' ' GLN . . . . . 0.415 ' HA ' HG22 ' D' ' 329' ' ' THR . 0.3 OUTLIER -88.45 110.81 21.14 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.126 -0.984 . . . . 0.91 109.557 -179.75 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' B' B ' 332' ' ' ILE . . . . . 0.579 HG21 ' HA ' ' B' ' 338' ' ' PHE . 50.7 mt -103.68 109.27 26.61 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.759 0 O-C-N 121.257 -0.902 . . . . 0.24 110.075 -179.516 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 333' ' ' ARG . . . . . 0.5 ' HG2' ' CE2' ' D' ' 327' ' ' TYR . 0.0 OUTLIER -72.1 142.72 49.17 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.086 -1.009 . . . . 2.93 109.349 179.798 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' B' B ' 334' ' ' GLY . . . . . . . . . . . . . . . 82.12 132.63 1.61 Allowed Glycine 0 N--CA 1.489 2.224 0 N-CA-C 109.814 -1.314 . . . . 0.4 109.814 179.68 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 335' ' ' ARG . . . . . . . . . . . . . 11.3 ttp180 -78.95 -26.71 43.55 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.488 -1.007 . . . . 3.01 109.437 179.77 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 336' ' ' GLU . . . . . . . . . . . . . 2.5 tt0 -58.04 -69.16 0.19 Allowed 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.191 -0.943 . . . . 2.28 109.578 179.864 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 337' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -59.86 -28.0 67.14 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.273 -0.892 . . . . 2.93 109.336 -179.898 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 338' ' ' PHE . . . . . 0.579 ' HA ' HG21 ' B' ' 332' ' ' ILE . 49.7 t80 -55.15 -59.58 4.57 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.214 -0.929 . . . . 0.37 109.534 179.775 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 339' ' ' GLU . . . . . . . . . . . . . 9.4 mt-10 -53.13 -33.08 50.78 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.199 -0.938 . . . . 1.98 109.748 -179.873 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 340' ' ' MET . . . . . . . . . . . . . 9.7 ttp -62.95 -51.33 67.33 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 120.955 -1.091 . . . . 0.32 109.808 -179.637 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 341' ' ' PHE . . . . . . . . . . . . . 48.7 m-85 -62.6 -48.78 77.94 Favored 'General case' 0 N--CA 1.488 1.465 0 O-C-N 121.171 -0.956 . . . . 0.18 109.968 -179.606 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 342' ' ' ARG . . . . . . . . . . . . . 70.7 ttt180 -48.62 -44.11 36.97 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.066 -1.021 . . . . 2.42 109.834 -179.791 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 343' ' ' GLU . . . . . . . . . . . . . 3.1 tt0 -58.05 -44.14 87.27 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.321 -0.862 . . . . 2.35 110.086 -179.309 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 344' ' ' LEU . . . . . 0.995 HD22 HD22 ' A' ' 344' ' ' LEU . 58.8 mt -63.85 -40.85 97.55 Favored 'General case' 0 N--CA 1.494 1.74 0 O-C-N 121.186 -0.946 . . . . 0.18 109.746 -179.982 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 345' ' ' ASN . . . . . 0.426 ' HA ' ' CZ ' ' D' ' 341' ' ' PHE . 48.6 t30 -57.02 -50.21 73.43 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.354 -0.841 . . . . 1.09 109.753 -179.852 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 346' ' ' GLU . . . . . . . . . . . . . 12.4 tt0 -61.58 -30.37 70.63 Favored 'General case' 0 N--CA 1.488 1.447 0 O-C-N 121.04 -1.038 . . . . 1.66 109.552 -179.876 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 347' ' ' ALA . . . . . 1.023 ' HB1' ' HB1' ' A' ' 347' ' ' ALA . . . -62.46 -48.85 77.8 Favored 'General case' 0 N--CA 1.493 1.692 0 O-C-N 121.2 -0.938 . . . . 0.17 110.038 -179.836 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 348' ' ' LEU . . . . . 0.577 HD22 ' N ' ' B' ' 348' ' ' LEU . 4.2 mm? -64.07 -50.87 66.65 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 120.996 -1.065 . . . . 0.29 109.584 -179.859 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 349' ' ' GLU . . . . . . . . . . . . . 29.3 mt-10 -56.5 -31.63 64.26 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.401 -0.812 . . . . 1.95 110.055 -179.321 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 350' ' ' LEU . . . . . 0.829 ' O ' HD23 ' B' ' 350' ' ' LEU . 3.6 tt -63.88 -40.56 96.83 Favored 'General case' 0 N--CA 1.489 1.493 0 O-C-N 121.352 -0.842 . . . . 0.45 109.321 -179.934 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 351' ' ' LYS . . . . . . . . . . . . . 15.9 tttt -60.68 -41.99 96.19 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.199 -0.938 . . . . 1.38 109.452 179.949 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 352' ' ' ASP . . . . . . . . . . . . . 94.6 m-20 -56.0 -40.22 73.04 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.311 -0.868 . . . . 1.16 109.883 -179.723 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 353' ' ' ALA . . . . . . . . . . . . . . . -66.22 -40.34 90.22 Favored 'General case' 0 N--CA 1.494 1.74 0 O-C-N 121.073 -1.017 . . . . 0.61 109.572 -179.644 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 354' ' ' GLN . . . . . 0.502 ' NE2' HD11 ' A' ' 350' ' ' LEU . 0.5 OUTLIER -80.5 -5.66 56.99 Favored 'General case' 0 C--N 1.302 -1.471 0 O-C-N 121.323 -0.861 . . . . 1.45 109.817 -179.588 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' B' B ' 355' ' ' ALA . . . . . . . . . . . . . . . -73.08 -84.39 0.04 OUTLIER 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.096 -1.003 . . . . 0.98 110.04 179.927 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 356' ' ' GLY . . . . . . . . . . . . . . . -70.46 88.64 0.34 Allowed Glycine 0 N--CA 1.491 2.331 0 N-CA-C 110.231 -1.148 . . . . 1.29 110.231 -179.566 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 357' ' ' LYS . . . . . . . . . . . . . 3.7 mttt -88.42 38.87 0.88 Allowed 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.279 -1.13 . . . . 4.09 109.424 179.13 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 358' ' ' GLU . . . . . . . . . . . . . 59.3 tt0 -46.47 108.89 0.9 Allowed Pre-proline 0 N--CA 1.492 1.66 0 O-C-N 121.105 -0.997 . . . . 5.72 109.82 179.93 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 359' ' ' PRO . . . . . . . . . . . . . 1.8 Cg_endo -62.38 114.67 2.46 Favored 'Trans proline' 0 C--N 1.312 -1.385 0 C-N-CA 121.913 1.742 . . . . 4.98 109.783 -179.985 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 360' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.488 2.135 0 CA-C-O 117.87 -1.517 . . . . 6.98 109.578 -179.647 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' C' C ' 319' ' ' LYS . . . . . 0.423 ' O ' ' CB ' ' C' ' 320' ' ' LYS . 4.1 mmtm . . . . . 0 N--CA 1.489 1.509 0 N-CA-C 109.119 -0.697 . . . . 6.82 109.119 . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' C' C ' 320' ' ' LYS . . . . . 0.423 ' CB ' ' O ' ' C' ' 319' ' ' LYS . 0.0 OUTLIER 69.8 6.84 5.93 Favored 'General case' 0 N--CA 1.488 1.445 0 O-C-N 121.383 -0.823 . . . . 6.49 109.418 -179.71 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' C' C ' 321' ' ' LYS . . . . . 0.593 ' CB ' ' HD3' ' C' ' 322' ' ' PRO . 0.7 OUTLIER -81.94 -58.42 0.47 Allowed Pre-proline 0 N--CA 1.493 1.691 0 O-C-N 121.187 -0.946 . . . . 6.4 110.052 -179.955 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' C' C ' 322' ' ' PRO . . . . . 0.593 ' HD3' ' CB ' ' C' ' 321' ' ' LYS . 1.8 Cg_endo -64.14 138.79 63.46 Favored 'Trans proline' 0 C--N 1.315 -1.205 0 C-N-CA 121.809 1.673 . . . . 3.42 109.971 -179.96 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' C' C ' 323' ' ' LEU . . . . . . . . . . . . . 14.1 mt -82.18 -159.86 0.33 Allowed 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.153 -0.967 . . . . 3.95 109.208 179.72 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' C' C ' 324' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -81.83 126.7 32.18 Favored 'General case' 0 C--N 1.304 -1.4 0 O-C-N 120.958 -1.089 . . . . 1.63 108.955 179.872 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' C' C ' 325' ' ' GLY . . . . . 0.459 ' O ' ' CE2' ' C' ' 327' ' ' TYR . . . -68.92 179.61 22.96 Favored Glycine 0 N--CA 1.492 2.394 0 N-CA-C 109.666 -1.374 . . . . 0.73 109.666 -179.394 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' C' C ' 326' ' ' GLU . . . . . . . . . . . . . 69.0 mm-40 -58.88 174.08 0.38 Allowed 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.199 -1.177 . . . . 2.17 109.098 179.728 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' C' C ' 327' ' ' TYR . . . . . 0.533 ' CE1' ' HG2' ' A' ' 333' ' ' ARG . 47.9 m-85 -151.76 90.61 1.56 Allowed 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.005 -1.06 . . . . 0.48 109.961 -179.514 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' C' C ' 328' ' ' PHE . . . . . 0.489 ' O ' ' CG2' ' C' ' 329' ' ' THR . 37.4 m-85 -99.34 -159.57 0.75 Allowed 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.171 -0.955 . . . . 0.33 109.361 179.588 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' C' C ' 329' ' ' THR . . . . . 0.489 ' CG2' ' O ' ' C' ' 328' ' ' PHE . 75.7 p -157.55 -177.96 6.98 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.452 -0.78 . . . . 0.23 109.481 -179.948 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' C' C ' 330' ' ' LEU . . . . . 0.494 HD11 HD22 ' A' ' 345' ' ' ASN . 38.6 tp -154.45 127.61 8.37 Favored 'General case' 0 C--N 1.302 -1.492 0 O-C-N 121.32 -0.862 . . . . 0.28 109.798 -179.705 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' C' C ' 331' ' ' GLN . . . . . . . . . . . . . 37.5 tp60 -84.68 107.21 16.76 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.163 -0.961 . . . . 1.48 109.625 179.776 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' C' C ' 332' ' ' ILE . . . . . 0.519 HG21 ' HA ' ' C' ' 338' ' ' PHE . 61.1 mt -104.63 107.88 23.52 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.56 0 O-C-N 121.148 -0.97 . . . . 0.24 109.8 -179.831 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' C' C ' 333' ' ' ARG . . . . . 0.632 ' CG ' ' CE2' ' A' ' 327' ' ' TYR . 6.8 mpt_? -74.14 139.52 44.57 Favored 'General case' 0 N--CA 1.488 1.43 0 O-C-N 121.454 -0.779 . . . . 2.74 109.757 179.969 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' C' C ' 334' ' ' GLY . . . . . . . . . . . . . . . 87.92 129.98 3.21 Favored Glycine 0 N--CA 1.494 2.528 0 N-CA-C 109.985 -1.246 . . . . 0.35 109.985 179.506 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' C' C ' 335' ' ' ARG . . . . . 0.469 ' NH2' ' OE1' ' C' ' 339' ' ' GLU . 2.9 ttp180 -79.87 -28.76 39.91 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.522 -0.987 . . . . 2.53 110.002 -179.95 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' C' C ' 336' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -56.04 -72.7 0.07 Allowed 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.136 -0.977 . . . . 2.62 109.873 -179.388 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' C' C ' 337' ' ' ARG . . . . . . . . . . . . . 99.3 mtt180 -60.09 -27.47 67.03 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.355 -0.841 . . . . 2.81 109.566 179.942 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' C' C ' 338' ' ' PHE . . . . . 0.519 ' HA ' HG21 ' C' ' 332' ' ' ILE . 45.7 t80 -53.15 -61.34 2.36 Favored 'General case' 0 N--CA 1.487 1.39 0 O-C-N 121.19 -0.944 . . . . 0.4 109.249 179.942 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' C' C ' 339' ' ' GLU . . . . . 0.469 ' OE1' ' NH2' ' C' ' 335' ' ' ARG . 57.6 mt-10 -50.01 -30.74 11.22 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.406 -0.809 . . . . 2.05 109.823 -180.0 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' C' C ' 340' ' ' MET . . . . . . . . . . . . . 27.1 ttp -64.72 -51.04 64.52 Favored 'General case' 0 N--CA 1.496 1.833 0 O-C-N 121.361 -0.837 . . . . 0.32 109.995 -179.49 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' C' C ' 341' ' ' PHE . . . . . . . . . . . . . 49.7 m-85 -63.82 -49.58 72.3 Favored 'General case' 0 N--CA 1.494 1.732 0 O-C-N 121.229 -0.919 . . . . 0.18 109.888 -179.507 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' C' C ' 342' ' ' ARG . . . . . . . . . . . . . 16.3 ttp180 -48.3 -43.16 32.68 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.172 -0.955 . . . . 2.91 109.804 -179.916 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' C' C ' 343' ' ' GLU . . . . . . . . . . . . . 4.0 tt0 -59.4 -44.32 92.84 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.075 -1.016 . . . . 2.14 110.408 -179.361 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' C' C ' 344' ' ' LEU . . . . . 0.614 HD22 HD22 ' D' ' 344' ' ' LEU . 46.2 mt -64.19 -37.03 85.99 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 120.802 -1.186 . . . . 0.22 109.96 -179.604 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' C' C ' 345' ' ' ASN . . . . . 0.448 ' HB2' HD21 ' A' ' 330' ' ' LEU . 52.2 t-20 -56.68 -46.91 80.87 Favored 'General case' 0 C--N 1.301 -1.536 0 O-C-N 121.065 -1.022 . . . . 1.08 109.107 -179.825 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' C' C ' 346' ' ' GLU . . . . . . . . . . . . . 32.6 tt0 -62.11 -30.65 71.16 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.281 -0.887 . . . . 2.21 109.518 179.737 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' C' C ' 347' ' ' ALA . . . . . 1.007 ' HB1' ' HB1' ' D' ' 347' ' ' ALA . . . -61.66 -51.55 67.99 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.098 -1.001 . . . . 0.18 109.735 179.668 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' C' C ' 348' ' ' LEU . . . . . 0.548 HD22 ' N ' ' C' ' 348' ' ' LEU . 4.4 mm? -61.88 -53.22 58.82 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.162 -0.961 . . . . 0.32 110.471 -179.249 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' C' C ' 349' ' ' GLU . . . . . 0.412 ' O ' ' HB2' ' C' ' 352' ' ' ASP . 9.6 mt-10 -57.23 -32.47 66.57 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.097 -1.002 . . . . 2.19 109.21 -179.727 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' C' C ' 350' ' ' LEU . . . . . 0.925 ' CD2' HD13 ' D' ' 350' ' ' LEU . 5.1 tt -62.48 -42.51 99.54 Favored 'General case' 0 C--N 1.301 -1.506 0 N-CA-C 109.383 -0.599 . . . . 0.46 109.383 179.926 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' C' C ' 351' ' ' LYS . . . . . 0.51 ' N ' HD23 ' C' ' 350' ' ' LEU . 0.0 OUTLIER -58.6 -34.06 70.69 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.158 -0.964 . . . . 1.35 109.593 179.983 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' C' C ' 352' ' ' ASP . . . . . 0.412 ' HB2' ' O ' ' C' ' 349' ' ' GLU . 7.9 m-20 -55.62 -40.3 71.94 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.254 -0.904 . . . . 1.19 109.015 179.98 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' C' C ' 353' ' ' ALA . . . . . . . . . . . . . . . -67.64 -27.41 66.85 Favored 'General case' 0 N--CA 1.488 1.467 0 O-C-N 121.244 -0.91 . . . . 0.57 109.114 179.809 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' C' C ' 354' ' ' GLN . . . . . 0.492 ' CD ' HD11 ' D' ' 350' ' ' LEU . 0.0 OUTLIER -79.1 -1.09 34.29 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.469 -0.769 . . . . 1.47 109.773 -179.907 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' C' C ' 355' ' ' ALA . . . . . . . . . . . . . . . -68.99 -91.49 0.01 OUTLIER 'General case' 0 N--CA 1.488 1.427 0 O-C-N 120.895 -1.128 . . . . 0.93 108.674 179.879 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' C' C ' 356' ' ' GLY . . . . . . . . . . . . . . . -73.47 113.76 4.39 Favored Glycine 0 N--CA 1.492 2.432 0 N-CA-C 108.857 -1.697 . . . . 1.33 108.857 179.205 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' C' C ' 357' ' ' LYS . . . . . . . . . . . . . 3.5 pttp -87.8 132.92 33.99 Favored 'General case' 0 N--CA 1.491 1.625 0 O-C-N 121.166 -1.197 . . . . 4.01 110.118 -179.371 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' C' C ' 358' ' ' GLU . . . . . 0.437 ' CG ' ' HD2' ' C' ' 359' ' ' PRO . 5.3 tt0 -47.1 140.18 6.75 Favored Pre-proline 0 N--CA 1.493 1.715 0 O-C-N 121.372 -0.83 . . . . 5.75 109.177 179.917 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' C' C ' 359' ' ' PRO . . . . . 0.437 ' HD2' ' CG ' ' C' ' 358' ' ' GLU . 5.3 Cg_exo -59.39 -153.64 0.01 OUTLIER 'Trans proline' 0 C--N 1.312 -1.392 0 C-N-CA 121.901 1.734 . . . . 4.94 109.979 179.781 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' C' C ' 360' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.261 0 N-CA-C 109.498 -1.441 . . . . 6.5 109.498 179.783 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' D' D ' 319' ' ' LYS . . . . . 0.421 ' O ' ' N ' ' D' ' 321' ' ' LYS . 0.0 OUTLIER . . . . . 0 N--CA 1.492 1.668 0 N-CA-C 109.342 -0.614 . . . . 7.53 109.342 . . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' D' D ' 320' ' ' LYS . . . . . 0.404 ' CG ' ' N ' ' D' ' 321' ' ' LYS . 2.1 tptt 55.69 -93.28 0.04 OUTLIER 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.053 -1.029 . . . . 6.41 109.283 -179.602 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' D' D ' 321' ' ' LYS . . . . . 0.421 ' N ' ' O ' ' D' ' 319' ' ' LYS . 0.0 OUTLIER -158.59 83.24 2.61 Favored Pre-proline 0 N--CA 1.49 1.574 0 O-C-N 121.092 -1.005 . . . . 6.11 109.516 179.706 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' D' D ' 322' ' ' PRO . . . . . . . . . . . . . 1.0 OUTLIER -66.15 -3.01 7.82 Favored 'Trans proline' 0 C--N 1.312 -1.389 0 C-N-CA 122.357 2.038 . . . . 2.82 111.089 179.872 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' D' D ' 323' ' ' LEU . . . . . 0.443 ' HA ' HD23 ' D' ' 323' ' ' LEU . 55.1 mt -85.47 61.17 6.69 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.102 -0.999 . . . . 2.83 110.042 -179.846 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' D' D ' 324' ' ' ASP . . . . . 0.458 ' OD1' ' N ' ' D' ' 324' ' ' ASP . 1.6 m-20 -81.91 -144.02 0.06 Allowed 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.301 -0.874 . . . . 1.54 109.593 179.946 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' D' D ' 325' ' ' GLY . . . . . 0.442 ' O ' ' CE1' ' D' ' 327' ' ' TYR . . . -64.92 -177.31 5.82 Favored Glycine 0 N--CA 1.489 2.215 0 N-CA-C 109.489 -1.445 . . . . 0.59 109.489 179.893 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' D' D ' 326' ' ' GLU . . . . . 0.421 ' HB2' ' CE1' ' D' ' 328' ' ' PHE . 24.9 mm-40 -57.65 179.77 0.06 Allowed 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.418 -1.048 . . . . 2.13 109.721 -179.711 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' D' D ' 327' ' ' TYR . . . . . 0.5 ' CE2' ' HG2' ' B' ' 333' ' ' ARG . 42.5 m-85 -149.01 108.8 4.03 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.353 -0.842 . . . . 0.47 109.674 -179.988 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' D' D ' 328' ' ' PHE . . . . . 0.423 ' CD1' ' N ' ' D' ' 328' ' ' PHE . 4.3 m-85 -114.02 -167.51 1.22 Allowed 'General case' 0 N--CA 1.489 1.499 0 O-C-N 121.473 -0.767 . . . . 0.3 108.986 179.813 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' D' D ' 329' ' ' THR . . . . . 0.457 ' HA ' ' O ' ' B' ' 330' ' ' LEU . 27.0 p -154.71 176.7 12.11 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.017 -1.052 . . . . 0.22 109.701 179.953 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' D' D ' 330' ' ' LEU . . . . . 0.459 ' O ' ' HA ' ' B' ' 329' ' ' THR . 64.5 tp -149.81 129.32 13.05 Favored 'General case' 0 N--CA 1.489 1.488 0 O-C-N 121.057 -1.027 . . . . 0.28 109.508 -179.786 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' D' D ' 331' ' ' GLN . . . . . 0.406 ' HA ' HG22 ' B' ' 329' ' ' THR . 0.0 OUTLIER -87.79 111.01 20.91 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.395 -0.816 . . . . 0.93 109.695 -179.882 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' D' D ' 332' ' ' ILE . . . . . 0.588 HG21 ' HA ' ' D' ' 338' ' ' PHE . 57.8 mt -103.57 111.89 34.99 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.595 0 O-C-N 121.308 -0.87 . . . . 0.25 109.793 179.987 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' D' D ' 333' ' ' ARG . . . . . 0.518 ' HG2' ' CE2' ' B' ' 327' ' ' TYR . 0.0 OUTLIER -73.86 141.13 46.12 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.145 -0.972 . . . . 2.93 109.4 179.72 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' D' D ' 334' ' ' GLY . . . . . . . . . . . . . . . 83.29 132.27 1.94 Allowed Glycine 0 N--CA 1.493 2.473 0 N-CA-C 109.866 -1.294 . . . . 0.41 109.866 179.921 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' D' D ' 335' ' ' ARG . . . . . . . . . . . . . 11.7 ttp180 -78.32 -25.86 46.67 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.206 -1.173 . . . . 3.03 109.12 179.668 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' D' D ' 336' ' ' GLU . . . . . . . . . . . . . 2.8 tt0 -58.93 -67.96 0.32 Allowed 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.318 -0.864 . . . . 2.26 109.991 -179.692 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' D' D ' 337' ' ' ARG . . . . . 0.402 ' HA ' ' HD2' ' D' ' 337' ' ' ARG . 1.0 OUTLIER -61.97 -26.46 68.22 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 120.857 -1.152 . . . . 2.92 109.026 179.951 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' D' D ' 338' ' ' PHE . . . . . 0.588 ' HA ' HG21 ' D' ' 332' ' ' ILE . 47.7 t80 -54.67 -60.9 2.72 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.344 -0.847 . . . . 0.37 109.303 179.553 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' D' D ' 339' ' ' GLU . . . . . . . . . . . . . 8.4 mt-10 -52.02 -34.03 41.13 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.247 -0.908 . . . . 1.99 109.848 -179.754 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' D' D ' 340' ' ' MET . . . . . . . . . . . . . 8.9 ttp -62.02 -50.26 72.76 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.2 -0.937 . . . . 0.31 109.923 -179.735 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' D' D ' 341' ' ' PHE . . . . . 0.426 ' CZ ' ' HA ' ' B' ' 345' ' ' ASN . 52.2 m-85 -63.73 -48.9 75.17 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 120.797 -1.19 . . . . 0.18 110.209 -179.638 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' D' D ' 342' ' ' ARG . . . . . . . . . . . . . 71.3 ttt180 -48.66 -44.96 38.13 Favored 'General case' 0 C--N 1.302 -1.498 0 O-C-N 121.296 -0.878 . . . . 2.41 109.834 -179.358 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' D' D ' 343' ' ' GLU . . . . . . . . . . . . . 3.0 tt0 -56.49 -45.48 80.95 Favored 'General case' 0 N--CA 1.489 1.494 0 O-C-N 121.204 -0.935 . . . . 2.35 109.902 -179.489 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' D' D ' 344' ' ' LEU . . . . . 0.614 HD22 HD22 ' C' ' 344' ' ' LEU . 47.4 mt -62.94 -40.51 97.86 Favored 'General case' 0 N--CA 1.494 1.757 0 O-C-N 121.147 -0.971 . . . . 0.19 110.088 -179.712 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' D' D ' 345' ' ' ASN . . . . . 0.458 ' HB2' HD21 ' B' ' 330' ' ' LEU . 55.5 t30 -56.86 -49.47 75.4 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.173 -0.954 . . . . 1.09 109.71 -179.605 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' D' D ' 346' ' ' GLU . . . . . . . . . . . . . 9.2 tt0 -61.9 -29.91 70.53 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.365 -0.834 . . . . 1.69 109.747 -179.929 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' D' D ' 347' ' ' ALA . . . . . 1.007 ' HB1' ' HB1' ' C' ' 347' ' ' ALA . . . -62.52 -49.47 75.19 Favored 'General case' 0 N--CA 1.494 1.739 0 O-C-N 121.112 -0.993 . . . . 0.18 109.977 -179.984 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' D' D ' 348' ' ' LEU . . . . . 0.592 HD22 ' N ' ' D' ' 348' ' ' LEU . 4.2 mm? -63.23 -52.61 61.51 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.154 -0.966 . . . . 0.31 109.524 -179.683 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' D' D ' 349' ' ' GLU . . . . . . . . . . . . . 25.1 mt-10 -55.36 -31.18 61.54 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.494 -0.754 . . . . 1.95 109.948 -179.683 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' D' D ' 350' ' ' LEU . . . . . 0.925 HD13 ' CD2' ' C' ' 350' ' ' LEU . 4.4 tt -64.6 -41.3 96.31 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.316 -0.865 . . . . 0.43 109.106 179.982 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' D' D ' 351' ' ' LYS . . . . . . . . . . . . . 17.8 tttt -59.04 -44.01 91.72 Favored 'General case' 0 N--CA 1.489 1.497 0 O-C-N 121.278 -0.889 . . . . 1.4 109.648 -179.973 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' D' D ' 352' ' ' ASP . . . . . . . . . . . . . 86.6 m-20 -55.1 -40.32 70.32 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.421 -0.799 . . . . 1.17 110.125 -179.404 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' D' D ' 353' ' ' ALA . . . . . . . . . . . . . . . -66.19 -38.39 87.9 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.239 -0.913 . . . . 0.59 109.741 -179.658 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' D' D ' 354' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -81.76 -6.09 58.74 Favored 'General case' 0 C--N 1.302 -1.484 0 O-C-N 121.238 -0.914 . . . . 1.44 109.873 -179.541 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' D' D ' 355' ' ' ALA . . . . . . . . . . . . . . . -73.35 -85.71 0.03 OUTLIER 'General case' 0 N--CA 1.488 1.455 0 O-C-N 121.218 -0.926 . . . . 0.98 109.847 -179.747 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' D' D ' 356' ' ' GLY . . . . . . . . . . . . . . . -67.85 86.19 0.16 Allowed Glycine 0 N--CA 1.495 2.614 0 N-CA-C 110.265 -1.134 . . . . 1.28 110.265 -179.554 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' D' D ' 357' ' ' LYS . . . . . . . . . . . . . 2.8 mttt -87.99 39.11 0.88 Allowed 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.116 -1.226 . . . . 4.09 109.311 179.765 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' D' D ' 358' ' ' GLU . . . . . . . . . . . . . 50.0 tt0 -47.16 109.62 1.11 Allowed Pre-proline 0 N--CA 1.495 1.791 0 O-C-N 121.123 -0.986 . . . . 5.71 109.79 -179.884 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' D' D ' 359' ' ' PRO . . . . . . . . . . . . . 1.6 Cg_endo -62.21 113.79 2.05 Favored 'Trans proline' 0 C--N 1.315 -1.205 0 C-N-CA 122.064 1.843 . . . . 4.97 110.411 179.831 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' D' D ' 360' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.218 0 N-CA-C 109.172 -1.571 . . . . 6.97 109.172 179.631 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 319' ' ' LYS . . . . . 0.418 ' O ' ' O ' ' A' ' 320' ' ' LYS . 0.9 OUTLIER . . . . . 0 N--CA 1.491 1.582 0 CA-C-O 121.304 0.574 . . . . 7.55 109.466 . . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 320' ' ' LYS . . . . . 0.418 ' O ' ' O ' ' A' ' 319' ' ' LYS . 0.1 OUTLIER 63.07 135.93 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.207 -0.933 . . . . 6.43 109.401 179.995 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 321' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -157.94 79.73 3.25 Favored Pre-proline 0 N--CA 1.49 1.538 0 O-C-N 121.285 -0.885 . . . . 6.13 109.491 -179.979 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 322' ' ' PRO . . . . . . . . . . . . . 3.4 Cg_exo -60.51 157.54 36.09 Favored 'Trans proline' 0 C--N 1.309 -1.518 0 C-N-CA 122.184 1.923 . . . . 2.83 110.1 179.964 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 323' ' ' LEU . . . . . . . . . . . . . 42.8 mt -80.87 113.97 19.44 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.205 -0.934 . . . . 2.83 109.715 -179.954 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 324' ' ' ASP . . . . . 0.418 ' HB2' ' OH ' ' A' ' 327' ' ' TYR . 26.9 m-20 -80.88 -156.67 0.14 Allowed 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.343 -0.848 . . . . 1.53 109.476 179.882 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 325' ' ' GLY . . . . . . . . . . . . . . . -68.86 -173.55 8.69 Favored Glycine 0 N--CA 1.49 2.264 0 N-CA-C 109.671 -1.371 . . . . 0.61 109.671 -179.956 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 326' ' ' GLU . . . . . . . . . . . . . 4.3 mm-40 -59.11 -174.09 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.258 -1.142 . . . . 2.13 109.499 179.976 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 327' ' ' TYR . . . . . 0.604 ' CE2' ' HG2' ' C' ' 333' ' ' ARG . 43.4 m-85 -149.52 106.11 3.53 Favored 'General case' 0 N--CA 1.488 1.444 0 O-C-N 121.289 -0.882 . . . . 0.48 109.56 179.837 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 328' ' ' PHE . . . . . 0.442 ' O ' ' NE2' ' C' ' 331' ' ' GLN . 22.6 m-85 -111.98 -167.57 1.2 Allowed 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.388 -0.82 . . . . 0.31 108.938 179.717 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 329' ' ' THR . . . . . 0.422 ' HA ' ' O ' ' C' ' 330' ' ' LEU . 77.7 p -153.59 -179.73 8.05 Favored 'General case' 0 C--N 1.303 -1.441 0 O-C-N 121.152 -0.968 . . . . 0.22 109.374 179.883 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 330' ' ' LEU . . . . . 0.428 ' O ' ' HA ' ' C' ' 329' ' ' THR . 52.1 tp -152.73 131.96 12.76 Favored 'General case' 0 N--CA 1.488 1.469 0 O-C-N 121.18 -0.95 . . . . 0.28 109.564 -179.892 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 331' ' ' GLN . . . . . . . . . . . . . 44.6 tp60 -87.99 106.64 18.27 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.359 -0.838 . . . . 0.91 109.5 179.933 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 332' ' ' ILE . . . . . . . . . . . . . 31.9 mt -103.49 103.1 14.63 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.541 0 O-C-N 121.129 -0.982 . . . . 0.26 109.534 179.926 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 333' ' ' ARG . . . . . 0.531 ' NH1' ' HG2' ' A' ' 333' ' ' ARG . 0.0 OUTLIER -72.46 151.49 42.51 Favored 'General case' 0 N--CA 1.488 1.464 0 O-C-N 121.265 -0.897 . . . . 2.92 109.445 179.861 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 334' ' ' GLY . . . . . . . . . . . . . . . 86.47 128.99 2.45 Favored Glycine 0 N--CA 1.491 2.315 0 N-CA-C 109.593 -1.403 . . . . 0.4 109.593 -179.984 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 335' ' ' ARG . . . . . 0.451 ' HA ' ' CE2' ' C' ' 328' ' ' PHE . 3.5 ttm180 -79.66 -39.09 32.2 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.278 -1.131 . . . . 3.01 109.586 179.988 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 336' ' ' GLU . . . . . . . . . . . . . 2.2 mt-10 -58.05 -61.42 2.56 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.225 -0.922 . . . . 2.29 109.7 -179.916 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 337' ' ' ARG . . . . . 0.457 ' NH1' ' CG ' ' A' ' 337' ' ' ARG . 0.0 OUTLIER -59.75 -29.33 68.08 Favored 'General case' 0 N--CA 1.489 1.494 0 O-C-N 121.168 -0.957 . . . . 2.93 109.528 -179.842 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 338' ' ' PHE . . . . . 0.449 ' HB3' ' O ' ' A' ' 335' ' ' ARG . 48.3 t80 -55.69 -56.03 25.17 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.145 -0.972 . . . . 0.38 109.465 179.993 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 339' ' ' GLU . . . . . . . . . . . . . 24.0 mt-10 -50.24 -33.27 19.05 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.195 -0.941 . . . . 1.97 110.045 -179.647 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 340' ' ' MET . . . . . . . . . . . . . 32.1 ttp -63.19 -51.0 68.13 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.158 -0.963 . . . . 0.31 109.878 -179.713 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 341' ' ' PHE . . . . . . . . . . . . . 38.9 m-85 -62.67 -52.02 64.93 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.177 -0.952 . . . . 0.18 109.704 -179.741 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 342' ' ' ARG . . . . . . . . . . . . . 9.7 ttm180 -47.63 -36.65 11.21 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.188 -0.945 . . . . 2.42 109.438 -179.948 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 343' ' ' GLU . . . . . . . . . . . . . 32.2 tt0 -59.18 -49.61 77.18 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.219 -0.926 . . . . 2.35 109.433 -179.92 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 344' ' ' LEU . . . . . 0.687 HD22 ' CD2' ' B' ' 344' ' ' LEU . 57.5 mt -62.42 -32.31 73.14 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.223 -0.923 . . . . 0.18 109.437 179.984 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 345' ' ' ASN . . . . . . . . . . . . . 9.6 t-20 -56.81 -54.93 40.77 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.302 -0.874 . . . . 1.09 109.618 -179.886 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 346' ' ' GLU . . . . . . . . . . . . . 43.8 tp10 -61.35 -31.66 71.54 Favored 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.274 -0.891 . . . . 1.65 109.813 -179.797 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 347' ' ' ALA . . . . . 0.772 ' HB1' ' HB1' ' B' ' 347' ' ' ALA . . . -59.91 -57.86 11.04 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.204 -0.935 . . . . 0.18 109.988 -179.73 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 348' ' ' LEU . . . . . 0.71 HD12 ' HE ' ' C' ' 337' ' ' ARG . 4.2 mm? -61.59 -41.91 98.11 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.206 -0.934 . . . . 0.3 109.81 -179.584 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 349' ' ' GLU . . . . . . . . . . . . . 98.5 mt-10 -58.08 -34.93 70.69 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.264 -0.898 . . . . 1.94 110.007 -179.53 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 350' ' ' LEU . . . . . 0.86 HD13 HD22 ' B' ' 350' ' ' LEU . 5.7 tt -63.54 -46.46 85.89 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.111 -0.993 . . . . 0.46 109.523 -179.819 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 351' ' ' LYS . . . . . . . . . . . . . 42.4 tttt -59.38 -38.0 79.37 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.274 -0.891 . . . . 1.4 109.443 -179.978 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 352' ' ' ASP . . . . . . . . . . . . . 23.0 m-20 -55.71 -36.14 66.86 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.199 -0.938 . . . . 1.16 109.671 -179.995 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 353' ' ' ALA . . . . . . . . . . . . . . . -66.88 -35.75 80.74 Favored 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.235 -0.916 . . . . 0.63 109.76 -179.745 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 354' ' ' GLN . . . . . . . . . . . . . 5.9 mt-30 -81.23 -3.9 53.81 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.215 -0.928 . . . . 1.47 109.657 -179.92 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 355' ' ' ALA . . . . . . . . . . . . . . . -70.97 -82.72 0.04 OUTLIER 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.134 -0.979 . . . . 1.01 109.579 179.887 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 356' ' ' GLY . . . . . . . . . . . . . . . -59.08 93.39 0.05 OUTLIER Glycine 0 N--CA 1.491 2.302 0 N-CA-C 109.688 -1.365 . . . . 1.3 109.688 -179.941 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 357' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -86.81 134.25 33.57 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.235 -1.156 . . . . 4.1 109.301 179.836 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 358' ' ' GLU . . . . . . . . . . . . . 19.0 tt0 -49.53 133.42 18.86 Favored Pre-proline 0 N--CA 1.49 1.558 0 O-C-N 121.234 -0.917 . . . . 5.75 109.412 -179.816 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 359' ' ' PRO . . . . . . . . . . . . . 2.2 Cg_endo -62.69 167.76 11.23 Favored 'Trans proline' 0 C--N 1.313 -1.329 0 C-N-CA 122.074 1.849 . . . . 5.0 110.164 179.929 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 360' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.35 0 CA-C-O 118.004 -1.442 . . . . 6.97 109.54 179.932 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' B' B ' 319' ' ' LYS . . . . . 0.412 ' O ' ' O ' ' B' ' 320' ' ' LYS . 0.9 OUTLIER . . . . . 0 N--CA 1.492 1.647 0 N-CA-C 109.451 -0.574 . . . . 7.55 109.451 . . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 320' ' ' LYS . . . . . 0.412 ' O ' ' O ' ' B' ' 319' ' ' LYS . 0.1 OUTLIER 63.14 135.85 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.247 -0.908 . . . . 6.44 109.383 -179.992 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' B' B ' 321' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -157.85 79.73 3.28 Favored Pre-proline 0 N--CA 1.489 1.478 0 O-C-N 121.229 -0.919 . . . . 6.13 109.558 179.984 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 322' ' ' PRO . . . . . . . . . . . . . 3.4 Cg_exo -60.49 157.44 36.45 Favored 'Trans proline' 0 C--N 1.311 -1.419 0 C-N-CA 122.161 1.907 . . . . 2.82 110.23 180.0 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 323' ' ' LEU . . . . . . . . . . . . . 43.5 mt -80.92 113.96 19.48 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.238 -0.914 . . . . 2.84 109.519 -179.741 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 324' ' ' ASP . . . . . 0.414 ' HB2' ' OH ' ' B' ' 327' ' ' TYR . 26.9 m-20 -81.01 -156.4 0.14 Allowed 'General case' 0 N--CA 1.489 1.488 0 O-C-N 121.284 -0.885 . . . . 1.53 109.608 179.896 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 325' ' ' GLY . . . . . . . . . . . . . . . -68.87 -173.47 8.64 Favored Glycine 0 N--CA 1.49 2.291 0 N-CA-C 109.562 -1.415 . . . . 0.59 109.562 -179.885 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 326' ' ' GLU . . . . . . . . . . . . . 4.3 mm-40 -59.21 -173.96 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.327 -1.102 . . . . 2.13 109.43 179.904 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 327' ' ' TYR . . . . . 0.517 ' CE2' ' HG2' ' D' ' 333' ' ' ARG . 43.1 m-85 -149.59 106.1 3.52 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.365 -0.835 . . . . 0.48 109.46 179.823 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 328' ' ' PHE . . . . . 0.488 ' CE1' ' HA ' ' D' ' 335' ' ' ARG . 22.5 m-85 -111.97 -167.74 1.22 Allowed 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.236 -0.915 . . . . 0.32 108.974 179.653 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 329' ' ' THR . . . . . 0.414 HG23 ' C ' ' B' ' 328' ' ' PHE . 75.7 p -153.38 -179.55 7.85 Favored 'General case' 0 N--CA 1.488 1.453 0 O-C-N 121.195 -0.941 . . . . 0.23 109.331 179.899 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 330' ' ' LEU . . . . . . . . . . . . . 52.2 tp -152.93 131.87 12.53 Favored 'General case' 0 N--CA 1.489 1.484 0 O-C-N 121.274 -0.891 . . . . 0.28 109.484 -179.867 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 331' ' ' GLN . . . . . . . . . . . . . 44.6 tp60 -88.09 106.41 18.14 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.284 -0.885 . . . . 0.91 109.505 179.967 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 332' ' ' ILE . . . . . . . . . . . . . 31.5 mt -103.28 103.26 14.84 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.601 0 O-C-N 121.198 -0.939 . . . . 0.24 109.609 179.86 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 333' ' ' ARG . . . . . 0.566 ' HG2' ' CE2' ' D' ' 327' ' ' TYR . 0.0 OUTLIER -72.55 151.39 42.45 Favored 'General case' 0 N--CA 1.489 1.5 0 O-C-N 121.278 -0.889 . . . . 2.93 109.465 179.835 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' B' B ' 334' ' ' GLY . . . . . . . . . . . . . . . 86.6 128.96 2.48 Favored Glycine 0 N--CA 1.49 2.254 0 N-CA-C 109.556 -1.418 . . . . 0.4 109.556 -179.977 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 335' ' ' ARG . . . . . 0.444 ' O ' ' HB3' ' B' ' 338' ' ' PHE . 3.4 ttm180 -79.58 -39.29 32.06 Favored 'General case' 0 N--CA 1.489 1.495 0 O-C-N 121.3 -1.117 . . . . 3.01 109.506 -179.994 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 336' ' ' GLU . . . . . . . . . . . . . 2.2 mt-10 -57.89 -61.36 2.59 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.221 -0.924 . . . . 2.28 109.77 -179.921 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 337' ' ' ARG . . . . . 0.455 ' NH1' ' CG ' ' B' ' 337' ' ' ARG . 0.0 OUTLIER -59.82 -29.35 68.19 Favored 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.226 -0.921 . . . . 2.93 109.502 -179.871 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' B' B ' 338' ' ' PHE . . . . . 0.444 ' HB3' ' O ' ' B' ' 335' ' ' ARG . 48.0 t80 -55.54 -56.12 23.96 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.184 -0.948 . . . . 0.37 109.469 179.943 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 339' ' ' GLU . . . . . . . . . . . . . 23.9 mt-10 -50.36 -33.17 19.49 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.27 -0.894 . . . . 1.98 109.99 -179.657 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 340' ' ' MET . . . . . . . . . . . . . 32.3 ttp -63.39 -50.85 68.24 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.052 -1.03 . . . . 0.32 109.812 -179.73 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 341' ' ' PHE . . . . . . . . . . . . . 39.3 m-85 -62.74 -51.8 65.75 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.19 -0.944 . . . . 0.18 109.819 -179.812 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 342' ' ' ARG . . . . . . . . . . . . . 9.7 ttm180 -47.78 -36.83 12.26 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.245 -0.91 . . . . 2.42 109.522 -179.988 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 343' ' ' GLU . . . . . . . . . . . . . 32.5 tt0 -58.88 -49.72 76.72 Favored 'General case' 0 N--CA 1.489 1.486 0 O-C-N 121.214 -0.929 . . . . 2.35 109.47 179.957 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 344' ' ' LEU . . . . . 0.687 ' CD2' HD22 ' A' ' 344' ' ' LEU . 56.8 mt -62.39 -32.34 73.14 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.174 -0.954 . . . . 0.18 109.466 179.947 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 345' ' ' ASN . . . . . . . . . . . . . 9.6 t-20 -56.81 -54.88 41.26 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.352 -0.842 . . . . 1.09 109.678 -179.87 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 346' ' ' GLU . . . . . . . . . . . . . 43.8 tp10 -61.37 -31.66 71.56 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.237 -0.914 . . . . 1.66 109.787 -179.849 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 347' ' ' ALA . . . . . 0.772 ' HB1' ' HB1' ' A' ' 347' ' ' ALA . . . -59.93 -57.8 11.29 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.235 -0.916 . . . . 0.17 109.974 -179.663 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 348' ' ' LEU . . . . . 0.6 HD22 ' N ' ' B' ' 348' ' ' LEU . 4.2 mm? -61.6 -41.91 98.11 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.198 -0.939 . . . . 0.29 109.828 -179.558 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 349' ' ' GLU . . . . . . . . . . . . . 98.5 mt-10 -57.97 -35.18 70.81 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.246 -0.909 . . . . 1.95 109.946 -179.492 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 350' ' ' LEU . . . . . 0.86 HD22 HD13 ' A' ' 350' ' ' LEU . 5.7 tt -63.33 -46.59 85.92 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.157 -0.964 . . . . 0.45 109.576 -179.836 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 351' ' ' LYS . . . . . . . . . . . . . 42.4 tttt -59.37 -37.86 78.98 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.294 -0.879 . . . . 1.38 109.398 -179.899 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 352' ' ' ASP . . . . . . . . . . . . . 22.8 m-20 -55.72 -36.17 66.93 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.349 -0.844 . . . . 1.16 109.717 179.992 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 353' ' ' ALA . . . . . . . . . . . . . . . -66.91 -35.75 80.7 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.217 -0.927 . . . . 0.61 109.838 -179.752 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 354' ' ' GLN . . . . . . . . . . . . . 5.9 mt-30 -81.19 -4.09 54.31 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.115 -0.991 . . . . 1.45 109.543 -179.892 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 355' ' ' ALA . . . . . . . . . . . . . . . -70.68 -82.52 0.04 OUTLIER 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.187 -0.946 . . . . 0.98 109.692 179.877 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 356' ' ' GLY . . . . . . . . . . . . . . . -59.35 93.6 0.05 OUTLIER Glycine 0 N--CA 1.491 2.34 0 N-CA-C 109.623 -1.391 . . . . 1.29 109.623 -179.926 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 357' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -86.88 134.16 33.55 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.259 -1.142 . . . . 4.09 109.265 179.816 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 358' ' ' GLU . . . . . . . . . . . . . 19.0 tt0 -49.49 133.57 18.54 Favored Pre-proline 0 N--CA 1.491 1.58 0 O-C-N 121.15 -0.969 . . . . 5.72 109.375 -179.81 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 359' ' ' PRO . . . . . . . . . . . . . 2.3 Cg_endo -62.83 167.75 11.46 Favored 'Trans proline' 0 C--N 1.312 -1.343 0 C-N-CA 121.962 1.775 . . . . 4.98 110.129 179.956 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 360' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.285 0 CA-C-O 117.961 -1.466 . . . . 6.98 109.507 179.954 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' C' C ' 319' ' ' LYS . . . . . 0.423 ' HB3' ' HE2' ' C' ' 320' ' ' LYS . 0.2 OUTLIER . . . . . 0 N--CA 1.49 1.571 0 N-CA-C 109.476 -0.565 . . . . 6.82 109.476 . . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' C' C ' 320' ' ' LYS . . . . . 0.423 ' HE2' ' HB3' ' C' ' 319' ' ' LYS . 0.0 OUTLIER 63.93 62.74 0.86 Allowed 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.222 -0.924 . . . . 6.49 109.524 179.969 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' C' C ' 321' ' ' LYS . . . . . 0.552 ' N ' ' HD2' ' C' ' 322' ' ' PRO . 0.0 OUTLIER -80.7 -54.25 0.79 Allowed Pre-proline 0 N--CA 1.49 1.573 0 O-C-N 121.341 -0.85 . . . . 6.4 110.542 -179.649 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' C' C ' 322' ' ' PRO . . . . . 0.552 ' HD2' ' N ' ' C' ' 321' ' ' LYS . 5.0 Cg_exo -60.7 159.58 27.95 Favored 'Trans proline' 0 C--N 1.31 -1.459 0 C-N-CA 121.835 1.69 . . . . 3.42 110.452 -179.374 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' C' C ' 323' ' ' LEU . . . . . . . . . . . . . 78.9 mt -78.53 151.38 32.54 Favored 'General case' 0 N--CA 1.489 1.499 0 O-C-N 121.247 -0.908 . . . . 3.95 109.139 -179.949 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' C' C ' 324' ' ' ASP . . . . . 0.48 ' HB2' ' OH ' ' C' ' 327' ' ' TYR . 2.5 m-20 -77.8 177.07 8.47 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.22 -0.925 . . . . 1.63 109.744 -179.563 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' C' C ' 325' ' ' GLY . . . . . 0.407 ' O ' ' O ' ' C' ' 326' ' ' GLU . . . -68.62 -169.58 5.68 Favored Glycine 0 N--CA 1.49 2.259 0 N-CA-C 109.761 -1.336 . . . . 0.73 109.761 -179.796 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' C' C ' 326' ' ' GLU . . . . . 0.522 ' O ' ' CD1' ' C' ' 327' ' ' TYR . 5.2 mt-10 -57.96 -163.85 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.285 -1.127 . . . . 2.17 109.428 179.998 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' C' C ' 327' ' ' TYR . . . . . 0.522 ' CD1' ' O ' ' C' ' 326' ' ' GLU . 40.3 m-85 -149.77 109.11 3.96 Favored 'General case' 0 N--CA 1.489 1.494 0 O-C-N 121.149 -0.97 . . . . 0.48 109.723 -179.973 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' C' C ' 328' ' ' PHE . . . . . 0.451 ' CE2' ' HA ' ' A' ' 335' ' ' ARG . 83.7 m-85 -113.89 -167.04 1.15 Allowed 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.401 -0.812 . . . . 0.33 109.137 179.81 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' C' C ' 329' ' ' THR . . . . . 0.431 HG23 ' C ' ' C' ' 328' ' ' PHE . 22.4 p -153.73 179.19 9.08 Favored 'General case' 0 N--CA 1.489 1.487 0 O-C-N 121.124 -0.985 . . . . 0.23 109.494 179.988 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' C' C ' 330' ' ' LEU . . . . . 0.422 ' O ' ' HA ' ' A' ' 329' ' ' THR . 54.1 tp -152.99 131.61 12.27 Favored 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.243 -0.911 . . . . 0.28 109.761 -179.802 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' C' C ' 331' ' ' GLN . . . . . 0.442 ' NE2' ' O ' ' A' ' 328' ' ' PHE . 0.0 OUTLIER -88.52 102.35 14.83 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.268 -0.895 . . . . 1.48 108.838 179.818 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' C' C ' 332' ' ' ILE . . . . . . . . . . . . . 53.6 mt -104.01 112.04 36.01 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.704 0 O-C-N 121.118 -0.988 . . . . 0.24 110.204 -179.606 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' C' C ' 333' ' ' ARG . . . . . 0.604 ' HG2' ' CE2' ' A' ' 327' ' ' TYR . 1.4 mpp_? -75.18 163.94 27.01 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.294 -0.879 . . . . 2.74 109.656 179.407 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' C' C ' 334' ' ' GLY . . . . . . . . . . . . . . . 72.55 130.3 0.12 Allowed Glycine 0 N--CA 1.493 2.476 0 N-CA-C 110.344 -1.102 . . . . 0.35 110.344 179.172 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' C' C ' 335' ' ' ARG . . . . . 0.481 ' O ' ' HB3' ' C' ' 338' ' ' PHE . 3.9 ttp180 -80.67 -37.98 29.88 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.401 -1.058 . . . . 2.53 109.414 179.684 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' C' C ' 336' ' ' GLU . . . . . . . . . . . . . 4.0 mt-10 -58.36 -60.98 2.94 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.218 -0.927 . . . . 2.62 109.676 -179.738 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' C' C ' 337' ' ' ARG . . . . . 0.71 ' HE ' HD12 ' A' ' 348' ' ' LEU . 0.0 OUTLIER -59.47 -29.24 67.68 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.208 -0.932 . . . . 2.81 109.463 -179.789 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' C' C ' 338' ' ' PHE . . . . . 0.481 ' HB3' ' O ' ' C' ' 335' ' ' ARG . 47.6 t80 -54.87 -55.55 29.2 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.228 -0.92 . . . . 0.4 109.245 179.825 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' C' C ' 339' ' ' GLU . . . . . . . . . . . . . 85.4 mt-10 -50.84 -29.17 11.08 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.297 -0.877 . . . . 2.05 109.672 -179.985 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' C' C ' 340' ' ' MET . . . . . . . . . . . . . 14.9 ttp -63.4 -53.83 46.29 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.132 -0.98 . . . . 0.32 109.64 -179.766 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' C' C ' 341' ' ' PHE . . . . . . . . . . . . . 38.8 m-85 -62.76 -46.1 89.61 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.211 -0.931 . . . . 0.18 109.729 -179.783 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' C' C ' 342' ' ' ARG . . . . . 0.445 HH11 ' CG ' ' C' ' 342' ' ' ARG . 0.0 OUTLIER -49.72 -42.45 46.01 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.215 -0.928 . . . . 2.91 109.621 -179.89 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' C' C ' 343' ' ' GLU . . . . . . . . . . . . . 23.1 tt0 -57.89 -47.26 83.32 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.134 -0.978 . . . . 2.14 109.298 -179.966 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' C' C ' 344' ' ' LEU . . . . . 0.615 HD22 HD22 ' D' ' 344' ' ' LEU . 76.3 mt -62.61 -29.07 70.33 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.211 -0.93 . . . . 0.22 109.232 179.704 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' C' C ' 345' ' ' ASN . . . . . . . . . . . . . 13.1 t-20 -58.84 -58.33 9.1 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.491 -0.756 . . . . 1.08 109.837 179.998 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' C' C ' 346' ' ' GLU . . . . . . . . . . . . . 6.6 tm-20 -60.8 -25.86 66.87 Favored 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.322 -0.861 . . . . 2.21 109.785 -179.644 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' C' C ' 347' ' ' ALA . . . . . 0.854 ' HB1' ' HB1' ' D' ' 347' ' ' ALA . . . -63.84 -58.2 7.53 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.137 -0.977 . . . . 0.18 110.028 -179.945 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' C' C ' 348' ' ' LEU . . . . . 0.567 HD22 ' N ' ' C' ' 348' ' ' LEU . 3.9 mm? -62.6 -49.61 74.54 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.202 -0.936 . . . . 0.32 110.582 -179.355 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' C' C ' 349' ' ' GLU . . . . . . . . . . . . . 54.3 mt-10 -56.97 -39.05 73.88 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.187 -0.946 . . . . 2.19 110.301 -179.096 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' C' C ' 350' ' ' LEU . . . . . 0.794 ' CD2' HD13 ' D' ' 350' ' ' LEU . 7.1 tt -64.57 -30.42 71.44 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.046 -1.033 . . . . 0.46 109.653 -179.761 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' C' C ' 351' ' ' LYS . . . . . . . . . . . . . 10.2 tttt -59.34 -48.88 79.94 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.308 -0.87 . . . . 1.35 109.414 -179.854 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' C' C ' 352' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -60.03 -47.06 87.41 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.331 -0.856 . . . . 1.19 109.588 179.867 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' C' C ' 353' ' ' ALA . . . . . . . . . . . . . . . -66.41 -10.51 44.41 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.224 -0.922 . . . . 0.57 109.461 -179.787 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' C' C ' 354' ' ' GLN . . . . . . . . . . . . . 4.9 tt0 -81.37 -65.77 0.97 Allowed 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.355 -0.841 . . . . 1.47 109.247 179.756 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' C' C ' 355' ' ' ALA . . . . . . . . . . . . . . . -69.42 -8.87 50.54 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.254 -0.904 . . . . 0.93 109.293 179.895 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' C' C ' 356' ' ' GLY . . . . . . . . . . . . . . . -80.48 4.37 68.75 Favored Glycine 0 N--CA 1.49 2.298 0 N-CA-C 109.55 -1.42 . . . . 1.33 109.55 179.76 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' C' C ' 357' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -85.16 138.74 32.18 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.245 -1.15 . . . . 4.01 109.464 -179.717 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' C' C ' 358' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -49.87 140.57 15.36 Favored Pre-proline 0 N--CA 1.49 1.526 0 O-C-N 121.223 -0.923 . . . . 5.75 109.466 -179.814 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' C' C ' 359' ' ' PRO . . . . . . . . . . . . . 2.4 Cg_endo -62.42 100.67 0.23 Allowed 'Trans proline' 0 C--N 1.31 -1.473 0 C-N-CA 122.046 1.83 . . . . 4.94 110.001 179.88 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' C' C ' 360' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.213 0 N-CA-C 109.559 -1.416 . . . . 6.5 109.559 -179.99 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' D' D ' 319' ' ' LYS . . . . . 0.415 ' O ' ' O ' ' D' ' 320' ' ' LYS . 0.8 OUTLIER . . . . . 0 N--CA 1.489 1.519 0 N-CA-C 109.487 -0.56 . . . . 7.53 109.487 . . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' D' D ' 320' ' ' LYS . . . . . 0.415 ' O ' ' O ' ' D' ' 319' ' ' LYS . 0.1 OUTLIER 63.22 135.97 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.27 -0.894 . . . . 6.41 109.396 -179.907 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' D' D ' 321' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -158.06 79.53 3.23 Favored Pre-proline 0 N--CA 1.488 1.47 0 O-C-N 121.267 -0.896 . . . . 6.11 109.52 -179.994 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' D' D ' 322' ' ' PRO . . . . . . . . . . . . . 3.2 Cg_exo -60.41 157.26 36.88 Favored 'Trans proline' 0 C--N 1.31 -1.468 0 C-N-CA 122.22 1.947 . . . . 2.82 110.185 -179.893 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' D' D ' 323' ' ' LEU . . . . . . . . . . . . . 43.6 mt -80.66 113.86 19.15 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.306 -0.871 . . . . 2.83 109.657 -179.845 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' D' D ' 324' ' ' ASP . . . . . 0.416 ' HB2' ' OH ' ' D' ' 327' ' ' TYR . 26.7 m-20 -80.89 -156.58 0.14 Allowed 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.299 -0.876 . . . . 1.54 109.543 179.819 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' D' D ' 325' ' ' GLY . . . . . . . . . . . . . . . -68.75 -173.36 8.35 Favored Glycine 0 N--CA 1.491 2.315 0 N-CA-C 109.669 -1.372 . . . . 0.59 109.669 -179.969 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' D' D ' 326' ' ' GLU . . . . . 0.401 ' O ' ' CD1' ' D' ' 327' ' ' TYR . 4.3 mm-40 -59.23 -174.09 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.29 -1.124 . . . . 2.13 109.451 179.924 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' D' D ' 327' ' ' TYR . . . . . 0.566 ' CE2' ' HG2' ' B' ' 333' ' ' ARG . 43.7 m-85 -149.61 106.04 3.51 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.268 -0.895 . . . . 0.47 109.534 179.824 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' D' D ' 328' ' ' PHE . . . . . 0.434 ' CE1' ' HA ' ' B' ' 335' ' ' ARG . 23.4 m-85 -111.87 -167.5 1.19 Allowed 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.339 -0.85 . . . . 0.3 109.007 179.683 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' D' D ' 329' ' ' THR . . . . . 0.408 HG23 ' C ' ' D' ' 328' ' ' PHE . 75.5 p -153.59 -179.76 8.08 Favored 'General case' 0 N--CA 1.488 1.452 0 O-C-N 121.158 -0.964 . . . . 0.22 109.424 179.925 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' D' D ' 330' ' ' LEU . . . . . . . . . . . . . 52.2 tp -152.75 131.91 12.71 Favored 'General case' 0 N--CA 1.488 1.467 0 O-C-N 121.205 -0.934 . . . . 0.28 109.532 -179.877 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' D' D ' 331' ' ' GLN . . . . . . . . . . . . . 44.6 tp60 -88.13 106.55 18.25 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.274 -0.891 . . . . 0.93 109.521 179.922 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' D' D ' 332' ' ' ILE . . . . . . . . . . . . . 31.9 mt -103.41 103.37 15.04 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.545 0 O-C-N 121.168 -0.957 . . . . 0.25 109.519 179.919 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' D' D ' 333' ' ' ARG . . . . . 0.547 ' HG2' ' NH1' ' D' ' 333' ' ' ARG . 0.0 OUTLIER -72.66 151.45 42.25 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.249 -0.907 . . . . 2.93 109.398 179.861 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' D' D ' 334' ' ' GLY . . . . . . . . . . . . . . . 86.56 128.87 2.46 Favored Glycine 0 N--CA 1.49 2.235 0 N-CA-C 109.595 -1.402 . . . . 0.41 109.595 -179.978 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' D' D ' 335' ' ' ARG . . . . . 0.488 ' HA ' ' CE1' ' B' ' 328' ' ' PHE . 3.4 ttm180 -79.54 -39.18 32.51 Favored 'General case' 0 N--CA 1.489 1.487 0 O-C-N 121.202 -1.175 . . . . 3.03 109.524 -179.975 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' D' D ' 336' ' ' GLU . . . . . . . . . . . . . 2.2 mt-10 -57.98 -61.4 2.57 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.252 -0.905 . . . . 2.26 109.731 -179.89 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' D' D ' 337' ' ' ARG . . . . . 0.457 HH11 ' CG ' ' D' ' 337' ' ' ARG . 0.0 OUTLIER -59.85 -29.35 68.23 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.18 -0.95 . . . . 2.92 109.504 -179.84 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' D' D ' 338' ' ' PHE . . . . . 0.44 ' HB3' ' O ' ' D' ' 335' ' ' ARG . 48.2 t80 -55.53 -56.2 23.04 Favored 'General case' 0 N--CA 1.488 1.474 0 O-C-N 121.219 -0.926 . . . . 0.37 109.483 179.886 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' D' D ' 339' ' ' GLU . . . . . . . . . . . . . 24.1 mt-10 -50.09 -33.49 18.76 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.23 -0.919 . . . . 1.99 110.03 -179.716 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' D' D ' 340' ' ' MET . . . . . . . . . . . . . 32.2 ttp -63.13 -51.11 67.78 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.2 -0.938 . . . . 0.31 109.814 -179.674 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' D' D ' 341' ' ' PHE . . . . . . . . . . . . . 39.3 m-85 -62.46 -51.99 65.28 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.146 -0.971 . . . . 0.18 109.757 -179.741 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' D' D ' 342' ' ' ARG . . . . . . . . . . . . . 9.7 ttm180 -47.69 -36.76 11.69 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.156 -0.965 . . . . 2.41 109.483 -179.926 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' D' D ' 343' ' ' GLU . . . . . . . . . . . . . 32.7 tt0 -58.91 -49.64 77.03 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.278 -0.889 . . . . 2.35 109.504 179.935 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' D' D ' 344' ' ' LEU . . . . . 0.615 HD22 HD22 ' C' ' 344' ' ' LEU . 57.5 mt -62.47 -32.37 73.25 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.177 -0.952 . . . . 0.19 109.453 -179.996 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' D' D ' 345' ' ' ASN . . . . . . . . . . . . . 9.6 t-20 -56.77 -54.93 40.6 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.266 -0.896 . . . . 1.09 109.63 -179.858 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' D' D ' 346' ' ' GLU . . . . . . . . . . . . . 44.0 tp10 -61.4 -31.61 71.53 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.258 -0.902 . . . . 1.69 109.755 -179.746 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' D' D ' 347' ' ' ALA . . . . . 0.854 ' HB1' ' HB1' ' C' ' 347' ' ' ALA . . . -59.93 -57.82 11.21 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.236 -0.915 . . . . 0.18 109.988 -179.709 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' D' D ' 348' ' ' LEU . . . . . 0.608 HD22 ' N ' ' D' ' 348' ' ' LEU . 4.2 mm? -61.53 -42.0 98.18 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.219 -0.926 . . . . 0.31 109.885 -179.664 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' D' D ' 349' ' ' GLU . . . . . . . . . . . . . 98.5 mt-10 -57.9 -35.12 70.59 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.245 -0.91 . . . . 1.95 109.943 -179.541 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' D' D ' 350' ' ' LEU . . . . . 0.794 HD13 ' CD2' ' C' ' 350' ' ' LEU . 5.7 tt -63.39 -46.37 86.73 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.125 -0.985 . . . . 0.43 109.603 -179.814 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' D' D ' 351' ' ' LYS . . . . . . . . . . . . . 42.4 tttt -59.48 -37.87 79.36 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.253 -0.904 . . . . 1.4 109.475 -179.996 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' D' D ' 352' ' ' ASP . . . . . . . . . . . . . 22.9 m-20 -55.76 -36.15 66.99 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.258 -0.901 . . . . 1.17 109.635 179.975 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' D' D ' 353' ' ' ALA . . . . . . . . . . . . . . . -66.95 -35.83 80.85 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.239 -0.913 . . . . 0.59 109.738 -179.739 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' D' D ' 354' ' ' GLN . . . . . . . . . . . . . 5.8 mt-30 -81.28 -3.88 53.85 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.229 -0.919 . . . . 1.44 109.595 -179.829 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' D' D ' 355' ' ' ALA . . . . . . . . . . . . . . . -70.97 -82.52 0.04 OUTLIER 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.239 -0.913 . . . . 0.98 109.579 179.926 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' D' D ' 356' ' ' GLY . . . . . . . . . . . . . . . -59.37 93.54 0.05 OUTLIER Glycine 0 N--CA 1.49 2.295 0 N-CA-C 109.651 -1.379 . . . . 1.28 109.651 -179.873 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' D' D ' 357' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -86.71 134.03 33.62 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.341 -1.093 . . . . 4.09 109.377 179.796 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' D' D ' 358' ' ' GLU . . . . . . . . . . . . . 18.9 tt0 -49.35 133.38 17.54 Favored Pre-proline 0 N--CA 1.491 1.597 0 O-C-N 121.231 -0.918 . . . . 5.71 109.457 -179.871 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' D' D ' 359' ' ' PRO . . . . . . . . . . . . . 2.2 Cg_endo -62.67 167.61 11.43 Favored 'Trans proline' 0 C--N 1.311 -1.421 0 C-N-CA 122.075 1.85 . . . . 4.97 110.168 -179.994 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' D' D ' 360' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.326 0 N-CA-C 109.483 -1.447 . . . . 6.97 109.483 179.921 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 319' ' ' LYS . . . . . . . . . . . . . 22.2 mttt . . . . . 0 N--CA 1.49 1.547 0 N-CA-C 109.596 -0.52 . . . . 7.55 109.596 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 320' ' ' LYS . . . . . . . . . . . . . 4.4 tttm 53.23 50.93 16.57 Favored 'General case' 0 N--CA 1.489 1.525 0 O-C-N 121.241 -0.912 . . . . 6.43 109.087 -179.997 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 321' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -157.47 84.6 2.84 Favored Pre-proline 0 N--CA 1.491 1.585 0 O-C-N 121.381 -0.824 . . . . 6.13 109.492 -179.786 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 322' ' ' PRO . . . . . . . . . . . . . 1.8 Cg_endo -68.68 -1.43 7.55 Favored 'Trans proline' 0 C--N 1.311 -1.43 0 C-N-CA 122.319 2.013 . . . . 2.83 110.567 179.722 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 323' ' ' LEU . . . . . . . . . . . . . 23.4 mt -84.16 47.6 1.35 Allowed 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.153 -0.967 . . . . 2.83 109.475 179.854 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 324' ' ' ASP . . . . . . . . . . . . . 49.4 m-20 -77.82 -175.76 4.1 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.261 -0.899 . . . . 1.53 109.349 -179.94 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 325' ' ' GLY . . . . . . . . . . . . . . . -68.61 -178.75 17.55 Favored Glycine 0 N--CA 1.489 2.172 0 N-CA-C 109.418 -1.473 . . . . 0.61 109.418 179.919 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 326' ' ' GLU . . . . . . . . . . . . . 20.8 mt-10 -58.46 -172.43 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.128 -1.219 . . . . 2.13 109.354 179.925 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 327' ' ' TYR . . . . . 0.588 ' CE1' ' HG2' ' C' ' 333' ' ' ARG . 48.0 m-85 -148.54 111.36 4.81 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.303 -0.873 . . . . 0.48 109.338 179.978 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 328' ' ' PHE . . . . . . . . . . . . . 94.5 m-85 -113.3 -169.88 1.58 Allowed 'General case' 0 N--CA 1.488 1.467 0 O-C-N 121.114 -0.991 . . . . 0.31 109.466 -179.706 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 329' ' ' THR . . . . . 0.502 ' HA ' ' O ' ' C' ' 330' ' ' LEU . 29.4 p -152.16 166.31 32.1 Favored 'General case' 0 C--N 1.303 -1.424 0 O-C-N 121.298 -0.876 . . . . 0.22 109.022 179.879 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 330' ' ' LEU . . . . . . . . . . . . . 49.2 tp -149.71 128.32 12.35 Favored 'General case' 0 C--N 1.303 -1.444 0 O-C-N 121.107 -0.996 . . . . 0.28 109.972 -179.396 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 331' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -86.74 109.92 19.55 Favored 'General case' 0 N--CA 1.488 1.471 0 O-C-N 121.321 -0.862 . . . . 0.91 109.184 179.681 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 332' ' ' ILE . . . . . 0.63 HD12 ' HD1' ' A' ' 338' ' ' PHE . 10.6 mt -103.65 108.44 24.54 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.536 0 O-C-N 121.203 -0.936 . . . . 0.26 109.766 -179.716 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 333' ' ' ARG . . . . . 0.52 ' HG2' ' CE1' ' C' ' 327' ' ' TYR . 37.8 mtm-85 -71.95 151.86 42.95 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.192 -0.942 . . . . 2.92 109.337 179.804 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 334' ' ' GLY . . . . . . . . . . . . . . . 79.8 129.85 0.77 Allowed Glycine 0 N--CA 1.491 2.335 0 N-CA-C 109.703 -1.359 . . . . 0.4 109.703 179.746 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 335' ' ' ARG . . . . . . . . . . . . . 9.6 ttm180 -79.92 -37.47 34.54 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.275 -1.132 . . . . 3.01 109.579 179.919 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 336' ' ' GLU . . . . . . . . . . . . . 4.2 mm-40 -57.15 -63.48 1.2 Allowed 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.325 -0.859 . . . . 2.29 109.807 -179.744 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 337' ' ' ARG . . . . . 0.442 HH11 ' HG2' ' A' ' 337' ' ' ARG . 5.0 mmt-85 -60.39 -30.44 69.59 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.266 -0.896 . . . . 2.93 109.788 -179.737 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 338' ' ' PHE . . . . . 0.63 ' HD1' HD12 ' A' ' 332' ' ' ILE . 25.8 t80 -55.26 -56.89 14.82 Favored 'General case' 0 N--CA 1.489 1.487 0 O-C-N 121.063 -1.023 . . . . 0.38 109.122 179.716 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 339' ' ' GLU . . . . . . . . . . . . . 32.1 mt-10 -51.32 -30.6 18.82 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.428 -0.795 . . . . 1.97 109.574 -179.755 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 340' ' ' MET . . . . . . . . . . . . . 41.5 ttp -63.66 -50.57 68.74 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.286 -0.884 . . . . 0.31 109.593 -179.834 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 341' ' ' PHE . . . . . 0.416 ' CZ ' ' HA ' ' C' ' 345' ' ' ASN . 75.7 m-85 -62.74 -46.49 87.81 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.205 -0.934 . . . . 0.18 109.718 -179.873 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 342' ' ' ARG . . . . . 0.453 HH11 ' HG3' ' A' ' 342' ' ' ARG . 0.3 OUTLIER -49.03 -42.69 39.11 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.257 -0.902 . . . . 2.42 109.987 -179.578 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 343' ' ' GLU . . . . . . . . . . . . . 25.1 tt0 -59.82 -44.62 93.94 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.38 -0.825 . . . . 2.35 109.846 -179.72 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 344' ' ' LEU . . . . . . . . . . . . . 41.1 mt -62.49 -36.01 81.17 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.1 -1.0 . . . . 0.18 109.933 -179.661 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 345' ' ' ASN . . . . . . . . . . . . . 63.8 t-20 -57.41 -54.66 44.34 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.298 -0.876 . . . . 1.09 109.906 -179.626 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 346' ' ' GLU . . . . . . . . . . . . . 83.5 tt0 -60.92 -30.33 70.13 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.139 -0.976 . . . . 1.65 109.946 -179.59 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 347' ' ' ALA . . . . . 0.876 ' HB1' ' HB1' ' B' ' 347' ' ' ALA . . . -60.58 -56.34 22.5 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.176 -0.953 . . . . 0.18 110.014 -179.616 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 348' ' ' LEU . . . . . 0.575 HD22 ' N ' ' A' ' 348' ' ' LEU . 3.9 mm? -61.33 -48.93 79.08 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.16 -0.962 . . . . 0.3 110.073 -179.398 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 349' ' ' GLU . . . . . . . . . . . . . 80.6 mm-40 -57.13 -30.27 64.26 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.24 -0.912 . . . . 1.94 110.127 -179.453 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 350' ' ' LEU . . . . . 0.73 ' O ' HD23 ' A' ' 350' ' ' LEU . 4.2 tt -64.28 -48.0 77.38 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.127 -0.983 . . . . 0.46 109.419 -179.984 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 351' ' ' LYS . . . . . . . . . . . . . 68.0 tttt -59.17 -48.83 80.15 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.277 -0.889 . . . . 1.4 109.538 -179.964 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 352' ' ' ASP . . . . . . . . . . . . . 3.4 m-20 -54.82 -29.36 54.62 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.251 -0.905 . . . . 1.16 109.478 -179.995 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 353' ' ' ALA . . . . . 0.436 ' O ' ' HB2' ' A' ' 357' ' ' LYS . . . -67.2 -37.98 84.56 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.276 -0.89 . . . . 0.63 109.512 179.945 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 354' ' ' GLN . . . . . . . . . . . . . 26.0 mt-30 -80.92 -2.42 47.53 Favored 'General case' 0 N--CA 1.488 1.461 0 O-C-N 121.252 -0.905 . . . . 1.47 109.475 -179.999 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 355' ' ' ALA . . . . . 0.411 ' O ' ' HG3' ' A' ' 358' ' ' GLU . . . -71.93 -71.65 0.27 Allowed 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.251 -0.906 . . . . 1.01 109.794 179.873 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 356' ' ' GLY . . . . . . . . . . . . . . . -73.54 0.9 47.08 Favored Glycine 0 N--CA 1.491 2.306 0 N-CA-C 110.315 -1.114 . . . . 1.3 110.315 -179.513 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 357' ' ' LYS . . . . . 0.436 ' HB2' ' O ' ' A' ' 353' ' ' ALA . 4.9 tptp -86.03 12.09 10.25 Favored 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.067 -1.255 . . . . 4.1 109.558 -180.0 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 358' ' ' GLU . . . . . 0.411 ' HG3' ' O ' ' A' ' 355' ' ' ALA . 23.6 mt-10 -49.86 149.17 4.87 Favored Pre-proline 0 N--CA 1.491 1.597 0 O-C-N 121.2 -0.938 . . . . 5.75 109.366 179.936 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 359' ' ' PRO . . . . . . . . . . . . . 1.2 Cg_endo -68.1 -5.01 13.68 Favored 'Trans proline' 0 C--N 1.309 -1.51 0 C-N-CA 122.202 1.934 . . . . 5.0 110.292 -179.868 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 360' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.286 0 CA-C-O 118.027 -1.43 . . . . 6.97 109.597 -179.903 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' B' B ' 319' ' ' LYS . . . . . . . . . . . . . 21.6 mttt . . . . . 0 N--CA 1.49 1.546 0 CA-C-O 121.251 0.548 . . . . 7.55 109.532 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' B' B ' 320' ' ' LYS . . . . . . . . . . . . . 4.6 tttm 53.73 49.86 18.32 Favored 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.216 -0.927 . . . . 6.44 109.265 179.954 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 321' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -156.3 85.02 3.17 Favored Pre-proline 0 N--CA 1.489 1.522 0 O-C-N 121.28 -0.887 . . . . 6.13 109.531 -179.748 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 322' ' ' PRO . . . . . . . . . . . . . 1.9 Cg_endo -68.55 -1.04 6.75 Favored 'Trans proline' 0 C--N 1.311 -1.397 0 C-N-CA 122.29 1.993 . . . . 2.82 110.695 179.879 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 323' ' ' LEU . . . . . . . . . . . . . 23.1 mt -84.35 47.14 1.3 Allowed 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.082 -1.011 . . . . 2.84 109.428 -179.931 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 324' ' ' ASP . . . . . . . . . . . . . 47.2 m-20 -77.93 -176.67 4.59 Favored 'General case' 0 N--CA 1.489 1.493 0 O-C-N 121.317 -0.864 . . . . 1.53 109.461 -179.807 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 325' ' ' GLY . . . . . . . . . . . . . . . -67.56 -179.27 13.86 Favored Glycine 0 N--CA 1.489 2.185 0 N-CA-C 109.417 -1.473 . . . . 0.59 109.417 179.935 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 326' ' ' GLU . . . . . . . . . . . . . 20.0 mt-10 -58.33 -172.47 0.01 OUTLIER 'General case' 0 N--CA 1.488 1.475 0 O-C-N 121.174 -1.192 . . . . 2.13 109.449 179.836 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 327' ' ' TYR . . . . . 0.473 ' CE1' ' HG2' ' D' ' 333' ' ' ARG . 48.7 m-85 -148.86 112.04 4.93 Favored 'General case' 0 N--CA 1.488 1.454 0 O-C-N 121.286 -0.884 . . . . 0.48 109.322 179.891 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 328' ' ' PHE . . . . . 0.4 ' CE1' ' HB2' ' D' ' 335' ' ' ARG . 94.0 m-85 -113.5 -169.45 1.5 Allowed 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.246 -0.908 . . . . 0.32 109.514 -179.865 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 329' ' ' THR . . . . . . . . . . . . . 29.6 p -152.64 166.46 32.04 Favored 'General case' 0 N--CA 1.487 1.42 0 O-C-N 121.274 -0.891 . . . . 0.23 109.055 179.771 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 330' ' ' LEU . . . . . 0.547 HD11 HD22 ' D' ' 345' ' ' ASN . 49.3 tp -149.87 128.85 12.61 Favored 'General case' 0 C--N 1.302 -1.473 0 O-C-N 121.033 -1.042 . . . . 0.28 109.812 -179.46 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 331' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -87.3 109.69 19.69 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.398 -0.813 . . . . 0.91 109.184 179.773 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 332' ' ' ILE . . . . . 0.61 HD12 ' HD1' ' B' ' 338' ' ' PHE . 10.3 mt -103.61 108.67 25.03 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.499 0 O-C-N 121.16 -0.962 . . . . 0.24 109.778 -179.686 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 333' ' ' ARG . . . . . 0.504 ' NH1' ' HG3' ' B' ' 333' ' ' ARG . 39.3 mtm-85 -71.93 152.24 42.69 Favored 'General case' 0 N--CA 1.488 1.455 0 O-C-N 121.312 -0.868 . . . . 2.93 109.387 179.73 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 334' ' ' GLY . . . . . . . . . . . . . . . 78.46 129.83 0.57 Allowed Glycine 0 N--CA 1.49 2.236 0 N-CA-C 109.719 -1.352 . . . . 0.4 109.719 179.811 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 335' ' ' ARG . . . . . . . . . . . . . 9.6 ttm180 -79.77 -37.99 34.15 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.29 -1.123 . . . . 3.01 109.65 -179.938 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 336' ' ' GLU . . . . . . . . . . . . . 4.5 mm-40 -56.21 -63.68 1.11 Allowed 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.232 -0.917 . . . . 2.28 109.783 -179.8 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 337' ' ' ARG . . . . . 0.447 HH11 ' HG2' ' B' ' 337' ' ' ARG . 4.7 mmt-85 -60.53 -30.44 69.74 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.282 -0.886 . . . . 2.93 109.608 -179.634 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 338' ' ' PHE . . . . . 0.61 ' HD1' HD12 ' B' ' 332' ' ' ILE . 25.6 t80 -55.09 -57.49 11.51 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.185 -0.947 . . . . 0.37 109.015 179.599 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 339' ' ' GLU . . . . . . . . . . . . . 31.5 mt-10 -50.76 -30.78 14.92 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.313 -0.867 . . . . 1.98 109.695 -179.82 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 340' ' ' MET . . . . . . . . . . . . . 41.5 ttp -63.54 -50.94 67.57 Favored 'General case' 0 N--CA 1.488 1.468 0 O-C-N 121.325 -0.859 . . . . 0.32 109.58 -179.93 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 341' ' ' PHE . . . . . . . . . . . . . 76.6 m-85 -62.35 -46.78 87.11 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.086 -1.009 . . . . 0.18 109.685 -179.905 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 342' ' ' ARG . . . . . 0.452 ' HG3' HH11 ' B' ' 342' ' ' ARG . 0.2 OUTLIER -48.41 -43.37 34.07 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.294 -0.878 . . . . 2.42 109.795 -179.612 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' B' B ' 343' ' ' GLU . . . . . . . . . . . . . 26.0 tt0 -59.42 -44.79 92.81 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.298 -0.876 . . . . 2.35 109.895 -179.569 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 344' ' ' LEU . . . . . . . . . . . . . 41.2 mt -62.17 -36.47 81.97 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.197 -0.939 . . . . 0.18 109.889 -179.618 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 345' ' ' ASN . . . . . 0.425 ' HA ' ' CZ ' ' D' ' 341' ' ' PHE . 62.7 t-20 -57.05 -54.86 41.98 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.203 -0.935 . . . . 1.09 109.982 -179.669 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 346' ' ' GLU . . . . . . . . . . . . . 83.7 tt0 -61.06 -30.49 70.36 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.14 -0.975 . . . . 1.66 109.842 -179.472 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 347' ' ' ALA . . . . . 0.876 ' HB1' ' HB1' ' A' ' 347' ' ' ALA . . . -60.31 -56.29 23.35 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.2 -0.937 . . . . 0.17 110.116 -179.741 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 348' ' ' LEU . . . . . 0.585 HD22 ' N ' ' B' ' 348' ' ' LEU . 3.9 mm? -61.66 -48.4 81.02 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.087 -1.008 . . . . 0.29 110.06 -179.366 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 349' ' ' GLU . . . . . . . . . . . . . 80.8 mm-40 -57.32 -30.66 64.95 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.158 -0.964 . . . . 1.95 110.079 -179.351 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 350' ' ' LEU . . . . . 0.731 ' O ' HD23 ' B' ' 350' ' ' LEU . 4.2 tt -63.95 -47.98 78.3 Favored 'General case' 0 C--N 1.302 -1.465 0 O-C-N 121.204 -0.935 . . . . 0.45 109.398 -179.909 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 351' ' ' LYS . . . . . . . . . . . . . 68.3 tttt -59.15 -48.35 81.92 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.331 -0.856 . . . . 1.38 109.566 -179.973 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 352' ' ' ASP . . . . . . . . . . . . . 3.2 m-20 -55.26 -29.68 58.58 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.243 -0.911 . . . . 1.16 109.371 179.988 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 353' ' ' ALA . . . . . 0.449 ' O ' ' HB2' ' B' ' 357' ' ' LYS . . . -66.74 -38.3 86.38 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.329 -0.857 . . . . 0.61 109.487 -179.967 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 354' ' ' GLN . . . . . . . . . . . . . 25.6 mt-30 -80.75 -1.97 45.02 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.236 -0.915 . . . . 1.45 109.467 179.863 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 355' ' ' ALA . . . . . 0.4 ' O ' ' HG3' ' B' ' 358' ' ' GLU . . . -72.21 -71.36 0.29 Allowed 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.238 -0.914 . . . . 0.98 109.633 179.972 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 356' ' ' GLY . . . . . . . . . . . . . . . -73.7 1.04 47.49 Favored Glycine 0 N--CA 1.494 2.546 0 N-CA-C 110.201 -1.16 . . . . 1.29 110.201 -179.561 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 357' ' ' LYS . . . . . 0.449 ' HB2' ' O ' ' B' ' 353' ' ' ALA . 4.8 tptp -86.24 12.44 9.86 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 120.931 -1.334 . . . . 4.09 109.596 -179.984 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 358' ' ' GLU . . . . . 0.4 ' HG3' ' O ' ' B' ' 355' ' ' ALA . 21.5 mt-10 -50.19 149.23 5.35 Favored Pre-proline 0 N--CA 1.489 1.52 0 O-C-N 121.127 -0.983 . . . . 5.72 109.423 179.888 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 359' ' ' PRO . . . . . . . . . . . . . 1.2 Cg_endo -68.08 -5.09 13.86 Favored 'Trans proline' 0 C--N 1.31 -1.5 0 C-N-CA 122.208 1.939 . . . . 4.98 110.35 179.918 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 360' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 2.37 0 CA-C-O 118.009 -1.44 . . . . 6.98 109.619 -179.973 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' C' C ' 319' ' ' LYS . . . . . 0.473 ' O ' ' O ' ' C' ' 320' ' ' LYS . 14.2 ttpt . . . . . 0 N--CA 1.489 1.511 0 N-CA-C 109.372 -0.603 . . . . 6.82 109.372 . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' C' C ' 320' ' ' LYS . . . . . 0.516 ' O ' ' HD3' ' C' ' 322' ' ' PRO . 17.0 ttpp 59.71 120.91 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.364 -0.835 . . . . 6.49 109.371 179.943 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' C' C ' 321' ' ' LYS . . . . . . . . . . . . . 20.5 mtmt -83.61 112.4 39.47 Favored Pre-proline 0 N--CA 1.492 1.647 0 O-C-N 121.347 -0.846 . . . . 6.4 109.783 -179.855 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' C' C ' 322' ' ' PRO . . . . . 0.516 ' HD3' ' O ' ' C' ' 320' ' ' LYS . 3.9 Cg_endo -70.22 170.79 16.3 Favored 'Trans proline' 0 C--N 1.312 -1.375 0 C-N-CA 121.95 1.767 . . . . 3.42 110.038 179.859 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' C' C ' 323' ' ' LEU . . . . . . . . . . . . . 35.7 mt -80.53 104.98 11.44 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.158 -0.963 . . . . 3.95 108.845 179.323 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' C' C ' 324' ' ' ASP . . . . . 0.423 ' OD1' ' N ' ' C' ' 324' ' ' ASP . 0.7 OUTLIER -78.58 153.15 31.42 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.222 -0.924 . . . . 1.63 109.376 -179.546 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' C' C ' 325' ' ' GLY . . . . . . . . . . . . . . . -68.51 -177.16 12.81 Favored Glycine 0 N--CA 1.489 2.198 0 N-CA-C 109.525 -1.43 . . . . 0.73 109.525 -179.82 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' C' C ' 326' ' ' GLU . . . . . . . . . . . . . 34.3 mt-10 -58.18 -175.87 0.02 OUTLIER 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.369 -1.077 . . . . 2.17 109.608 -179.782 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' C' C ' 327' ' ' TYR . . . . . 0.52 ' CE1' ' HG2' ' A' ' 333' ' ' ARG . 39.1 m-85 -148.11 111.41 4.93 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.387 -0.82 . . . . 0.48 109.399 179.973 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' C' C ' 328' ' ' PHE . . . . . 0.4 ' O ' HG23 ' C' ' 329' ' ' THR . 97.8 m-85 -113.98 -168.16 1.31 Allowed 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.155 -0.966 . . . . 0.33 109.629 -179.978 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' C' C ' 329' ' ' THR . . . . . 0.4 HG23 ' O ' ' C' ' 328' ' ' PHE . 9.4 p -153.13 165.83 34.4 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.392 -0.818 . . . . 0.23 108.962 -179.99 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' C' C ' 330' ' ' LEU . . . . . 0.502 ' O ' ' HA ' ' A' ' 329' ' ' THR . 16.3 tp -151.94 126.31 9.36 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.202 -0.936 . . . . 0.28 109.858 -179.521 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' C' C ' 331' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -85.89 118.65 25.51 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.298 -0.876 . . . . 1.48 109.044 179.433 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' C' C ' 332' ' ' ILE . . . . . . . . . . . . . 83.1 mt -103.45 109.86 28.24 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.508 0 O-C-N 121.163 -0.961 . . . . 0.24 110.111 -179.452 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' C' C ' 333' ' ' ARG . . . . . 0.588 ' HG2' ' CE1' ' A' ' 327' ' ' TYR . 10.9 mtt180 -72.8 128.74 36.41 Favored 'General case' 0 N--CA 1.489 1.479 0 O-C-N 121.284 -0.885 . . . . 2.74 109.289 179.674 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' C' C ' 334' ' ' GLY . . . . . . . . . . . . . . . 101.46 131.56 7.43 Favored Glycine 0 N--CA 1.489 2.212 0 N-CA-C 109.426 -1.47 . . . . 0.35 109.426 -179.913 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' C' C ' 335' ' ' ARG . . . . . 0.484 ' O ' ' HB3' ' C' ' 338' ' ' PHE . 12.1 ttt180 -80.42 -37.28 32.4 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.239 -1.154 . . . . 2.53 109.991 -179.653 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' C' C ' 336' ' ' GLU . . . . . . . . . . . . . 6.2 mm-40 -58.51 -57.15 14.22 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.052 -1.03 . . . . 2.62 109.943 -179.586 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' C' C ' 337' ' ' ARG . . . . . . . . . . . . . 2.0 mtp180 -59.96 -24.61 64.55 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.235 -0.916 . . . . 2.81 109.629 -179.603 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' C' C ' 338' ' ' PHE . . . . . 0.484 ' HB3' ' O ' ' C' ' 335' ' ' ARG . 85.3 t80 -54.95 -63.08 1.27 Allowed 'General case' 0 N--CA 1.489 1.489 0 O-C-N 121.289 -0.882 . . . . 0.4 109.387 -179.973 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' C' C ' 339' ' ' GLU . . . . . . . . . . . . . 42.5 mt-10 -50.03 -30.17 10.18 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.287 -0.883 . . . . 2.05 109.917 -179.68 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' C' C ' 340' ' ' MET . . . . . . . . . . . . . 27.4 ttp -64.22 -55.95 18.04 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.169 -0.957 . . . . 0.32 110.051 -179.882 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' C' C ' 341' ' ' PHE . . . . . . . . . . . . . 52.9 m-85 -62.32 -51.4 67.8 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.157 -0.965 . . . . 0.18 109.76 -179.51 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' C' C ' 342' ' ' ARG . . . . . . . . . . . . . 2.7 ttp180 -45.49 -40.85 8.93 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.268 -0.895 . . . . 2.91 109.577 179.999 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' C' C ' 343' ' ' GLU . . . . . . . . . . . . . 16.9 tt0 -60.5 -48.62 80.95 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.208 -0.932 . . . . 2.14 110.297 -179.637 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' C' C ' 344' ' ' LEU . . . . . 0.48 HD22 ' CD2' ' D' ' 344' ' ' LEU . 37.5 mt -60.51 -42.43 96.4 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 120.937 -1.102 . . . . 0.22 109.852 -179.481 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' C' C ' 345' ' ' ASN . . . . . 0.416 ' HA ' ' CZ ' ' A' ' 341' ' ' PHE . 44.4 t-20 -56.03 -47.9 76.97 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.161 -0.962 . . . . 1.08 109.436 179.906 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' C' C ' 346' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -62.42 -37.31 85.36 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.173 -0.955 . . . . 2.21 109.785 -179.756 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' C' C ' 347' ' ' ALA . . . . . 0.775 ' HB1' ' HB1' ' D' ' 347' ' ' ALA . . . -59.04 -55.4 35.53 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.137 -0.977 . . . . 0.18 110.251 -179.664 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' C' C ' 348' ' ' LEU . . . . . 0.604 HD22 ' N ' ' C' ' 348' ' ' LEU . 4.1 mm? -60.13 -38.62 83.61 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.109 -0.994 . . . . 0.32 109.548 -179.578 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' C' C ' 349' ' ' GLU . . . . . . . . . . . . . 89.3 mt-10 -59.0 -41.68 88.25 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.352 -0.842 . . . . 2.19 110.206 -179.481 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' C' C ' 350' ' ' LEU . . . . . 0.687 HD22 HD13 ' D' ' 350' ' ' LEU . 6.6 tt -63.21 -40.77 98.43 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.216 -0.928 . . . . 0.46 110.022 -179.439 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' C' C ' 351' ' ' LYS . . . . . . . . . . . . . 2.8 tttm -59.38 -41.27 88.95 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.242 -0.911 . . . . 1.35 109.886 -179.602 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' C' C ' 352' ' ' ASP . . . . . . . . . . . . . 3.1 m-20 -56.08 -41.11 74.62 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.171 -0.955 . . . . 1.19 110.064 -179.774 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' C' C ' 353' ' ' ALA . . . . . . . . . . . . . . . -67.91 -25.37 65.45 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.219 -0.926 . . . . 0.57 109.578 -179.881 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' C' C ' 354' ' ' GLN . . . . . 0.464 ' O ' ' CG ' ' C' ' 354' ' ' GLN . 7.1 tt0 -80.77 -2.3 46.46 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.348 -0.845 . . . . 1.47 109.582 179.995 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' C' C ' 355' ' ' ALA . . . . . . . . . . . . . . . -69.29 -81.0 0.04 OUTLIER 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.27 -0.893 . . . . 0.93 109.563 179.927 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' C' C ' 356' ' ' GLY . . . . . . . . . . . . . . . -64.79 96.89 0.23 Allowed Glycine 0 N--CA 1.491 2.319 0 N-CA-C 109.998 -1.241 . . . . 1.33 109.998 -179.64 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' C' C ' 357' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -89.7 131.43 35.68 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.319 -1.106 . . . . 4.01 109.617 179.713 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' C' C ' 358' ' ' GLU . . . . . . . . . . . . . 4.9 mt-10 -52.17 116.52 8.55 Favored Pre-proline 0 N--CA 1.492 1.661 0 O-C-N 121.279 -0.888 . . . . 5.75 109.919 179.874 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' C' C ' 359' ' ' PRO . . . . . . . . . . . . . 2.2 Cg_endo -63.51 -153.32 0.02 OUTLIER 'Trans proline' 0 C--N 1.314 -1.286 0 C-N-CA 122.072 1.848 . . . . 4.94 110.218 179.704 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' C' C ' 360' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.318 0 CA-C-O 118.009 -1.44 . . . . 6.5 109.584 179.904 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' D' D ' 319' ' ' LYS . . . . . . . . . . . . . 21.1 mttt . . . . . 0 N--CA 1.49 1.568 0 CA-C-O 121.26 0.552 . . . . 7.53 109.562 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' D' D ' 320' ' ' LYS . . . . . . . . . . . . . 4.5 tttm 53.34 51.08 16.12 Favored 'General case' 0 N--CA 1.488 1.449 0 O-C-N 121.262 -0.899 . . . . 6.41 109.041 -179.969 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' D' D ' 321' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -157.24 85.21 2.85 Favored Pre-proline 0 N--CA 1.49 1.573 0 O-C-N 121.361 -0.837 . . . . 6.11 109.598 -179.848 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' D' D ' 322' ' ' PRO . . . . . . . . . . . . . 1.8 Cg_endo -68.73 -1.08 6.98 Favored 'Trans proline' 0 C--N 1.31 -1.448 0 C-N-CA 122.438 2.092 . . . . 2.82 110.598 179.923 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' D' D ' 323' ' ' LEU . . . . . . . . . . . . . 22.3 mt -84.15 46.73 1.23 Allowed 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.086 -1.009 . . . . 2.83 109.496 179.865 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' D' D ' 324' ' ' ASP . . . . . . . . . . . . . 45.2 m-20 -77.64 -176.23 4.23 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.2 -0.938 . . . . 1.54 109.515 -179.811 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' D' D ' 325' ' ' GLY . . . . . . . . . . . . . . . -68.21 -178.77 15.82 Favored Glycine 0 N--CA 1.491 2.306 0 N-CA-C 109.337 -1.505 . . . . 0.59 109.337 179.943 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' D' D ' 326' ' ' GLU . . . . . . . . . . . . . 19.7 mt-10 -58.76 -172.38 0.01 OUTLIER 'General case' 0 C--N 1.302 -1.489 0 O-C-N 121.263 -1.139 . . . . 2.13 109.566 -179.996 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' D' D ' 327' ' ' TYR . . . . . 0.468 ' CE1' ' HG2' ' B' ' 333' ' ' ARG . 49.9 m-85 -148.84 111.7 4.84 Favored 'General case' 0 N--CA 1.488 1.455 0 O-C-N 121.167 -0.958 . . . . 0.47 109.285 179.935 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' D' D ' 328' ' ' PHE . . . . . . . . . . . . . 94.4 m-85 -113.45 -169.5 1.51 Allowed 'General case' 0 N--CA 1.487 1.405 0 O-C-N 121.337 -0.852 . . . . 0.3 109.459 -179.859 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' D' D ' 329' ' ' THR . . . . . 0.412 ' HA ' ' O ' ' B' ' 330' ' ' LEU . 25.7 p -152.69 166.95 30.54 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.285 -0.885 . . . . 0.22 108.937 179.953 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' D' D ' 330' ' ' LEU . . . . . 0.407 HD21 ' HB2' ' B' ' 345' ' ' ASN . 49.2 tp -150.1 128.51 12.17 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.151 -0.968 . . . . 0.28 109.737 -179.441 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' D' D ' 331' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -86.95 109.74 19.56 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.231 -0.918 . . . . 0.93 109.134 179.632 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' D' D ' 332' ' ' ILE . . . . . 0.608 HD12 ' HD1' ' D' ' 338' ' ' PHE . 10.7 mt -103.62 108.55 24.76 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.539 0 O-C-N 121.201 -0.937 . . . . 0.25 109.765 -179.647 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' D' D ' 333' ' ' ARG . . . . . 0.52 ' NH1' ' HG3' ' D' ' 333' ' ' ARG . 39.0 mtm-85 -72.0 152.51 42.41 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.267 -0.895 . . . . 2.93 109.375 179.736 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' D' D ' 334' ' ' GLY . . . . . . . . . . . . . . . 78.41 129.73 0.56 Allowed Glycine 0 N--CA 1.492 2.405 0 N-CA-C 109.635 -1.386 . . . . 0.41 109.635 179.889 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' D' D ' 335' ' ' ARG . . . . . 0.4 ' HB2' ' CE1' ' B' ' 328' ' ' PHE . 9.6 ttm180 -80.1 -37.04 34.52 Favored 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.343 -1.092 . . . . 3.03 109.421 -179.937 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' D' D ' 336' ' ' GLU . . . . . . . . . . . . . 4.7 mm-40 -56.76 -63.88 1.06 Allowed 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.254 -0.904 . . . . 2.26 109.726 -179.788 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' D' D ' 337' ' ' ARG . . . . . 0.443 HH11 ' HG2' ' D' ' 337' ' ' ARG . 5.5 mmt-85 -60.34 -29.93 69.2 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.201 -0.937 . . . . 2.92 109.803 -179.557 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' D' D ' 338' ' ' PHE . . . . . 0.608 ' HD1' HD12 ' D' ' 332' ' ' ILE . 25.7 t80 -55.82 -57.52 11.72 Favored 'General case' 0 N--CA 1.489 1.492 0 O-C-N 121.242 -0.911 . . . . 0.37 108.909 179.745 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' D' D ' 339' ' ' GLU . . . . . . . . . . . . . 31.0 mt-10 -50.48 -30.93 13.93 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.25 -0.906 . . . . 1.99 109.665 -179.961 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' D' D ' 340' ' ' MET . . . . . . . . . . . . . 41.8 ttp -63.26 -50.96 68.13 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.2 -0.937 . . . . 0.31 109.696 -179.811 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' D' D ' 341' ' ' PHE . . . . . 0.425 ' CZ ' ' HA ' ' B' ' 345' ' ' ASN . 76.8 m-85 -62.35 -46.67 87.63 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.258 -0.901 . . . . 0.18 109.661 -179.887 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' D' D ' 342' ' ' ARG . . . . . 0.446 ' HG3' HH11 ' D' ' 342' ' ' ARG . 0.2 OUTLIER -48.43 -43.63 34.52 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.348 -0.845 . . . . 2.41 109.871 -179.611 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' D' D ' 343' ' ' GLU . . . . . . . . . . . . . 26.2 tt0 -59.24 -44.56 92.34 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.223 -0.923 . . . . 2.35 109.976 -179.595 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' D' D ' 344' ' ' LEU . . . . . 0.48 ' CD2' HD22 ' C' ' 344' ' ' LEU . 42.2 mt -62.41 -36.38 82.16 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.239 -0.913 . . . . 0.19 109.879 -179.654 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' D' D ' 345' ' ' ASN . . . . . 0.547 HD22 HD11 ' B' ' 330' ' ' LEU . 62.3 t-20 -57.53 -54.71 43.78 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.221 -0.925 . . . . 1.09 109.923 -179.614 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' D' D ' 346' ' ' GLU . . . . . . . . . . . . . 84.3 tt0 -61.1 -30.33 70.29 Favored 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.127 -0.983 . . . . 1.69 109.815 -179.605 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' D' D ' 347' ' ' ALA . . . . . 0.775 ' HB1' ' HB1' ' C' ' 347' ' ' ALA . . . -60.6 -56.22 23.93 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.117 -0.989 . . . . 0.18 110.056 -179.652 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' D' D ' 348' ' ' LEU . . . . . 0.596 HD22 ' N ' ' D' ' 348' ' ' LEU . 3.9 mm? -61.54 -48.73 79.69 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.235 -0.915 . . . . 0.31 109.979 -179.491 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' D' D ' 349' ' ' GLU . . . . . . . . . . . . . 80.8 mm-40 -57.2 -30.21 64.36 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.114 -0.991 . . . . 1.95 110.068 -179.317 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' D' D ' 350' ' ' LEU . . . . . 0.722 ' O ' HD23 ' D' ' 350' ' ' LEU . 4.2 tt -64.09 -48.19 77.14 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.03 -1.044 . . . . 0.43 109.34 179.945 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' D' D ' 351' ' ' LYS . . . . . . . . . . . . . 68.5 tttt -58.95 -48.43 81.53 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.287 -0.883 . . . . 1.4 109.551 -179.899 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' D' D ' 352' ' ' ASP . . . . . . . . . . . . . 3.1 m-20 -55.15 -29.24 57.38 Favored 'General case' 0 N--CA 1.488 1.467 0 O-C-N 121.217 -0.927 . . . . 1.17 109.478 179.963 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' D' D ' 353' ' ' ALA . . . . . 0.445 ' O ' ' HB2' ' D' ' 357' ' ' LYS . . . -67.33 -38.23 84.57 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.271 -0.893 . . . . 0.59 109.47 179.968 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' D' D ' 354' ' ' GLN . . . . . 0.554 ' NE2' HD11 ' C' ' 350' ' ' LEU . 25.5 mt-30 -80.94 -1.84 45.25 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.222 -0.924 . . . . 1.44 109.453 179.995 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' D' D ' 355' ' ' ALA . . . . . 0.404 ' O ' ' HG3' ' D' ' 358' ' ' GLU . . . -72.12 -71.58 0.27 Allowed 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.36 -0.838 . . . . 0.98 109.62 179.837 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' D' D ' 356' ' ' GLY . . . . . . . . . . . . . . . -73.9 1.91 44.5 Favored Glycine 0 N--CA 1.492 2.39 0 N-CA-C 110.173 -1.171 . . . . 1.28 110.173 -179.504 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' D' D ' 357' ' ' LYS . . . . . 0.445 ' HB2' ' O ' ' D' ' 353' ' ' ALA . 5.0 tptp -86.96 12.32 11.49 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.03 -1.276 . . . . 4.09 109.452 179.988 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' D' D ' 358' ' ' GLU . . . . . 0.404 ' HG3' ' O ' ' D' ' 355' ' ' ALA . 19.6 mt-10 -49.95 149.17 5.02 Favored Pre-proline 0 N--CA 1.49 1.548 0 O-C-N 121.214 -0.929 . . . . 5.71 109.378 179.967 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' D' D ' 359' ' ' PRO . . . . . . . . . . . . . 1.3 Cg_endo -68.28 -4.46 12.81 Favored 'Trans proline' 0 C--N 1.309 -1.505 0 C-N-CA 122.247 1.965 . . . . 4.97 110.33 -179.935 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' D' D ' 360' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.182 0 CA-C-O 118.049 -1.417 . . . . 6.97 109.601 -179.963 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 319' ' ' LYS . . . . . 0.443 ' O ' ' HB2' ' A' ' 320' ' ' LYS . 4.8 mmtp . . . . . 0 N--CA 1.491 1.577 0 N-CA-C 109.576 -0.527 . . . . 7.55 109.576 . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 320' ' ' LYS . . . . . 0.443 ' HB2' ' O ' ' A' ' 319' ' ' LYS . 19.0 mttt 61.66 -168.45 0.18 Allowed 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.334 -0.854 . . . . 6.43 109.434 -179.961 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 321' ' ' LYS . . . . . . . . . . . . . 9.5 mttt -158.51 71.14 3.82 Favored Pre-proline 0 N--CA 1.49 1.537 0 O-C-N 121.34 -0.85 . . . . 6.13 109.516 179.954 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 322' ' ' PRO . . . . . . . . . . . . . 4.1 Cg_exo -60.26 136.93 71.63 Favored 'Trans proline' 0 C--N 1.309 -1.535 0 C-N-CA 122.083 1.855 . . . . 2.83 110.169 179.923 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 323' ' ' LEU . . . . . . . . . . . . . 30.2 mt -80.5 115.24 19.92 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.268 -0.895 . . . . 2.83 109.337 179.984 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 324' ' ' ASP . . . . . . . . . . . . . 4.7 m-20 -79.36 144.41 34.21 Favored 'General case' 0 C--N 1.304 -1.404 0 O-C-N 121.268 -0.895 . . . . 1.53 109.358 179.909 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 325' ' ' GLY . . . . . 0.414 ' O ' ' CE2' ' A' ' 327' ' ' TYR . . . -68.34 177.37 25.3 Favored Glycine 0 N--CA 1.487 2.093 0 N-CA-C 109.181 -1.568 . . . . 0.61 109.181 179.941 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 326' ' ' GLU . . . . . . . . . . . . . 66.9 mm-40 -56.35 179.21 0.04 OUTLIER 'General case' 0 N--CA 1.489 1.489 0 O-C-N 121.172 -1.193 . . . . 2.13 109.312 -179.917 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 327' ' ' TYR . . . . . 0.605 ' CE1' ' CG ' ' C' ' 333' ' ' ARG . 43.1 m-85 -148.75 95.27 2.39 Favored 'General case' 0 N--CA 1.488 1.446 0 O-C-N 121.249 -0.907 . . . . 0.48 109.557 -179.898 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 328' ' ' PHE . . . . . . . . . . . . . 84.7 m-85 -103.35 -162.48 0.91 Allowed 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.255 -0.903 . . . . 0.31 109.62 -179.991 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 329' ' ' THR . . . . . . . . . . . . . 40.8 p -154.12 166.91 31.6 Favored 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.365 -0.834 . . . . 0.22 109.11 179.855 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 330' ' ' LEU . . . . . . . . . . . . . 18.9 tp -149.96 126.61 10.96 Favored 'General case' 0 N--CA 1.488 1.46 0 O-C-N 121.097 -1.002 . . . . 0.28 110.064 -179.561 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 331' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -88.07 112.62 22.86 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.353 -0.842 . . . . 0.91 108.95 179.399 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 332' ' ' ILE . . . . . 0.578 HG21 ' HA ' ' A' ' 338' ' ' PHE . 50.5 mt -103.49 109.45 27.06 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.595 0 O-C-N 121.216 -0.928 . . . . 0.26 109.792 -179.716 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 333' ' ' ARG . . . . . 0.542 ' HG2' ' CE1' ' C' ' 327' ' ' TYR . 80.8 mtt180 -72.73 149.46 43.71 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.37 -0.831 . . . . 2.92 109.449 179.803 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 334' ' ' GLY . . . . . . . . . . . . . . . 82.03 124.69 0.78 Allowed Glycine 0 N--CA 1.491 2.307 0 N-CA-C 109.398 -1.481 . . . . 0.4 109.398 -179.894 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 335' ' ' ARG . . . . . . . . . . . . . 60.6 ttt180 -75.53 -33.42 60.71 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.318 -1.107 . . . . 3.01 109.542 -179.894 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 336' ' ' GLU . . . . . . . . . . . . . 62.8 tt0 -58.32 -61.84 2.27 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.267 -0.896 . . . . 2.29 109.768 -179.886 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 337' ' ' ARG . . . . . 0.654 ' NH2' HD12 ' C' ' 348' ' ' LEU . 8.2 mmt180 -62.1 -33.18 73.95 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.122 -0.987 . . . . 2.93 109.783 -179.739 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 338' ' ' PHE . . . . . 0.578 ' HA ' HG21 ' A' ' 332' ' ' ILE . 45.7 t80 -54.38 -57.02 12.87 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.123 -0.986 . . . . 0.38 109.753 -179.631 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 339' ' ' GLU . . . . . . . . . . . . . 41.6 mt-10 -51.09 -35.1 33.37 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.234 -0.916 . . . . 1.97 109.989 -179.699 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 340' ' ' MET . . . . . . . . . . . . . 48.5 ttp -63.61 -49.14 74.47 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.262 -0.899 . . . . 0.31 110.092 -179.56 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 341' ' ' PHE . . . . . . . . . . . . . 44.3 m-85 -61.83 -45.97 91.51 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.239 -0.913 . . . . 0.18 109.835 -179.456 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 342' ' ' ARG . . . . . . . . . . . . . 5.7 ttt180 -49.91 -42.26 47.73 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.167 -0.958 . . . . 2.42 110.06 -179.658 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 343' ' ' GLU . . . . . . . . . . . . . 1.2 tp10 -59.04 -49.85 76.33 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.144 -0.972 . . . . 2.35 109.886 -179.613 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 344' ' ' LEU . . . . . 0.439 HD22 HD22 ' B' ' 344' ' ' LEU . 61.5 mt -59.94 -30.95 69.42 Favored 'General case' 0 N--CA 1.489 1.495 0 O-C-N 121.222 -0.924 . . . . 0.18 109.403 -179.737 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 345' ' ' ASN . . . . . 0.706 HD22 HD11 ' C' ' 330' ' ' LEU . 64.4 t-20 -58.41 -59.3 5.56 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.271 -0.893 . . . . 1.09 109.74 -179.98 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 346' ' ' GLU . . . . . 0.465 ' OE1' ' NZ ' ' B' ' 351' ' ' LYS . 1.0 OUTLIER -61.48 -26.29 67.8 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.234 -0.917 . . . . 1.65 109.884 -179.577 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 347' ' ' ALA . . . . . 0.478 ' HB1' ' HB1' ' B' ' 347' ' ' ALA . . . -60.79 -57.93 10.59 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.173 -0.954 . . . . 0.18 110.018 -179.74 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 348' ' ' LEU . . . . . 0.592 HD22 ' N ' ' A' ' 348' ' ' LEU . 4.1 mm? -61.94 -44.5 96.63 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.211 -0.931 . . . . 0.3 110.122 -179.38 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 349' ' ' GLU . . . . . . . . . . . . . 12.0 mm-40 -58.34 -33.34 69.43 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.123 -0.985 . . . . 1.94 109.939 -179.462 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 350' ' ' LEU . . . . . 0.872 HD11 ' NE2' ' B' ' 354' ' ' GLN . 5.1 tt -64.47 -43.51 93.98 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.225 -0.922 . . . . 0.46 109.843 -179.761 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 351' ' ' LYS . . . . . 0.44 ' NZ ' ' OE1' ' B' ' 346' ' ' GLU . 19.8 tttp -59.15 -45.11 91.82 Favored 'General case' 0 N--CA 1.489 1.499 0 O-C-N 121.337 -0.852 . . . . 1.4 109.961 -179.643 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 352' ' ' ASP . . . . . . . . . . . . . 36.1 m-20 -58.66 -49.03 79.04 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.233 -0.917 . . . . 1.16 110.265 -179.584 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 353' ' ' ALA . . . . . . . . . . . . . . . -65.99 -11.05 45.11 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.087 -1.008 . . . . 0.63 109.893 -179.31 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 354' ' ' GLN . . . . . 0.825 ' NE2' HD11 ' B' ' 350' ' ' LEU . 1.7 mt-30 -83.98 -54.2 5.02 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.228 -0.92 . . . . 1.47 109.55 179.765 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 355' ' ' ALA . . . . . . . . . . . . . . . -71.41 -3.94 23.63 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.36 -0.838 . . . . 1.01 109.962 -179.731 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 356' ' ' GLY . . . . . . . . . . . . . . . -80.44 -9.03 86.97 Favored Glycine 0 N--CA 1.491 2.32 0 N-CA-C 109.763 -1.335 . . . . 1.3 109.763 -179.883 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 357' ' ' LYS . . . . . . . . . . . . . 20.0 mttt -90.35 103.32 16.02 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.237 -1.155 . . . . 4.1 109.56 179.946 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 358' ' ' GLU . . . . . 0.56 ' CB ' ' HD3' ' A' ' 359' ' ' PRO . 1.8 tt0 -49.81 -55.45 23.49 Favored Pre-proline 0 N--CA 1.489 1.495 0 O-C-N 121.153 -0.967 . . . . 5.75 109.685 179.949 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 359' ' ' PRO . . . . . 0.56 ' HD3' ' CB ' ' A' ' 358' ' ' GLU . 2.2 Cg_endo -62.71 144.87 94.69 Favored 'Trans proline' 0 C--N 1.311 -1.427 0 C-N-CA 121.86 1.706 . . . . 5.0 110.105 179.979 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 360' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.356 0 N-CA-C 109.418 -1.473 . . . . 6.97 109.418 179.992 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' B' B ' 319' ' ' LYS . . . . . 0.429 ' O ' ' HB2' ' B' ' 320' ' ' LYS . 4.8 mmtp . . . . . 0 N--CA 1.49 1.557 0 CA-C-O 121.274 0.559 . . . . 7.55 109.501 . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 320' ' ' LYS . . . . . 0.429 ' HB2' ' O ' ' B' ' 319' ' ' LYS . 18.9 mttt 61.09 -168.86 0.17 Allowed 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.216 -0.927 . . . . 6.44 109.49 -179.904 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 321' ' ' LYS . . . . . . . . . . . . . 10.0 mttt -158.22 70.5 3.94 Favored Pre-proline 0 N--CA 1.49 1.575 0 O-C-N 121.24 -0.913 . . . . 6.13 109.521 179.99 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 322' ' ' PRO . . . . . . . . . . . . . 4.4 Cg_exo -59.86 136.74 71.99 Favored 'Trans proline' 0 C--N 1.31 -1.474 0 C-N-CA 122.163 1.909 . . . . 2.82 110.204 179.823 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 323' ' ' LEU . . . . . . . . . . . . . 27.7 mt -80.37 115.81 20.11 Favored 'General case' 0 N--CA 1.489 1.48 0 O-C-N 121.193 -0.942 . . . . 2.84 109.321 -179.991 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 324' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 -79.66 142.46 35.52 Favored 'General case' 0 N--CA 1.489 1.491 0 O-C-N 121.206 -0.934 . . . . 1.53 109.5 179.991 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 325' ' ' GLY . . . . . 0.411 ' O ' ' CE2' ' B' ' 327' ' ' TYR . . . -65.97 176.96 15.67 Favored Glycine 0 N--CA 1.489 2.194 0 N-CA-C 109.264 -1.534 . . . . 0.59 109.264 179.765 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 326' ' ' GLU . . . . . . . . . . . . . 67.0 mm-40 -56.48 179.31 0.04 OUTLIER 'General case' 0 N--CA 1.489 1.5 0 O-C-N 121.16 -1.2 . . . . 2.13 109.261 -179.973 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 327' ' ' TYR . . . . . 0.579 ' CE1' ' HG2' ' D' ' 333' ' ' ARG . 44.1 m-85 -148.63 94.97 2.36 Favored 'General case' 0 N--CA 1.488 1.425 0 O-C-N 121.011 -1.056 . . . . 0.48 109.582 -179.956 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 328' ' ' PHE . . . . . . . . . . . . . 85.5 m-85 -103.19 -162.83 0.94 Allowed 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.265 -0.897 . . . . 0.32 109.534 -179.91 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 329' ' ' THR . . . . . . . . . . . . . 41.1 p -153.96 166.92 31.46 Favored 'General case' 0 N--CA 1.488 1.471 0 O-C-N 121.33 -0.856 . . . . 0.23 109.082 179.943 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 330' ' ' LEU . . . . . 0.512 HD11 HD22 ' D' ' 345' ' ' ASN . 18.6 tp -149.97 126.03 10.6 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.011 -1.056 . . . . 0.28 109.954 -179.579 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 331' ' ' GLN . . . . . 0.453 ' OE1' ' O ' ' D' ' 328' ' ' PHE . 0.2 OUTLIER -87.38 112.66 22.35 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.273 -0.892 . . . . 0.91 108.895 179.432 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' B' B ' 332' ' ' ILE . . . . . 0.561 HG21 ' HA ' ' B' ' 338' ' ' PHE . 50.3 mt -103.46 109.6 27.47 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.561 0 O-C-N 121.113 -0.992 . . . . 0.24 109.746 -179.699 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 333' ' ' ARG . . . . . 0.541 ' HG2' ' CE1' ' D' ' 327' ' ' TYR . 81.6 mtt180 -72.84 149.96 43.1 Favored 'General case' 0 N--CA 1.489 1.486 0 O-C-N 121.329 -0.857 . . . . 2.93 109.414 179.748 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 334' ' ' GLY . . . . . . . . . . . . . . . 81.4 124.81 0.7 Allowed Glycine 0 N--CA 1.491 2.36 0 N-CA-C 109.444 -1.463 . . . . 0.4 109.444 -179.893 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 335' ' ' ARG . . . . . . . . . . . . . 58.7 ttt180 -75.42 -33.15 60.92 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.22 -1.165 . . . . 3.01 109.644 -179.874 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 336' ' ' GLU . . . . . . . . . . . . . 61.3 tt0 -58.78 -61.77 2.37 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.241 -0.912 . . . . 2.28 109.704 -179.793 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 337' ' ' ARG . . . . . . . . . . . . . 7.8 mmt180 -61.78 -33.1 73.48 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.161 -0.962 . . . . 2.93 109.743 -179.762 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 338' ' ' PHE . . . . . 0.561 ' HA ' HG21 ' B' ' 332' ' ' ILE . 46.4 t80 -54.26 -57.54 10.79 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.171 -0.956 . . . . 0.37 109.794 -179.805 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 339' ' ' GLU . . . . . . . . . . . . . 41.3 mt-10 -51.02 -34.82 31.02 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.177 -0.952 . . . . 1.98 110.071 -179.686 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 340' ' ' MET . . . . . . . . . . . . . 47.8 ttp -63.91 -48.99 74.4 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.146 -0.971 . . . . 0.32 110.094 -179.505 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 341' ' ' PHE . . . . . . . . . . . . . 44.5 m-85 -61.96 -46.17 90.47 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.151 -0.968 . . . . 0.18 109.885 -179.56 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 342' ' ' ARG . . . . . . . . . . . . . 6.0 ttt180 -49.69 -42.36 45.52 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.213 -0.929 . . . . 2.42 110.051 -179.631 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 343' ' ' GLU . . . . . . . . . . . . . 1.1 tp10 -58.92 -49.62 77.11 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.077 -1.014 . . . . 2.35 109.882 -179.604 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 344' ' ' LEU . . . . . 0.439 HD22 HD22 ' A' ' 344' ' ' LEU . 60.0 mt -60.29 -30.84 69.74 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.208 -0.932 . . . . 0.18 109.432 -179.677 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 345' ' ' ASN . . . . . 0.428 ' HA ' ' CZ ' ' D' ' 341' ' ' PHE . 64.4 t-20 -58.56 -59.05 5.99 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.354 -0.841 . . . . 1.09 109.735 179.978 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 346' ' ' GLU . . . . . 0.44 ' OE1' ' NZ ' ' A' ' 351' ' ' LYS . 1.1 tm-20 -61.64 -26.38 67.96 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.237 -0.914 . . . . 1.66 109.943 -179.642 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 347' ' ' ALA . . . . . 0.478 ' HB1' ' HB1' ' A' ' 347' ' ' ALA . . . -60.67 -57.7 11.6 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.187 -0.946 . . . . 0.17 110.116 -179.817 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 348' ' ' LEU . . . . . 0.695 HD12 ' CZ ' ' D' ' 337' ' ' ARG . 4.1 mm? -62.06 -44.7 96.12 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.188 -0.945 . . . . 0.29 110.192 -179.448 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 349' ' ' GLU . . . . . . . . . . . . . 11.3 mm-40 -58.35 -33.09 69.16 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.222 -0.924 . . . . 1.95 109.979 -179.422 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 350' ' ' LEU . . . . . 0.825 HD11 ' NE2' ' A' ' 354' ' ' GLN . 5.2 tt -64.59 -43.34 94.12 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.258 -0.901 . . . . 0.45 109.858 -179.797 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 351' ' ' LYS . . . . . 0.465 ' NZ ' ' OE1' ' A' ' 346' ' ' GLU . 19.1 tttp -59.5 -44.57 93.07 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.365 -0.834 . . . . 1.38 109.917 -179.588 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 352' ' ' ASP . . . . . . . . . . . . . 37.2 m-20 -58.68 -49.24 78.27 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.242 -0.911 . . . . 1.16 110.178 -179.676 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 353' ' ' ALA . . . . . . . . . . . . . . . -65.8 -11.22 44.37 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.044 -1.035 . . . . 0.61 109.839 -179.438 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 354' ' ' GLN . . . . . 0.872 ' NE2' HD11 ' A' ' 350' ' ' LEU . 1.6 mt-30 -83.6 -54.59 4.83 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.189 -0.945 . . . . 1.45 109.464 179.962 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 355' ' ' ALA . . . . . . . . . . . . . . . -71.39 -3.68 22.17 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.366 -0.834 . . . . 0.98 109.915 -179.744 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 356' ' ' GLY . . . . . . . . . . . . . . . -80.49 -9.16 86.8 Favored Glycine 0 N--CA 1.491 2.333 0 N-CA-C 109.721 -1.352 . . . . 1.29 109.721 -179.775 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 357' ' ' LYS . . . . . . . . . . . . . 21.3 mttt -90.27 103.38 16.06 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.119 -1.224 . . . . 4.09 109.567 179.892 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 358' ' ' GLU . . . . . 0.56 ' N ' ' HD2' ' B' ' 359' ' ' PRO . 1.8 tt0 -50.01 -55.43 24.35 Favored Pre-proline 0 N--CA 1.489 1.499 0 O-C-N 121.25 -0.907 . . . . 5.72 109.659 179.92 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 359' ' ' PRO . . . . . 0.56 ' HD2' ' N ' ' B' ' 358' ' ' GLU . 2.2 Cg_endo -62.47 145.56 95.57 Favored 'Trans proline' 0 C--N 1.311 -1.4 0 C-N-CA 121.832 1.688 . . . . 4.98 110.028 -179.942 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 360' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.236 0 CA-C-O 118.03 -1.428 . . . . 6.98 109.568 -179.959 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' C' C ' 319' ' ' LYS . . . . . . . . . . . . . 12.2 mttt . . . . . 0 N--CA 1.49 1.549 0 CA-C-O 121.383 0.611 . . . . 6.82 109.375 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' C' C ' 320' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER 57.84 16.05 3.39 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.238 -0.914 . . . . 6.49 109.705 179.875 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' C' C ' 321' ' ' LYS . . . . . 0.619 ' N ' ' CD ' ' C' ' 322' ' ' PRO . 13.0 mmtt -81.35 -43.8 1.14 Allowed Pre-proline 0 N--CA 1.49 1.529 0 O-C-N 121.205 -0.935 . . . . 6.4 110.696 179.953 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' C' C ' 322' ' ' PRO . . . . . 0.619 ' CD ' ' N ' ' C' ' 321' ' ' LYS . 1.3 Cg_endo -65.89 -45.76 5.76 Favored 'Trans proline' 0 C--N 1.315 -1.205 0 C-N-CA 121.427 1.418 . . . . 3.42 110.554 -179.548 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' C' C ' 323' ' ' LEU . . . . . . . . . . . . . 32.7 mt -83.48 78.04 9.72 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.237 -0.914 . . . . 3.95 110.269 -179.412 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' C' C ' 324' ' ' ASP . . . . . 0.462 ' CB ' ' OH ' ' C' ' 327' ' ' TYR . 0.8 OUTLIER -83.6 177.14 8.54 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.347 -0.846 . . . . 1.63 109.325 179.26 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' C' C ' 325' ' ' GLY . . . . . . . . . . . . . . . -69.46 -171.49 8.17 Favored Glycine 0 N--CA 1.492 2.419 0 N-CA-C 109.678 -1.369 . . . . 0.73 109.678 179.776 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' C' C ' 326' ' ' GLU . . . . . . . . . . . . . 1.8 mm-40 -59.41 -175.06 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.193 -1.181 . . . . 2.17 109.527 179.932 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' C' C ' 327' ' ' TYR . . . . . 0.542 ' CE1' ' HG2' ' A' ' 333' ' ' ARG . 41.2 m-85 -149.94 105.79 3.44 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.245 -0.909 . . . . 0.48 109.76 179.847 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' C' C ' 328' ' ' PHE . . . . . 0.437 ' O ' HG23 ' C' ' 329' ' ' THR . 91.6 m-85 -111.7 -164.21 0.9 Allowed 'General case' 0 C--N 1.303 -1.436 0 O-C-N 121.42 -0.8 . . . . 0.33 109.185 179.757 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' C' C ' 329' ' ' THR . . . . . 0.437 HG23 ' O ' ' C' ' 328' ' ' PHE . 11.3 p -153.94 160.46 42.11 Favored 'General case' 0 C--N 1.302 -1.478 0 O-C-N 121.397 -0.815 . . . . 0.23 109.064 179.776 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' C' C ' 330' ' ' LEU . . . . . 0.706 HD11 HD22 ' A' ' 345' ' ' ASN . 16.7 tp -148.96 125.64 11.09 Favored 'General case' 0 N--CA 1.488 1.471 0 O-C-N 121.252 -0.905 . . . . 0.28 109.644 -179.788 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' C' C ' 331' ' ' GLN . . . . . . . . . . . . . 1.5 tp60 -86.93 116.65 25.14 Favored 'General case' 0 N--CA 1.489 1.5 0 O-C-N 121.282 -0.887 . . . . 1.48 109.021 179.61 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' C' C ' 332' ' ' ILE . . . . . 0.407 HD13 ' CD2' ' C' ' 341' ' ' PHE . 59.6 mt -103.3 110.02 28.62 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.452 0 O-C-N 121.128 -0.983 . . . . 0.24 109.654 -179.796 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' C' C ' 333' ' ' ARG . . . . . 0.605 ' CG ' ' CE1' ' A' ' 327' ' ' TYR . 2.1 mpt_? -71.61 149.75 45.32 Favored 'General case' 0 C--N 1.304 -1.381 0 O-C-N 121.334 -0.854 . . . . 2.74 109.07 179.634 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' C' C ' 334' ' ' GLY . . . . . . . . . . . . . . . 80.98 130.09 0.99 Allowed Glycine 0 N--CA 1.489 2.189 0 N-CA-C 109.567 -1.413 . . . . 0.35 109.567 -179.942 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' C' C ' 335' ' ' ARG . . . . . . . . . . . . . 57.1 ttt180 -77.92 -36.88 48.91 Favored 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.401 -1.058 . . . . 2.53 109.52 -179.89 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' C' C ' 336' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -57.5 -58.28 8.98 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.371 -0.831 . . . . 2.62 110.169 -179.471 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' C' C ' 337' ' ' ARG . . . . . 0.555 ' HG3' ' NH1' ' C' ' 337' ' ' ARG . 0.1 OUTLIER -59.87 -31.92 70.23 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.173 -0.954 . . . . 2.81 109.797 -179.638 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' C' C ' 338' ' ' PHE . . . . . . . . . . . . . 79.7 t80 -54.07 -55.21 29.69 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.294 -0.879 . . . . 0.4 109.745 -179.72 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' C' C ' 339' ' ' GLU . . . . . . . . . . . . . 34.0 mt-10 -52.01 -35.71 47.66 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.299 -0.876 . . . . 2.05 109.977 -179.795 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' C' C ' 340' ' ' MET . . . . . . . . . . . . . 31.5 ttp -64.38 -51.2 64.47 Favored 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.307 -0.87 . . . . 0.32 110.304 -179.454 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' C' C ' 341' ' ' PHE . . . . . 0.407 ' CD2' HD13 ' C' ' 332' ' ' ILE . 33.1 m-85 -62.06 -40.06 94.5 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.056 -1.028 . . . . 0.18 110.365 -179.338 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' C' C ' 342' ' ' ARG . . . . . 0.522 ' NH1' ' HG3' ' C' ' 342' ' ' ARG . 0.0 OUTLIER -51.7 -48.61 63.46 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.022 -1.049 . . . . 2.91 110.091 -179.516 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' C' C ' 343' ' ' GLU . . . . . . . . . . . . . 1.6 tp10 -59.74 -43.81 94.06 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.274 -0.891 . . . . 2.14 110.247 -179.419 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' C' C ' 344' ' ' LEU . . . . . . . . . . . . . 53.6 mt -61.5 -34.53 75.66 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.157 -0.964 . . . . 0.22 109.839 -179.529 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' C' C ' 345' ' ' ASN . . . . . 0.406 ' O ' ' HG2' ' C' ' 349' ' ' GLU . 39.0 t-20 -58.82 -57.77 11.57 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.242 -0.911 . . . . 1.08 109.71 -179.997 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' C' C ' 346' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -60.61 -24.87 65.84 Favored 'General case' 0 N--CA 1.489 1.486 0 O-C-N 121.205 -0.934 . . . . 2.21 109.926 -179.603 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' C' C ' 347' ' ' ALA . . . . . 0.562 ' HB1' ' HB1' ' D' ' 347' ' ' ALA . . . -62.07 -59.62 4.81 Favored 'General case' 0 N--CA 1.489 1.501 0 O-C-N 121.095 -1.003 . . . . 0.18 109.65 -179.979 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' C' C ' 348' ' ' LEU . . . . . 0.654 HD12 ' NH2' ' A' ' 337' ' ' ARG . 3.8 mm? -64.43 -48.35 75.66 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.271 -0.893 . . . . 0.32 110.328 -179.583 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' C' C ' 349' ' ' GLU . . . . . 0.406 ' HG2' ' O ' ' C' ' 345' ' ' ASN . 3.8 mm-40 -55.33 -34.11 63.92 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.119 -0.988 . . . . 2.19 109.482 -179.393 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' C' C ' 350' ' ' LEU . . . . . 0.811 ' CD2' HD13 ' D' ' 350' ' ' LEU . 5.0 tt -64.87 -36.98 86.11 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.301 -0.874 . . . . 0.46 109.073 179.695 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' C' C ' 351' ' ' LYS . . . . . . . . . . . . . 19.4 tttt -60.33 -47.57 85.47 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.494 -0.754 . . . . 1.35 109.306 179.913 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' C' C ' 352' ' ' ASP . . . . . . . . . . . . . 15.0 m-20 -55.88 -52.96 62.26 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.385 -0.822 . . . . 1.19 109.514 -179.988 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' C' C ' 353' ' ' ALA . . . . . . . . . . . . . . . -66.46 -14.49 62.3 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.188 -0.945 . . . . 0.57 109.59 -179.818 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' C' C ' 354' ' ' GLN . . . . . 0.64 ' NE2' HD11 ' D' ' 350' ' ' LEU . 0.9 OUTLIER -81.9 -29.89 32.16 Favored 'General case' 0 N--CA 1.488 1.432 0 O-C-N 121.285 -0.884 . . . . 1.47 109.056 179.822 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' C' C ' 355' ' ' ALA . . . . . 0.423 ' O ' ' C ' ' C' ' 356' ' ' GLY . . . -73.91 -63.04 1.3 Allowed 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.345 -0.847 . . . . 0.93 109.553 179.73 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' C' C ' 356' ' ' GLY . . . . . 0.423 ' C ' ' O ' ' C' ' 355' ' ' ALA . . . -41.93 -87.33 0.01 OUTLIER Glycine 0 N--CA 1.493 2.448 0 N-CA-C 109.757 -1.337 . . . . 1.33 109.757 -179.775 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' C' C ' 357' ' ' LYS . . . . . 0.474 ' O ' ' HD3' ' C' ' 359' ' ' PRO . 1.0 OUTLIER -86.44 91.49 8.54 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.21 -1.171 . . . . 4.01 109.265 -179.93 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' C' C ' 358' ' ' GLU . . . . . . . . . . . . . 3.3 tm-20 -45.17 103.91 0.37 Allowed Pre-proline 0 N--CA 1.492 1.634 0 O-C-N 121.388 -0.82 . . . . 5.75 109.719 -179.72 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' C' C ' 359' ' ' PRO . . . . . 0.522 ' HG2' ' CG ' ' C' ' 354' ' ' GLN . 1.4 Cg_endo -66.56 -81.06 0.01 OUTLIER 'Trans proline' 0 C--N 1.311 -1.428 0 C-N-CA 121.886 1.724 . . . . 4.94 109.684 179.622 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' C' C ' 360' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.2 0 CA-C-O 117.961 -1.466 . . . . 6.5 109.451 179.813 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' D' D ' 319' ' ' LYS . . . . . 0.411 ' O ' ' HB2' ' D' ' 320' ' ' LYS . 4.5 mmtp . . . . . 0 N--CA 1.49 1.575 0 N-CA-C 109.459 -0.571 . . . . 7.53 109.459 . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' D' D ' 320' ' ' LYS . . . . . 0.411 ' HB2' ' O ' ' D' ' 319' ' ' LYS . 19.6 mttt 60.71 -169.6 0.16 Allowed 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.341 -0.849 . . . . 6.41 109.339 -179.994 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' D' D ' 321' ' ' LYS . . . . . . . . . . . . . 10.0 mttt -157.83 70.54 4.15 Favored Pre-proline 0 N--CA 1.488 1.449 0 O-C-N 121.225 -0.922 . . . . 6.11 109.482 -179.946 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' D' D ' 322' ' ' PRO . . . . . . . . . . . . . 4.2 Cg_exo -60.16 136.76 70.92 Favored 'Trans proline' 0 C--N 1.31 -1.484 0 C-N-CA 122.135 1.89 . . . . 2.82 110.227 179.914 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' D' D ' 323' ' ' LEU . . . . . . . . . . . . . 25.0 mt -80.07 115.58 19.72 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.287 -0.883 . . . . 2.83 109.443 -179.991 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' D' D ' 324' ' ' ASP . . . . . . . . . . . . . 4.1 m-20 -79.45 143.47 34.94 Favored 'General case' 0 N--CA 1.488 1.47 0 O-C-N 121.274 -0.891 . . . . 1.54 109.312 179.999 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' D' D ' 325' ' ' GLY . . . . . 0.407 ' O ' ' CE2' ' D' ' 327' ' ' TYR . . . -67.19 176.59 22.32 Favored Glycine 0 N--CA 1.49 2.275 0 N-CA-C 109.12 -1.592 . . . . 0.59 109.12 179.899 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' D' D ' 326' ' ' GLU . . . . . . . . . . . . . 66.1 mm-40 -56.17 179.12 0.04 OUTLIER 'General case' 0 N--CA 1.488 1.436 0 O-C-N 121.126 -1.22 . . . . 2.13 109.222 -179.923 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' D' D ' 327' ' ' TYR . . . . . 0.541 ' CE1' ' HG2' ' B' ' 333' ' ' ARG . 43.8 m-85 -148.44 94.81 2.35 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.21 -0.931 . . . . 0.47 109.453 -179.875 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' D' D ' 328' ' ' PHE . . . . . 0.453 ' O ' ' OE1' ' B' ' 331' ' ' GLN . 85.6 m-85 -103.03 -162.54 0.92 Allowed 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.191 -0.943 . . . . 0.3 109.574 179.93 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' D' D ' 329' ' ' THR . . . . . 0.42 ' HA ' ' O ' ' B' ' 330' ' ' LEU . 40.3 p -154.24 166.79 32.05 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.316 -0.865 . . . . 0.22 108.951 179.895 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' D' D ' 330' ' ' LEU . . . . . . . . . . . . . 18.7 tp -149.78 125.96 10.69 Favored 'General case' 0 N--CA 1.488 1.443 0 O-C-N 121.029 -1.044 . . . . 0.28 109.824 -179.502 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' D' D ' 331' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -87.48 112.48 22.24 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.203 -0.936 . . . . 0.93 108.876 179.491 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' D' D ' 332' ' ' ILE . . . . . 0.542 HG21 ' HA ' ' D' ' 338' ' ' PHE . 47.2 mt -103.34 109.64 27.54 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.543 0 O-C-N 121.257 -0.902 . . . . 0.25 109.858 -179.68 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' D' D ' 333' ' ' ARG . . . . . 0.579 ' HG2' ' CE1' ' B' ' 327' ' ' TYR . 82.0 mtt180 -72.84 150.74 42.44 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.445 -0.784 . . . . 2.93 109.358 179.838 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' D' D ' 334' ' ' GLY . . . . . . . . . . . . . . . 80.75 125.18 0.63 Allowed Glycine 0 N--CA 1.491 2.308 0 N-CA-C 109.373 -1.491 . . . . 0.41 109.373 -179.833 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' D' D ' 335' ' ' ARG . . . . . . . . . . . . . 57.0 ttt180 -75.7 -33.65 60.35 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.366 -1.079 . . . . 3.03 109.535 -179.978 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' D' D ' 336' ' ' GLU . . . . . . . . . . . . . 60.8 tt0 -58.29 -62.2 2.01 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.255 -0.903 . . . . 2.26 109.77 -179.854 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' D' D ' 337' ' ' ARG . . . . . 0.695 ' CZ ' HD12 ' B' ' 348' ' ' LEU . 7.4 mmt180 -61.23 -32.85 72.64 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.247 -0.908 . . . . 2.92 109.74 -179.771 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' D' D ' 338' ' ' PHE . . . . . 0.542 ' HA ' HG21 ' D' ' 332' ' ' ILE . 46.5 t80 -54.44 -57.64 10.54 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.289 -0.882 . . . . 0.37 109.72 -179.732 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' D' D ' 339' ' ' GLU . . . . . . . . . . . . . 41.2 mt-10 -50.99 -34.88 30.97 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.166 -0.959 . . . . 1.99 109.978 -179.666 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' D' D ' 340' ' ' MET . . . . . . . . . . . . . 46.7 ttp -63.84 -49.74 71.61 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.086 -1.009 . . . . 0.31 110.019 -179.496 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' D' D ' 341' ' ' PHE . . . . . 0.428 ' CZ ' ' HA ' ' B' ' 345' ' ' ASN . 44.7 m-85 -61.31 -46.6 89.61 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.126 -0.984 . . . . 0.18 110.007 -179.674 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' D' D ' 342' ' ' ARG . . . . . . . . . . . . . 6.0 ttt180 -49.39 -42.58 42.76 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.168 -0.958 . . . . 2.41 110.02 -179.625 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' D' D ' 343' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -58.65 -49.93 75.72 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.133 -0.979 . . . . 2.35 109.844 -179.518 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' D' D ' 344' ' ' LEU . . . . . . . . . . . . . 60.2 mt -59.93 -30.89 69.36 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.175 -0.953 . . . . 0.19 109.504 -179.786 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' D' D ' 345' ' ' ASN . . . . . 0.512 HD22 HD11 ' B' ' 330' ' ' LEU . 64.3 t-20 -58.61 -59.29 5.63 Favored 'General case' 0 N--CA 1.488 1.455 0 O-C-N 121.204 -0.935 . . . . 1.09 109.82 179.955 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' D' D ' 346' ' ' GLU . . . . . . . . . . . . . 1.2 tm-20 -61.31 -26.71 67.98 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.29 -0.881 . . . . 1.69 109.981 -179.687 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' D' D ' 347' ' ' ALA . . . . . 0.562 ' HB1' ' HB1' ' C' ' 347' ' ' ALA . . . -60.29 -57.72 11.6 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.1 -1.0 . . . . 0.18 110.111 -179.723 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' D' D ' 348' ' ' LEU . . . . . 0.599 HD22 ' N ' ' D' ' 348' ' ' LEU . 4.1 mm? -62.12 -44.68 96.1 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.152 -0.968 . . . . 0.31 110.092 -179.348 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' D' D ' 349' ' ' GLU . . . . . . . . . . . . . 10.2 mm-40 -58.22 -33.31 69.17 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.209 -0.932 . . . . 1.95 110.018 -179.436 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' D' D ' 350' ' ' LEU . . . . . 0.811 HD13 ' CD2' ' C' ' 350' ' ' LEU . 5.3 tt -64.44 -43.89 92.86 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.147 -0.971 . . . . 0.43 109.716 -179.819 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' D' D ' 351' ' ' LYS . . . . . 0.433 ' O ' ' HB2' ' D' ' 354' ' ' GLN . 18.7 tttp -58.96 -44.72 91.54 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.371 -0.831 . . . . 1.4 110.015 -179.601 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' D' D ' 352' ' ' ASP . . . . . . . . . . . . . 35.2 m-20 -58.46 -48.9 79.24 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.297 -0.877 . . . . 1.17 110.307 -179.576 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' D' D ' 353' ' ' ALA . . . . . . . . . . . . . . . -66.43 -11.15 50.3 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.259 -0.901 . . . . 0.59 109.784 -179.351 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' D' D ' 354' ' ' GLN . . . . . 0.546 ' HG3' HD23 ' D' ' 350' ' ' LEU . 1.5 mt-30 -83.36 -54.63 4.84 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.211 -0.93 . . . . 1.44 109.484 179.829 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' D' D ' 355' ' ' ALA . . . . . . . . . . . . . . . -71.58 -3.58 22.23 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.288 -0.883 . . . . 0.98 109.852 -179.869 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' D' D ' 356' ' ' GLY . . . . . . . . . . . . . . . -80.44 -8.81 87.19 Favored Glycine 0 N--CA 1.49 2.245 0 N-CA-C 109.708 -1.357 . . . . 1.28 109.708 -179.802 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' D' D ' 357' ' ' LYS . . . . . . . . . . . . . 21.6 mttt -90.3 103.03 15.76 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.28 -1.129 . . . . 4.09 109.61 179.861 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' D' D ' 358' ' ' GLU . . . . . 0.569 ' N ' ' HD2' ' D' ' 359' ' ' PRO . 2.0 tt0 -49.76 -55.03 25.91 Favored Pre-proline 0 N--CA 1.489 1.513 0 O-C-N 121.188 -0.945 . . . . 5.71 109.681 179.979 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' D' D ' 359' ' ' PRO . . . . . 0.569 ' HD2' ' N ' ' D' ' 358' ' ' GLU . 2.3 Cg_endo -62.83 146.08 94.91 Favored 'Trans proline' 0 C--N 1.311 -1.436 0 C-N-CA 121.963 1.775 . . . . 4.97 110.004 179.888 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' D' D ' 360' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.252 0 N-CA-C 109.426 -1.47 . . . . 6.97 109.426 179.969 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 319' ' ' LYS . . . . . . . . . . . . . 2.9 mmpp? . . . . . 0 N--CA 1.489 1.477 0 N-CA-C 109.467 -0.568 . . . . 7.55 109.467 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 320' ' ' LYS . . . . . 0.402 ' HG2' ' OD1' ' A' ' 324' ' ' ASP . 0.0 OUTLIER 61.23 157.5 0.04 OUTLIER 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.37 -0.831 . . . . 6.43 109.381 -179.967 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 321' ' ' LYS . . . . . 0.618 ' CB ' ' HD3' ' A' ' 322' ' ' PRO . 0.1 OUTLIER -159.53 -65.5 0.02 OUTLIER Pre-proline 0 N--CA 1.49 1.538 0 O-C-N 121.154 -0.966 . . . . 6.13 109.728 179.777 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 322' ' ' PRO . . . . . 0.618 ' HD3' ' CB ' ' A' ' 321' ' ' LYS . 4.1 Cg_exo -57.74 -160.18 0.02 OUTLIER 'Trans proline' 0 C--N 1.314 -1.255 0 C-N-CA 121.555 1.503 . . . . 2.83 110.064 179.617 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 323' ' ' LEU . . . . . . . . . . . . . 37.4 mt -79.46 137.57 37.28 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.276 -0.89 . . . . 2.83 109.264 179.86 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 324' ' ' ASP . . . . . 0.402 ' OD1' ' HG2' ' A' ' 320' ' ' LYS . 5.2 m-20 -78.85 -147.99 0.04 OUTLIER 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.252 -0.905 . . . . 1.53 109.203 -179.948 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 325' ' ' GLY . . . . . . . . . . . . . . . -68.33 177.51 24.91 Favored Glycine 0 N--CA 1.488 2.15 0 N-CA-C 109.267 -1.533 . . . . 0.61 109.267 179.972 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 326' ' ' GLU . . . . . . . . . . . . . 2.9 mm-40 -57.34 -172.84 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.489 0 O-C-N 121.199 -1.177 . . . . 2.13 109.016 -179.999 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 327' ' ' TYR . . . . . 0.577 ' CE1' ' HG2' ' C' ' 333' ' ' ARG . 48.1 m-85 -148.98 102.42 3.26 Favored 'General case' 0 N--CA 1.488 1.444 0 O-C-N 121.168 -0.958 . . . . 0.48 109.395 179.985 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 328' ' ' PHE . . . . . . . . . . . . . 37.8 m-85 -106.87 -168.24 1.38 Allowed 'General case' 0 N--CA 1.489 1.479 0 O-C-N 121.406 -0.809 . . . . 0.31 109.282 -179.962 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 329' ' ' THR . . . . . . . . . . . . . 6.3 p -152.41 166.92 30.4 Favored 'General case' 0 N--CA 1.488 1.428 0 O-C-N 121.284 -0.885 . . . . 0.22 109.007 179.96 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 330' ' ' LEU . . . . . 0.497 HD11 HD22 ' C' ' 345' ' ' ASN . 16.9 tp -148.97 130.37 14.74 Favored 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.173 -0.954 . . . . 0.28 109.767 -179.605 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 331' ' ' GLN . . . . . . . . . . . . . 19.1 tp60 -88.42 111.78 22.17 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.326 -0.859 . . . . 0.91 109.53 179.785 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 332' ' ' ILE . . . . . 0.505 HG21 ' HA ' ' A' ' 338' ' ' PHE . 75.7 mt -103.96 111.41 33.51 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.702 0 O-C-N 121.121 -0.987 . . . . 0.26 109.603 179.836 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 333' ' ' ARG . . . . . 0.534 ' HG2' ' CE1' ' C' ' 327' ' ' TYR . 67.5 mtt180 -73.94 151.27 40.41 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.289 -0.882 . . . . 2.92 109.714 -179.983 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 334' ' ' GLY . . . . . . . . . . . . . . . 75.79 130.36 0.31 Allowed Glycine 0 N--CA 1.49 2.299 0 N-CA-C 109.545 -1.422 . . . . 0.4 109.545 179.914 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 335' ' ' ARG . . . . . 0.446 ' HB2' ' CZ ' ' C' ' 328' ' ' PHE . 33.1 ttt180 -78.21 -31.65 49.51 Favored 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.216 -1.167 . . . . 3.01 109.675 -179.819 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 336' ' ' GLU . . . . . . . . . . . . . 2.2 mt-10 -57.78 -62.01 2.11 Favored 'General case' 0 N--CA 1.493 1.675 0 O-C-N 121.19 -0.944 . . . . 2.29 109.776 -179.816 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 337' ' ' ARG . . . . . 0.421 HH11 ' HG2' ' A' ' 337' ' ' ARG . 1.9 mmt-85 -59.92 -32.05 70.42 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.238 -0.914 . . . . 2.93 109.529 -179.922 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 338' ' ' PHE . . . . . 0.505 ' HA ' HG21 ' A' ' 332' ' ' ILE . 64.5 t80 -56.44 -57.65 11.4 Favored 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.262 -0.899 . . . . 0.38 109.818 -179.991 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 339' ' ' GLU . . . . . . . . . . . . . 48.2 mt-10 -51.77 -31.92 28.86 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.231 -0.918 . . . . 1.97 109.947 -179.841 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 340' ' ' MET . . . . . . . . . . . . . 37.9 ttp -63.9 -50.66 67.88 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.239 -0.913 . . . . 0.31 109.729 -179.601 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 341' ' ' PHE . . . . . . . . . . . . . 39.2 m-85 -62.66 -41.86 99.3 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.297 -0.877 . . . . 0.18 109.949 -179.62 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 342' ' ' ARG . . . . . 0.538 ' HG2' ' NH1' ' A' ' 342' ' ' ARG . 0.1 OUTLIER -50.4 -42.43 53.63 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.093 -1.004 . . . . 2.42 109.771 -179.818 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 343' ' ' GLU . . . . . . . . . . . . . 2.3 tp10 -57.65 -45.72 85.11 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.211 -0.931 . . . . 2.35 109.705 -179.708 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 344' ' ' LEU . . . . . . . . . . . . . 32.3 mt -62.36 -33.4 74.66 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.108 -0.995 . . . . 0.18 109.452 -179.973 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 345' ' ' ASN . . . . . . . . . . . . . 8.8 t-20 -56.72 -58.35 8.45 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.249 -0.907 . . . . 1.09 109.848 -179.797 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 346' ' ' GLU . . . . . . . . . . . . . 3.2 tt0 -60.42 -28.75 68.51 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.212 -0.93 . . . . 1.65 109.88 -179.539 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 347' ' ' ALA . . . . . 0.835 ' HB1' ' HB1' ' B' ' 347' ' ' ALA . . . -61.07 -59.84 4.72 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.122 -0.986 . . . . 0.18 110.132 -179.996 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 348' ' ' LEU . . . . . 0.591 HD22 ' N ' ' A' ' 348' ' ' LEU . 4.0 mm? -61.8 -43.74 98.26 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.27 -0.894 . . . . 0.3 110.058 -179.48 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 349' ' ' GLU . . . . . 0.42 ' OE2' ' NH1' ' C' ' 333' ' ' ARG . 1.8 mm-40 -56.7 -36.74 70.01 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.214 -0.929 . . . . 1.94 109.753 -179.393 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 350' ' ' LEU . . . . . 0.915 HD22 HD13 ' B' ' 350' ' ' LEU . 5.0 tt -63.2 -42.96 99.39 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.17 -0.956 . . . . 0.46 109.504 -179.738 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 351' ' ' LYS . . . . . . . . . . . . . 29.9 tttp -58.2 -35.55 71.8 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.142 -0.974 . . . . 1.4 109.132 179.89 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 352' ' ' ASP . . . . . . . . . . . . . 98.4 m-20 -57.07 -40.62 77.24 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.35 -0.844 . . . . 1.16 109.367 179.764 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 353' ' ' ALA . . . . . . . . . . . . . . . -67.74 -24.45 65.36 Favored 'General case' 0 N--CA 1.489 1.491 0 O-C-N 121.317 -0.865 . . . . 0.63 109.865 -179.838 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 354' ' ' GLN . . . . . . . . . . . . . 4.0 tt0 -81.02 -2.96 50.11 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.085 -1.009 . . . . 1.47 109.671 179.945 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 355' ' ' ALA . . . . . . . . . . . . . . . -69.3 -84.48 0.03 OUTLIER 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.186 -0.946 . . . . 1.01 109.432 -179.948 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 356' ' ' GLY . . . . . . . . . . . . . . . -61.17 99.06 0.19 Allowed Glycine 0 N--CA 1.491 2.343 0 N-CA-C 109.244 -1.542 . . . . 1.3 109.244 179.799 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 357' ' ' LYS . . . . . . . . . . . . . 6.4 mttm -86.46 157.36 19.82 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.342 -1.093 . . . . 4.1 109.815 -179.641 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 358' ' ' GLU . . . . . 0.495 ' HB2' ' HD2' ' A' ' 359' ' ' PRO . 15.0 pt-20 -50.76 159.74 0.89 Allowed Pre-proline 0 N--CA 1.494 1.775 0 O-C-N 121.213 -0.93 . . . . 5.75 109.631 179.921 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 359' ' ' PRO . . . . . 0.495 ' HD2' ' HB2' ' A' ' 358' ' ' GLU . 1.9 Cg_endo -63.39 -79.99 0.01 OUTLIER 'Trans proline' 0 C--N 1.313 -1.328 0 C-N-CA 122.123 1.882 . . . . 5.0 109.992 179.762 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 360' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.36 0 CA-C-O 118.016 -1.436 . . . . 6.97 109.715 -179.964 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' B' B ' 319' ' ' LYS . . . . . . . . . . . . . 2.5 mmpp? . . . . . 0 N--CA 1.491 1.618 0 N-CA-C 109.075 -0.713 . . . . 7.55 109.075 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' B' B ' 320' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 61.37 157.27 0.04 OUTLIER 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.392 -0.818 . . . . 6.44 109.483 -179.699 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 321' ' ' LYS . . . . . 0.617 ' CB ' ' HD3' ' B' ' 322' ' ' PRO . 0.1 OUTLIER -159.52 -65.75 0.02 OUTLIER Pre-proline 0 N--CA 1.489 1.503 0 O-C-N 121.263 -0.898 . . . . 6.13 109.748 179.699 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' B' B ' 322' ' ' PRO . . . . . 0.617 ' HD3' ' CB ' ' B' ' 321' ' ' LYS . 3.7 Cg_exo -57.52 -159.45 0.01 OUTLIER 'Trans proline' 0 C--N 1.315 -1.209 0 C-N-CA 121.714 1.609 . . . . 2.82 110.168 179.668 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 323' ' ' LEU . . . . . . . . . . . . . 37.4 mt -80.23 137.7 36.7 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.242 -0.911 . . . . 2.84 109.128 179.846 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 324' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 -79.12 -148.69 0.05 OUTLIER 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.226 -0.921 . . . . 1.53 109.358 -179.871 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 325' ' ' GLY . . . . . . . . . . . . . . . -67.16 177.71 19.23 Favored Glycine 0 N--CA 1.49 2.282 0 N-CA-C 109.22 -1.552 . . . . 0.59 109.22 179.879 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 326' ' ' GLU . . . . . . . . . . . . . 3.1 mm-40 -57.65 -172.81 0.01 OUTLIER 'General case' 0 N--CA 1.488 1.452 0 O-C-N 121.162 -1.199 . . . . 2.13 109.125 179.771 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 327' ' ' TYR . . . . . 0.556 ' CE1' ' HG2' ' D' ' 333' ' ' ARG . 48.8 m-85 -148.84 103.51 3.37 Favored 'General case' 0 N--CA 1.488 1.463 0 O-C-N 121.28 -0.887 . . . . 0.48 109.247 179.782 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 328' ' ' PHE . . . . . . . . . . . . . 38.4 m-85 -108.27 -168.79 1.41 Allowed 'General case' 0 N--CA 1.488 1.473 0 O-C-N 121.249 -0.907 . . . . 0.32 109.149 -179.998 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 329' ' ' THR . . . . . . . . . . . . . 6.7 p -151.8 167.13 29.24 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.213 -0.929 . . . . 0.23 109.27 179.985 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 330' ' ' LEU . . . . . . . . . . . . . 16.9 tp -149.08 130.65 14.89 Favored 'General case' 0 N--CA 1.488 1.437 0 O-C-N 121.15 -0.969 . . . . 0.28 109.74 -179.648 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 331' ' ' GLN . . . . . . . . . . . . . 19.6 tp60 -88.88 111.71 22.39 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.45 -0.781 . . . . 0.91 109.409 179.951 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 332' ' ' ILE . . . . . 0.503 HG21 ' HA ' ' B' ' 338' ' ' PHE . 75.5 mt -103.93 111.19 32.61 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.603 0 O-C-N 121.151 -0.968 . . . . 0.24 109.637 179.91 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 333' ' ' ARG . . . . . 0.55 ' HG2' ' CE1' ' D' ' 327' ' ' TYR . 67.5 mtt180 -73.71 151.47 40.7 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.187 -0.946 . . . . 2.93 109.648 -179.984 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 334' ' ' GLY . . . . . . . . . . . . . . . 75.79 130.17 0.3 Allowed Glycine 0 N--CA 1.491 2.316 0 N-CA-C 109.772 -1.331 . . . . 0.4 109.772 179.827 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 335' ' ' ARG . . . . . . . . . . . . . 34.8 ttt180 -78.12 -31.32 49.85 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.291 -1.123 . . . . 3.01 109.808 -179.924 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 336' ' ' GLU . . . . . . . . . . . . . 2.1 mt-10 -58.28 -61.71 2.37 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.058 -1.026 . . . . 2.28 109.789 -179.736 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 337' ' ' ARG . . . . . 0.427 HH11 ' HG2' ' B' ' 337' ' ' ARG . 1.6 mmt-85 -60.2 -31.69 70.39 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.174 -0.953 . . . . 2.93 109.601 -179.864 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 338' ' ' PHE . . . . . 0.503 ' HA ' HG21 ' B' ' 332' ' ' ILE . 64.9 t80 -56.32 -58.5 7.74 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.147 -0.97 . . . . 0.37 109.712 179.837 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 339' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -51.04 -32.07 20.55 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.172 -0.955 . . . . 1.98 109.893 -179.867 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 340' ' ' MET . . . . . . . . . . . . . 39.4 ttp -63.41 -50.95 67.83 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.095 -1.003 . . . . 0.32 109.795 -179.743 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 341' ' ' PHE . . . . . . . . . . . . . 40.1 m-85 -62.5 -41.84 99.09 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.253 -0.904 . . . . 0.18 109.99 -179.589 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 342' ' ' ARG . . . . . 0.547 ' NH1' ' HG2' ' B' ' 342' ' ' ARG . 0.1 OUTLIER -50.63 -41.86 55.56 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.153 -0.967 . . . . 2.42 109.902 -179.662 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' B' B ' 343' ' ' GLU . . . . . . . . . . . . . 2.3 tp10 -58.38 -46.22 86.79 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.162 -0.961 . . . . 2.35 109.565 -179.707 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 344' ' ' LEU . . . . . . . . . . . . . 34.5 mt -61.51 -33.79 74.4 Favored 'General case' 0 N--CA 1.489 1.477 0 O-C-N 121.277 -0.889 . . . . 0.18 109.421 179.937 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 345' ' ' ASN . . . . . . . . . . . . . 9.0 t-20 -56.86 -57.5 12.23 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.235 -0.915 . . . . 1.09 110.066 -179.669 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 346' ' ' GLU . . . . . . . . . . . . . 3.2 tt0 -61.12 -28.41 69.08 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.263 -0.898 . . . . 1.66 109.697 -179.569 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 347' ' ' ALA . . . . . 0.835 ' HB1' ' HB1' ' A' ' 347' ' ' ALA . . . -61.28 -59.94 4.52 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.189 -0.945 . . . . 0.17 110.047 -179.785 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 348' ' ' LEU . . . . . 0.593 HD22 ' N ' ' B' ' 348' ' ' LEU . 4.0 mm? -61.71 -43.74 98.28 Favored 'General case' 0 N--CA 1.494 1.743 0 O-C-N 121.356 -0.84 . . . . 0.29 109.994 -179.49 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 349' ' ' GLU . . . . . . . . . . . . . 1.8 mm-40 -56.75 -36.61 69.96 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.24 -0.912 . . . . 1.95 109.958 -179.419 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 350' ' ' LEU . . . . . 0.915 HD13 HD22 ' A' ' 350' ' ' LEU . 5.0 tt -63.42 -42.88 98.72 Favored 'General case' 0 N--CA 1.489 1.484 0 O-C-N 121.108 -0.995 . . . . 0.45 109.428 -179.777 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 351' ' ' LYS . . . . . . . . . . . . . 30.4 tttp -57.96 -35.92 71.83 Favored 'General case' 0 N--CA 1.489 1.481 0 O-C-N 121.07 -1.019 . . . . 1.38 109.135 179.832 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 352' ' ' ASP . . . . . . . . . . . . . 98.4 m-20 -57.05 -40.49 76.89 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.351 -0.843 . . . . 1.16 109.403 179.8 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 353' ' ' ALA . . . . . . . . . . . . . . . -67.71 -24.54 65.4 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.308 -0.87 . . . . 0.61 109.71 -179.763 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 354' ' ' GLN . . . . . . . . . . . . . 3.8 tt0 -81.02 -3.04 50.42 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.222 -0.924 . . . . 1.45 109.704 -179.875 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 355' ' ' ALA . . . . . 0.401 ' O ' ' HG3' ' B' ' 357' ' ' LYS . . . -69.06 -85.04 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.241 -0.912 . . . . 0.98 109.314 179.97 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 356' ' ' GLY . . . . . . . . . . . . . . . -60.46 99.05 0.16 Allowed Glycine 0 N--CA 1.492 2.391 0 N-CA-C 109.495 -1.442 . . . . 1.29 109.495 179.919 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 357' ' ' LYS . . . . . 0.401 ' HG3' ' O ' ' B' ' 355' ' ' ALA . 5.6 mttm -86.67 156.9 19.8 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.25 -1.147 . . . . 4.09 109.848 -179.766 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 358' ' ' GLU . . . . . 0.508 ' HB2' ' HD2' ' B' ' 359' ' ' PRO . 15.6 pt-20 -50.28 159.7 0.8 Allowed Pre-proline 0 N--CA 1.49 1.526 0 O-C-N 121.316 -0.865 . . . . 5.72 109.527 179.862 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 359' ' ' PRO . . . . . 0.508 ' HD2' ' HB2' ' B' ' 358' ' ' GLU . 1.9 Cg_endo -63.3 -80.98 0.01 OUTLIER 'Trans proline' 0 C--N 1.309 -1.518 0 C-N-CA 122.241 1.961 . . . . 4.98 109.973 179.568 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 360' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.207 0 N-CA-C 109.309 -1.517 . . . . 6.98 109.309 179.973 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' C' C ' 319' ' ' LYS . . . . . . . . . . . . . 13.2 mmtt . . . . . 0 N--CA 1.49 1.528 0 CA-C-O 121.232 0.539 . . . . 6.82 109.604 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' C' C ' 320' ' ' LYS . . . . . . . . . . . . . 5.4 mttt 65.26 12.65 8.21 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.313 -0.867 . . . . 6.49 109.651 179.878 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' C' C ' 321' ' ' LYS . . . . . 0.53 ' CB ' ' HD2' ' C' ' 322' ' ' PRO . 0.0 OUTLIER -80.12 173.91 6.97 Favored Pre-proline 0 N--CA 1.49 1.57 0 O-C-N 121.314 -0.866 . . . . 6.4 109.109 179.913 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' C' C ' 322' ' ' PRO . . . . . 0.53 ' HD2' ' CB ' ' C' ' 321' ' ' LYS . 4.6 Cg_exo -56.99 -152.98 0.0 OUTLIER 'Trans proline' 0 C--N 1.309 -1.516 0 C-N-CA 121.983 1.789 . . . . 3.42 110.128 -179.823 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' C' C ' 323' ' ' LEU . . . . . . . . . . . . . 61.0 mt -79.16 123.69 27.63 Favored 'General case' 0 N--CA 1.489 1.525 0 O-C-N 121.217 -0.927 . . . . 3.95 109.4 -179.961 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' C' C ' 324' ' ' ASP . . . . . . . . . . . . . 11.3 m-20 -79.32 -133.41 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.327 -0.858 . . . . 1.63 109.329 -179.8 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' C' C ' 325' ' ' GLY . . . . . . . . . . . . . . . -65.99 -174.25 5.28 Favored Glycine 0 N--CA 1.49 2.275 0 N-CA-C 109.273 -1.531 . . . . 0.73 109.273 -179.958 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' C' C ' 326' ' ' GLU . . . . . 0.42 ' HB3' ' CE1' ' C' ' 328' ' ' PHE . 6.8 mm-40 -58.0 -179.0 0.05 OUTLIER 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.142 -1.21 . . . . 2.17 109.561 -179.788 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' C' C ' 327' ' ' TYR . . . . . 0.534 ' CE1' ' HG2' ' A' ' 333' ' ' ARG . 46.1 m-85 -148.61 107.79 3.91 Favored 'General case' 0 N--CA 1.488 1.443 0 O-C-N 121.327 -0.858 . . . . 0.48 109.267 -179.982 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' C' C ' 328' ' ' PHE . . . . . 0.446 ' CZ ' ' HB2' ' A' ' 335' ' ' ARG . 14.4 m-85 -113.66 -167.84 1.26 Allowed 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.345 -0.847 . . . . 0.33 109.433 179.914 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' C' C ' 329' ' ' THR . . . . . . . . . . . . . 29.5 p -151.46 169.54 21.78 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.341 -0.849 . . . . 0.23 109.282 -180.0 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' C' C ' 330' ' ' LEU . . . . . . . . . . . . . 28.3 tp -150.62 123.32 8.59 Favored 'General case' 0 C--N 1.304 -1.398 0 O-C-N 121.264 -0.898 . . . . 0.28 109.509 -179.787 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' C' C ' 331' ' ' GLN . . . . . . . . . . . . . 1.2 tt0 -86.71 115.56 24.23 Favored 'General case' 0 N--CA 1.489 1.48 0 O-C-N 121.317 -0.865 . . . . 1.48 108.974 179.599 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' C' C ' 332' ' ' ILE . . . . . 0.709 HG21 ' HA ' ' C' ' 338' ' ' PHE . 84.2 mt -103.2 111.78 34.24 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.511 0 O-C-N 121.178 -0.951 . . . . 0.24 109.62 -179.552 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' C' C ' 333' ' ' ARG . . . . . 0.577 ' HG2' ' CE1' ' A' ' 327' ' ' TYR . 5.6 mtp180 -73.35 144.38 46.51 Favored 'General case' 0 N--CA 1.487 1.422 0 O-C-N 121.274 -0.891 . . . . 2.74 109.443 179.8 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' C' C ' 334' ' ' GLY . . . . . . . . . . . . . . . 75.99 123.76 0.17 Allowed Glycine 0 N--CA 1.49 2.293 0 N-CA-C 109.572 -1.411 . . . . 0.35 109.572 179.864 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' C' C ' 335' ' ' ARG . . . . . 0.511 ' HG2' ' NH1' ' C' ' 335' ' ' ARG . 0.7 OUTLIER -70.59 -24.89 62.84 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.296 -1.12 . . . . 2.53 109.858 -179.728 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' C' C ' 336' ' ' GLU . . . . . . . . . . . . . 18.4 mt-10 -56.25 -67.8 0.27 Allowed 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.169 -0.957 . . . . 2.62 109.737 -179.553 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' C' C ' 337' ' ' ARG . . . . . 0.479 ' HD2' ' N ' ' C' ' 337' ' ' ARG . 11.4 mpt_? -60.11 -30.22 69.12 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.245 -0.91 . . . . 2.81 109.774 -179.823 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' C' C ' 338' ' ' PHE . . . . . 0.709 ' HA ' HG21 ' C' ' 332' ' ' ILE . 57.8 t80 -54.67 -59.75 4.29 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.325 -0.859 . . . . 0.4 109.984 -179.634 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' C' C ' 339' ' ' GLU . . . . . . . . . . . . . 14.8 mt-10 -51.14 -34.47 31.24 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.256 -0.903 . . . . 2.05 110.306 -179.567 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' C' C ' 340' ' ' MET . . . . . . . . . . . . . 53.8 ttp -63.62 -50.45 69.32 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.089 -1.007 . . . . 0.32 109.956 -179.611 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' C' C ' 341' ' ' PHE . . . . . . . . . . . . . 65.2 m-85 -61.56 -45.41 94.26 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.243 -0.911 . . . . 0.18 109.948 -179.593 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' C' C ' 342' ' ' ARG . . . . . . . . . . . . . 1.9 tmt_? -48.98 -42.69 38.61 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.282 -0.886 . . . . 2.91 110.025 -179.59 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' C' C ' 343' ' ' GLU . . . . . . . . . . . . . 28.8 tt0 -59.61 -47.04 87.13 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.153 -0.967 . . . . 2.14 110.24 -179.373 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' C' C ' 344' ' ' LEU . . . . . 0.401 HD22 HD22 ' D' ' 344' ' ' LEU . 73.4 mt -61.78 -34.58 76.14 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.142 -0.974 . . . . 0.22 110.218 -179.44 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' C' C ' 345' ' ' ASN . . . . . 0.497 HD22 HD11 ' A' ' 330' ' ' LEU . 39.1 t30 -57.64 -55.66 31.91 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.094 -1.004 . . . . 1.08 109.944 -179.526 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' C' C ' 346' ' ' GLU . . . . . 0.486 ' O ' ' HB2' ' C' ' 350' ' ' LEU . 3.5 tt0 -59.94 -27.34 66.69 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.164 -0.96 . . . . 2.21 109.638 -179.635 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' C' C ' 347' ' ' ALA . . . . . 0.979 ' HB1' ' HB1' ' D' ' 347' ' ' ALA . . . -62.76 -58.06 8.77 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.169 -0.957 . . . . 0.18 110.076 -179.917 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' C' C ' 348' ' ' LEU . . . . . 0.582 HD22 ' N ' ' C' ' 348' ' ' LEU . 4.2 mm? -62.52 -50.25 72.13 Favored 'General case' 0 N--CA 1.494 1.739 0 O-C-N 121.276 -0.89 . . . . 0.32 110.42 -179.289 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' C' C ' 349' ' ' GLU . . . . . . . . . . . . . 67.5 mm-40 -57.18 -33.42 67.44 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.124 -0.985 . . . . 2.19 109.831 -179.242 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' C' C ' 350' ' ' LEU . . . . . 0.795 HD22 HD13 ' D' ' 350' ' ' LEU . 5.4 tt -62.81 -40.22 96.71 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.236 -0.915 . . . . 0.46 109.383 -179.902 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' C' C ' 351' ' ' LYS . . . . . 0.4 ' HE3' ' OE1' ' D' ' 346' ' ' GLU . 1.5 tttm -62.13 -47.77 83.08 Favored 'General case' 0 N--CA 1.488 1.455 0 O-C-N 121.207 -0.933 . . . . 1.35 110.169 -179.801 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' C' C ' 352' ' ' ASP . . . . . . . . . . . . . 77.5 m-20 -51.35 -27.18 9.06 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.199 -0.938 . . . . 1.19 109.247 -179.6 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' C' C ' 353' ' ' ALA . . . . . . . . . . . . . . . -67.65 -42.95 81.42 Favored 'General case' 0 N--CA 1.488 1.469 0 O-C-N 121.323 -0.861 . . . . 0.57 109.312 179.742 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' C' C ' 354' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -80.54 1.32 30.04 Favored 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.355 -0.841 . . . . 1.47 109.667 -179.978 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' C' C ' 355' ' ' ALA . . . . . . . . . . . . . . . -67.89 -83.66 0.03 OUTLIER 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.138 -0.976 . . . . 0.93 109.096 179.842 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' C' C ' 356' ' ' GLY . . . . . . . . . . . . . . . -66.79 95.37 0.27 Allowed Glycine 0 N--CA 1.489 2.183 0 N-CA-C 109.138 -1.585 . . . . 1.33 109.138 179.67 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' C' C ' 357' ' ' LYS . . . . . . . . . . . . . 2.1 ttpt -86.72 100.84 12.77 Favored 'General case' 0 N--CA 1.488 1.444 0 O-C-N 121.234 -1.157 . . . . 4.01 109.495 -179.781 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' C' C ' 358' ' ' GLU . . . . . 0.572 ' N ' ' HD2' ' C' ' 359' ' ' PRO . 2.5 mm-40 -50.65 -55.6 25.37 Favored Pre-proline 0 N--CA 1.489 1.495 0 O-C-N 121.274 -0.891 . . . . 5.75 110.051 -179.907 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' C' C ' 359' ' ' PRO . . . . . 0.572 ' HD2' ' N ' ' C' ' 358' ' ' GLU . 2.2 Cg_endo -61.77 109.95 0.87 Allowed 'Trans proline' 0 C--N 1.311 -1.405 0 C-N-CA 121.98 1.786 . . . . 4.94 110.3 -179.822 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' C' C ' 360' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.304 0 CA-C-O 118.0 -1.445 . . . . 6.5 109.531 179.856 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' D' D ' 319' ' ' LYS . . . . . . . . . . . . . 2.5 mmpp? . . . . . 0 N--CA 1.49 1.562 0 N-CA-C 109.11 -0.7 . . . . 7.53 109.11 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' D' D ' 320' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 61.8 157.2 0.05 OUTLIER 'General case' 0 N--CA 1.489 1.478 0 O-C-N 121.303 -0.873 . . . . 6.41 109.529 -179.805 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' D' D ' 321' ' ' LYS . . . . . 0.619 ' CB ' ' HD3' ' D' ' 322' ' ' PRO . 0.1 OUTLIER -159.61 -65.61 0.02 OUTLIER Pre-proline 0 N--CA 1.492 1.642 0 O-C-N 121.25 -0.906 . . . . 6.11 109.686 179.666 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' D' D ' 322' ' ' PRO . . . . . 0.619 ' HD3' ' CB ' ' D' ' 321' ' ' LYS . 3.5 Cg_exo -57.82 -159.27 0.02 OUTLIER 'Trans proline' 0 C--N 1.315 -1.237 0 C-N-CA 121.539 1.492 . . . . 2.82 110.109 179.859 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' D' D ' 323' ' ' LEU . . . . . . . . . . . . . 42.0 mt -80.35 137.56 36.58 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.25 -0.906 . . . . 2.83 109.133 179.9 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' D' D ' 324' ' ' ASP . . . . . . . . . . . . . 3.8 m-20 -79.13 -148.52 0.04 OUTLIER 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.221 -0.925 . . . . 1.54 109.398 -179.827 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' D' D ' 325' ' ' GLY . . . . . . . . . . . . . . . -67.56 177.72 20.95 Favored Glycine 0 N--CA 1.49 2.262 0 N-CA-C 109.241 -1.543 . . . . 0.59 109.241 -179.887 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' D' D ' 326' ' ' GLU . . . . . . . . . . . . . 3.2 mm-40 -57.57 -173.02 0.01 OUTLIER 'General case' 0 N--CA 1.488 1.473 0 O-C-N 121.223 -1.163 . . . . 2.13 109.028 179.886 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' D' D ' 327' ' ' TYR . . . . . 0.55 ' CE1' ' HG2' ' B' ' 333' ' ' ARG . 47.2 m-85 -149.03 103.05 3.31 Favored 'General case' 0 N--CA 1.488 1.442 0 O-C-N 121.219 -0.926 . . . . 0.47 109.357 179.815 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' D' D ' 328' ' ' PHE . . . . . . . . . . . . . 39.5 m-85 -107.61 -168.5 1.39 Allowed 'General case' 0 N--CA 1.489 1.477 0 O-C-N 121.286 -0.884 . . . . 0.3 109.248 -179.953 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' D' D ' 329' ' ' THR . . . . . . . . . . . . . 7.1 p -152.04 166.97 29.95 Favored 'General case' 0 N--CA 1.488 1.457 0 O-C-N 121.259 -0.9 . . . . 0.22 109.144 179.942 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' D' D ' 330' ' ' LEU . . . . . . . . . . . . . 18.0 tp -148.9 130.75 15.16 Favored 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.184 -0.948 . . . . 0.28 109.778 -179.605 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' D' D ' 331' ' ' GLN . . . . . . . . . . . . . 19.3 tp60 -89.06 111.18 21.86 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.509 -0.744 . . . . 0.93 109.545 179.814 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' D' D ' 332' ' ' ILE . . . . . 0.51 HG21 ' HA ' ' D' ' 338' ' ' PHE . 74.0 mt -103.49 111.77 34.45 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.568 0 O-C-N 121.073 -1.017 . . . . 0.25 109.579 179.921 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' D' D ' 333' ' ' ARG . . . . . 0.556 ' HG2' ' CE1' ' B' ' 327' ' ' TYR . 68.2 mtt180 -74.07 151.56 40.14 Favored 'General case' 0 N--CA 1.488 1.451 0 O-C-N 121.221 -0.924 . . . . 2.93 109.7 179.901 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' D' D ' 334' ' ' GLY . . . . . . . . . . . . . . . 76.03 130.8 0.35 Allowed Glycine 0 N--CA 1.491 2.338 0 N-CA-C 109.663 -1.375 . . . . 0.41 109.663 179.798 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' D' D ' 335' ' ' ARG . . . . . . . . . . . . . 35.9 ttt180 -78.61 -31.99 47.31 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.309 -1.113 . . . . 3.03 109.715 -179.934 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' D' D ' 336' ' ' GLU . . . . . . . . . . . . . 2.1 mt-10 -57.44 -61.86 2.19 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.173 -0.954 . . . . 2.26 109.832 -179.732 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' D' D ' 337' ' ' ARG . . . . . 0.408 HH11 ' HG2' ' D' ' 337' ' ' ARG . 1.5 mmt-85 -60.3 -31.74 70.55 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.172 -0.955 . . . . 2.92 109.593 -179.831 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' D' D ' 338' ' ' PHE . . . . . 0.51 ' HA ' HG21 ' D' ' 332' ' ' ILE . 63.6 t80 -56.24 -58.19 9.01 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.347 -0.845 . . . . 0.37 109.739 179.898 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' D' D ' 339' ' ' GLU . . . . . . . . . . . . . 43.1 mt-10 -51.59 -31.67 25.72 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.257 -0.902 . . . . 1.99 109.901 -179.767 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' D' D ' 340' ' ' MET . . . . . . . . . . . . . 39.8 ttp -63.8 -50.68 68.02 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.244 -0.91 . . . . 0.31 109.768 -179.695 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' D' D ' 341' ' ' PHE . . . . . . . . . . . . . 40.3 m-85 -62.55 -41.92 99.2 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.234 -0.916 . . . . 0.18 110.086 -179.725 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' D' D ' 342' ' ' ARG . . . . . 0.558 ' NH1' ' HG2' ' D' ' 342' ' ' ARG . 0.2 OUTLIER -50.33 -42.56 53.03 Favored 'General case' 0 N--CA 1.492 1.675 0 O-C-N 121.125 -0.984 . . . . 2.41 109.843 -179.598 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' D' D ' 343' ' ' GLU . . . . . . . . . . . . . 2.2 tp10 -57.92 -45.65 86.2 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.239 -0.913 . . . . 2.35 109.652 -179.686 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' D' D ' 344' ' ' LEU . . . . . 0.401 HD22 HD22 ' C' ' 344' ' ' LEU . 36.0 mt -62.04 -34.13 75.66 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.223 -0.923 . . . . 0.19 109.398 -179.956 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' D' D ' 345' ' ' ASN . . . . . . . . . . . . . 9.2 t-20 -56.54 -58.13 9.35 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.277 -0.889 . . . . 1.09 109.95 -179.876 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' D' D ' 346' ' ' GLU . . . . . 0.4 ' OE1' ' HE3' ' C' ' 351' ' ' LYS . 3.1 tt0 -60.19 -28.95 68.38 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.269 -0.894 . . . . 1.69 109.704 -179.484 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' D' D ' 347' ' ' ALA . . . . . 0.979 ' HB1' ' HB1' ' C' ' 347' ' ' ALA . . . -61.1 -59.77 4.82 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.228 -0.92 . . . . 0.18 110.108 -179.766 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' D' D ' 348' ' ' LEU . . . . . 0.595 HD22 ' N ' ' D' ' 348' ' ' LEU . 4.0 mm? -61.71 -44.28 97.24 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.138 -0.976 . . . . 0.31 109.959 -179.39 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' D' D ' 349' ' ' GLU . . . . . . . . . . . . . 1.8 mm-40 -56.14 -36.69 68.55 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.175 -0.953 . . . . 1.95 109.892 -179.381 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' D' D ' 350' ' ' LEU . . . . . 0.795 HD13 HD22 ' C' ' 350' ' ' LEU . 5.1 tt -63.34 -42.48 98.94 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.169 -0.957 . . . . 0.43 109.467 -179.716 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' D' D ' 351' ' ' LYS . . . . . . . . . . . . . 30.9 tttp -58.63 -35.79 73.05 Favored 'General case' 0 N--CA 1.489 1.486 0 O-C-N 121.135 -0.978 . . . . 1.4 109.076 179.884 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' D' D ' 352' ' ' ASP . . . . . . . . . . . . . 98.6 m-20 -56.82 -40.45 76.03 Favored 'General case' 0 N--CA 1.488 1.47 0 O-C-N 121.345 -0.847 . . . . 1.17 109.479 179.729 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' D' D ' 353' ' ' ALA . . . . . . . . . . . . . . . -68.03 -24.54 65.11 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.334 -0.854 . . . . 0.59 109.737 -179.756 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' D' D ' 354' ' ' GLN . . . . . 0.479 HE22 HD11 ' C' ' 350' ' ' LEU . 3.9 tt0 -80.95 -3.33 51.17 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.205 -0.934 . . . . 1.44 109.544 -179.914 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' D' D ' 355' ' ' ALA . . . . . . . . . . . . . . . -68.85 -84.9 0.02 OUTLIER 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.192 -0.942 . . . . 0.98 109.482 -179.994 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' D' D ' 356' ' ' GLY . . . . . . . . . . . . . . . -60.56 99.02 0.16 Allowed Glycine 0 N--CA 1.491 2.324 0 N-CA-C 109.292 -1.523 . . . . 1.28 109.292 -179.998 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' D' D ' 357' ' ' LYS . . . . . . . . . . . . . 4.6 mttm -87.22 156.45 19.66 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.2 -1.176 . . . . 4.09 109.908 -179.747 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' D' D ' 358' ' ' GLU . . . . . 0.49 ' HB2' ' HD2' ' D' ' 359' ' ' PRO . 16.1 pt-20 -49.6 159.39 0.7 Allowed Pre-proline 0 N--CA 1.489 1.498 0 O-C-N 121.565 -0.71 . . . . 5.71 109.781 -179.975 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' D' D ' 359' ' ' PRO . . . . . 0.49 ' HD2' ' HB2' ' D' ' 358' ' ' GLU . 1.6 Cg_endo -63.76 -80.54 0.01 OUTLIER 'Trans proline' 0 C--N 1.309 -1.546 0 C-N-CA 122.223 1.949 . . . . 4.97 109.846 179.705 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' D' D ' 360' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.305 0 CA-C-O 118.024 -1.431 . . . . 6.97 109.691 179.928 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 319' ' ' LYS . . . . . . . . . . . . . 1.4 mtmt . . . . . 0 N--CA 1.49 1.537 0 N-CA-C 109.414 -0.588 . . . . 7.55 109.414 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 320' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 63.01 -140.0 0.38 Allowed 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.153 -0.967 . . . . 6.43 109.58 179.884 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 321' ' ' LYS . . . . . . . . . . . . . 2.2 ttmt -155.47 103.68 2.19 Favored Pre-proline 0 N--CA 1.49 1.565 0 O-C-N 121.001 -1.062 . . . . 6.13 109.41 -179.79 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 322' ' ' PRO . . . . . . . . . . . . . 2.9 Cg_endo -69.18 5.93 1.3 Allowed 'Trans proline' 0 C--N 1.313 -1.318 0 C-N-CA 122.425 2.083 . . . . 2.83 111.494 -179.905 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 323' ' ' LEU . . . . . . . . . . . . . 11.3 mt -83.5 58.55 4.61 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 120.802 -1.186 . . . . 2.83 110.011 -179.682 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 324' ' ' ASP . . . . . . . . . . . . . 26.4 m-20 -80.83 165.5 21.8 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.061 -1.024 . . . . 1.53 109.365 179.648 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 325' ' ' GLY . . . . . . . . . . . . . . . -68.44 -179.7 19.0 Favored Glycine 0 N--CA 1.49 2.277 0 N-CA-C 109.349 -1.5 . . . . 0.61 109.349 179.924 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 326' ' ' GLU . . . . . . . . . . . . . 1.8 mm-40 -57.3 -173.19 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.219 -1.166 . . . . 2.13 109.241 179.969 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 327' ' ' TYR . . . . . 0.589 ' CE1' ' HG2' ' C' ' 333' ' ' ARG . 46.6 m-85 -149.14 105.31 3.5 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.129 -0.982 . . . . 0.48 109.767 -179.769 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 328' ' ' PHE . . . . . 0.552 ' CZ ' ' HD3' ' C' ' 335' ' ' ARG . 97.3 m-85 -112.28 -163.71 0.87 Allowed 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.388 -0.82 . . . . 0.31 109.407 179.801 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 329' ' ' THR . . . . . 0.449 ' HA ' ' O ' ' C' ' 330' ' ' LEU . 74.4 p -154.58 166.34 33.65 Favored 'General case' 0 N--CA 1.489 1.487 0 O-C-N 121.278 -0.889 . . . . 0.22 109.032 179.812 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 330' ' ' LEU . . . . . 0.421 ' O ' ' HA ' ' C' ' 329' ' ' THR . 32.9 tp -151.06 131.96 14.18 Favored 'General case' 0 N--CA 1.488 1.449 0 O-C-N 121.119 -0.988 . . . . 0.28 109.886 -179.775 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 331' ' ' GLN . . . . . . . . . . . . . 19.4 tp60 -86.87 114.84 23.85 Favored 'General case' 0 N--CA 1.488 1.449 0 O-C-N 121.318 -0.864 . . . . 0.91 109.121 179.688 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 332' ' ' ILE . . . . . 0.554 HG21 ' HA ' ' A' ' 338' ' ' PHE . 52.1 mt -103.26 107.22 21.66 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.572 0 O-C-N 121.215 -0.928 . . . . 0.26 109.659 -179.797 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 333' ' ' ARG . . . . . 0.532 ' HG2' ' CE1' ' C' ' 327' ' ' TYR . 9.9 mtp180 -72.49 140.04 48.0 Favored 'General case' 0 N--CA 1.488 1.447 0 O-C-N 121.252 -0.905 . . . . 2.92 109.45 179.897 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 334' ' ' GLY . . . . . . . . . . . . . . . 88.88 127.53 2.98 Favored Glycine 0 N--CA 1.49 2.297 0 N-CA-C 109.723 -1.351 . . . . 0.4 109.723 -179.991 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 335' ' ' ARG . . . . . 0.484 ' HB2' ' OE1' ' C' ' 326' ' ' GLU . 8.0 ttt180 -78.33 -34.62 48.48 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.265 -1.138 . . . . 3.01 109.636 179.956 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 336' ' ' GLU . . . . . . . . . . . . . 9.3 tt0 -57.89 -62.33 1.89 Allowed 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.166 -0.959 . . . . 2.29 109.714 -179.862 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 337' ' ' ARG . . . . . 0.512 ' NH1' ' HG2' ' A' ' 337' ' ' ARG . 0.0 OUTLIER -60.97 -27.39 68.23 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.202 -0.936 . . . . 2.93 109.717 -179.746 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 338' ' ' PHE . . . . . 0.554 ' HA ' HG21 ' A' ' 332' ' ' ILE . 52.0 t80 -54.08 -64.73 0.73 Allowed 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.239 -0.913 . . . . 0.38 109.651 -179.727 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 339' ' ' GLU . . . . . . . . . . . . . 43.2 mt-10 -50.62 -29.04 9.99 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.245 -0.909 . . . . 1.97 109.681 -179.739 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 340' ' ' MET . . . . . 0.448 ' HB3' ' O ' ' A' ' 337' ' ' ARG . 6.9 ttp -64.43 -52.29 58.81 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.17 -0.956 . . . . 0.31 109.851 -179.853 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 341' ' ' PHE . . . . . . . . . . . . . 40.4 m-85 -62.54 -44.61 95.93 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.313 -0.867 . . . . 0.18 110.068 -179.687 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 342' ' ' ARG . . . . . . . . . . . . . 1.8 ttp180 -49.82 -41.87 45.85 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.102 -0.999 . . . . 2.42 109.867 -179.598 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 343' ' ' GLU . . . . . . . . . . . . . 38.4 tt0 -59.06 -47.19 86.15 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.194 -0.941 . . . . 2.35 109.882 -179.697 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 344' ' ' LEU . . . . . 0.411 HD22 HD22 ' B' ' 344' ' ' LEU . 78.6 mt -62.71 -32.56 73.68 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.213 -0.929 . . . . 0.18 109.925 -179.65 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 345' ' ' ASN . . . . . 0.514 ' HA ' ' CZ ' ' C' ' 341' ' ' PHE . 53.8 t-20 -57.03 -56.09 26.26 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.203 -0.936 . . . . 1.09 110.064 -179.641 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 346' ' ' GLU . . . . . . . . . . . . . 3.9 tp10 -61.48 -26.79 68.13 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.145 -0.972 . . . . 1.65 110.089 -179.397 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 347' ' ' ALA . . . . . 0.984 ' HB1' ' HB1' ' B' ' 347' ' ' ALA . . . -61.41 -58.31 8.72 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.081 -1.012 . . . . 0.18 110.182 -179.618 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 348' ' ' LEU . . . . . 0.58 HD22 ' N ' ' A' ' 348' ' ' LEU . 4.0 mm? -62.1 -50.72 70.8 Favored 'General case' 0 N--CA 1.494 1.773 0 O-C-N 121.183 -0.948 . . . . 0.3 110.323 -179.287 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 349' ' ' GLU . . . . . . . . . . . . . 66.6 mt-10 -57.15 -30.87 64.81 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.184 -0.948 . . . . 1.94 110.055 -179.149 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 350' ' ' LEU . . . . . 0.616 HD22 HD22 ' B' ' 350' ' ' LEU . 8.9 tt -65.06 -45.59 84.68 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.147 -0.971 . . . . 0.46 109.579 -179.876 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 351' ' ' LYS . . . . . . . . . . . . . 41.1 tttm -57.35 -43.19 83.23 Favored 'General case' 0 N--CA 1.488 1.45 0 O-C-N 121.337 -0.852 . . . . 1.4 109.541 -179.441 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 352' ' ' ASP . . . . . . . . . . . . . 14.3 m-20 -55.85 -54.86 39.43 Favored 'General case' 0 N--CA 1.488 1.46 0 O-C-N 121.214 -0.929 . . . . 1.16 109.583 179.976 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 353' ' ' ALA . . . . . . . . . . . . . . . -68.47 -11.48 59.84 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.227 -0.921 . . . . 0.63 109.8 -179.832 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 354' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -84.89 -16.38 41.38 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.167 -0.958 . . . . 1.47 109.723 -179.771 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 355' ' ' ALA . . . . . . . . . . . . . . . -73.84 -18.22 60.97 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.191 -0.943 . . . . 1.01 109.52 179.989 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 356' ' ' GLY . . . . . . . . . . . . . . . -80.59 3.13 75.58 Favored Glycine 0 N--CA 1.491 2.354 0 N-CA-C 109.82 -1.312 . . . . 1.3 109.82 -179.987 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 357' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -91.63 -44.51 8.99 Favored 'General case' 0 N--CA 1.489 1.489 0 O-C-N 121.095 -1.238 . . . . 4.1 109.763 -179.729 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 358' ' ' GLU . . . . . . . . . . . . . 57.2 tt0 -48.62 134.77 13.49 Favored Pre-proline 0 N--CA 1.49 1.528 0 O-C-N 121.142 -0.974 . . . . 5.75 109.258 -179.95 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 359' ' ' PRO . . . . . . . . . . . . . 2.3 Cg_endo -62.44 -175.25 0.19 Allowed 'Trans proline' 0 C--N 1.312 -1.394 0 C-N-CA 122.008 1.806 . . . . 5.0 110.233 -179.956 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 360' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.277 0 CA-C-O 117.992 -1.449 . . . . 6.97 109.536 179.98 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' B' B ' 319' ' ' LYS . . . . . . . . . . . . . 1.4 mtmt . . . . . 0 N--CA 1.489 1.501 0 N-CA-C 109.479 -0.563 . . . . 7.55 109.479 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' B' B ' 320' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 63.26 -139.81 0.36 Allowed 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.253 -0.904 . . . . 6.44 109.501 179.821 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 321' ' ' LYS . . . . . . . . . . . . . 2.3 ttmt -155.68 103.64 2.15 Favored Pre-proline 0 N--CA 1.491 1.576 0 O-C-N 121.059 -1.026 . . . . 6.13 109.393 -179.879 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 322' ' ' PRO . . . . . . . . . . . . . 3.1 Cg_endo -69.18 5.96 1.29 Allowed 'Trans proline' 0 C--N 1.314 -1.239 0 C-N-CA 122.392 2.062 . . . . 2.82 111.572 -179.939 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 323' ' ' LEU . . . . . . . . . . . . . 11.3 mt -83.54 58.6 4.65 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 120.929 -1.107 . . . . 2.84 110.08 -179.692 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 324' ' ' ASP . . . . . . . . . . . . . 26.5 m-20 -81.03 164.96 22.11 Favored 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.022 -1.049 . . . . 1.53 109.27 179.743 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 325' ' ' GLY . . . . . . . . . . . . . . . -67.61 -179.7 15.0 Favored Glycine 0 N--CA 1.49 2.262 0 N-CA-C 109.447 -1.461 . . . . 0.59 109.447 179.873 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 326' ' ' GLU . . . . . . . . . . . . . 1.8 mm-40 -57.39 -173.12 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.158 -1.201 . . . . 2.13 109.204 179.83 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 327' ' ' TYR . . . . . 0.58 ' CE1' ' HG2' ' D' ' 333' ' ' ARG . 46.2 m-85 -149.18 105.26 3.49 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.096 -1.003 . . . . 0.48 109.812 -179.79 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 328' ' ' PHE . . . . . 0.417 ' C ' HG23 ' B' ' 329' ' ' THR . 97.2 m-85 -112.16 -163.69 0.87 Allowed 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.375 -0.828 . . . . 0.32 109.471 179.783 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 329' ' ' THR . . . . . 0.417 HG23 ' C ' ' B' ' 328' ' ' PHE . 73.8 p -154.59 166.33 33.7 Favored 'General case' 0 N--CA 1.489 1.488 0 O-C-N 121.283 -0.886 . . . . 0.23 108.986 179.788 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 330' ' ' LEU . . . . . . . . . . . . . 32.5 tp -151.07 131.93 14.15 Favored 'General case' 0 N--CA 1.489 1.481 0 O-C-N 121.102 -0.999 . . . . 0.28 109.857 -179.809 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 331' ' ' GLN . . . . . . . . . . . . . 19.5 tp60 -86.89 114.97 23.97 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.358 -0.839 . . . . 0.91 109.081 179.688 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 332' ' ' ILE . . . . . 0.552 HG21 ' HA ' ' B' ' 338' ' ' PHE . 52.2 mt -103.38 106.9 20.99 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.58 0 O-C-N 121.248 -0.908 . . . . 0.24 109.677 -179.769 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 333' ' ' ARG . . . . . 0.489 ' HG2' ' CE1' ' D' ' 327' ' ' TYR . 9.8 mtp180 -72.22 140.05 48.49 Favored 'General case' 0 N--CA 1.489 1.497 0 O-C-N 121.259 -0.901 . . . . 2.93 109.414 179.756 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 334' ' ' GLY . . . . . . . . . . . . . . . 88.95 127.45 2.98 Favored Glycine 0 N--CA 1.491 2.361 0 N-CA-C 109.72 -1.352 . . . . 0.4 109.72 179.851 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 335' ' ' ARG . . . . . 0.474 ' O ' ' HB3' ' B' ' 338' ' ' PHE . 8.2 ttt180 -78.14 -34.77 49.65 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.303 -1.116 . . . . 3.01 109.576 179.991 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 336' ' ' GLU . . . . . . . . . . . . . 9.2 tt0 -57.79 -62.36 1.86 Allowed 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.265 -0.897 . . . . 2.28 109.771 -179.787 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 337' ' ' ARG . . . . . 0.519 ' HG2' ' NH1' ' B' ' 337' ' ' ARG . 0.0 OUTLIER -60.85 -27.55 68.19 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.258 -0.901 . . . . 2.93 109.827 -179.801 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' B' B ' 338' ' ' PHE . . . . . 0.552 ' HA ' HG21 ' B' ' 332' ' ' ILE . 52.2 t80 -53.92 -64.87 0.69 Allowed 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.284 -0.885 . . . . 0.37 109.669 -179.772 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 339' ' ' GLU . . . . . . . . . . . . . 42.7 mt-10 -50.5 -28.94 9.36 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.256 -0.902 . . . . 1.98 109.77 -179.775 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 340' ' ' MET . . . . . 0.45 ' HB3' ' O ' ' B' ' 337' ' ' ARG . 6.9 ttp -64.54 -52.2 58.91 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.182 -0.949 . . . . 0.32 109.79 -179.8 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 341' ' ' PHE . . . . . 0.546 ' CZ ' ' HA ' ' D' ' 345' ' ' ASN . 39.9 m-85 -62.66 -44.53 96.03 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.243 -0.911 . . . . 0.18 110.019 -179.624 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 342' ' ' ARG . . . . . . . . . . . . . 1.8 ttp180 -49.93 -41.79 47.04 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.156 -0.965 . . . . 2.42 109.918 -179.618 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 343' ' ' GLU . . . . . . . . . . . . . 37.4 tt0 -59.24 -47.15 86.42 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.181 -0.949 . . . . 2.35 109.793 -179.645 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 344' ' ' LEU . . . . . 0.411 HD22 HD22 ' A' ' 344' ' ' LEU . 79.3 mt -62.71 -32.46 73.57 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.129 -0.982 . . . . 0.18 109.825 -179.645 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 345' ' ' ASN . . . . . 0.461 ' HA ' ' CZ ' ' D' ' 341' ' ' PHE . 54.1 t-20 -57.22 -56.04 27.0 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.22 -0.925 . . . . 1.09 110.014 -179.585 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 346' ' ' GLU . . . . . . . . . . . . . 3.9 tp10 -61.49 -26.66 68.06 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.259 -0.9 . . . . 1.66 110.011 -179.443 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 347' ' ' ALA . . . . . 0.984 ' HB1' ' HB1' ' A' ' 347' ' ' ALA . . . -61.53 -58.34 8.53 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.124 -0.985 . . . . 0.17 110.17 -179.623 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 348' ' ' LEU . . . . . 0.584 HD22 ' N ' ' B' ' 348' ' ' LEU . 4.0 mm? -62.11 -50.75 70.65 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.192 -0.943 . . . . 0.29 110.327 -179.267 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 349' ' ' GLU . . . . . . . . . . . . . 66.7 mt-10 -57.09 -30.93 64.75 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.185 -0.947 . . . . 1.95 110.084 -179.15 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 350' ' ' LEU . . . . . 0.616 HD22 HD22 ' A' ' 350' ' ' LEU . 8.9 tt -65.01 -45.54 85.1 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.151 -0.968 . . . . 0.45 109.601 -179.923 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 351' ' ' LYS . . . . . . . . . . . . . 40.8 tttm -57.33 -43.17 83.13 Favored 'General case' 0 N--CA 1.489 1.497 0 O-C-N 121.268 -0.895 . . . . 1.38 109.618 -179.45 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 352' ' ' ASP . . . . . . . . . . . . . 14.4 m-20 -55.91 -54.88 39.32 Favored 'General case' 0 N--CA 1.489 1.478 0 O-C-N 121.208 -0.932 . . . . 1.16 109.56 179.902 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 353' ' ' ALA . . . . . . . . . . . . . . . -68.44 -11.61 59.98 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.215 -0.928 . . . . 0.61 109.802 -179.78 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 354' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -84.62 -16.55 41.65 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.167 -0.958 . . . . 1.45 109.727 -179.779 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 355' ' ' ALA . . . . . . . . . . . . . . . -73.79 -18.22 60.99 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.231 -0.918 . . . . 0.98 109.571 179.99 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 356' ' ' GLY . . . . . . . . . . . . . . . -80.53 3.17 75.07 Favored Glycine 0 N--CA 1.492 2.379 0 N-CA-C 109.842 -1.303 . . . . 1.29 109.842 179.992 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 357' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -91.72 -44.4 9.02 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.114 -1.227 . . . . 4.09 109.669 -179.667 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 358' ' ' GLU . . . . . . . . . . . . . 56.9 tt0 -48.7 134.83 13.72 Favored Pre-proline 0 N--CA 1.491 1.586 0 O-C-N 121.047 -1.033 . . . . 5.72 109.253 -179.842 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 359' ' ' PRO . . . . . . . . . . . . . 2.2 Cg_endo -62.53 -175.25 0.19 Allowed 'Trans proline' 0 C--N 1.311 -1.437 0 C-N-CA 122.046 1.831 . . . . 4.98 110.183 -179.946 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 360' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.214 0 CA-C-O 117.944 -1.476 . . . . 6.98 109.595 -179.989 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' C' C ' 319' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.49 1.539 0 N-CA-C 109.43 -0.582 . . . . 6.82 109.43 . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' C' C ' 320' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 54.93 79.19 0.15 Allowed 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.233 -0.917 . . . . 6.49 109.341 -179.85 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' C' C ' 321' ' ' LYS . . . . . 0.555 ' N ' ' HD3' ' C' ' 322' ' ' PRO . 0.1 OUTLIER -156.47 57.73 1.5 Allowed Pre-proline 0 N--CA 1.49 1.541 0 O-C-N 121.377 -0.827 . . . . 6.4 109.347 179.868 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' C' C ' 322' ' ' PRO . . . . . 0.555 ' HD3' ' N ' ' C' ' 321' ' ' LYS . 1.6 Cg_endo -62.35 153.48 70.19 Favored 'Trans proline' 0 C--N 1.311 -1.435 0 C-N-CA 122.327 2.018 . . . . 3.42 110.264 -179.822 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' C' C ' 323' ' ' LEU . . . . . 0.41 HD23 ' HA ' ' C' ' 323' ' ' LEU . 30.4 mt -80.24 132.13 35.8 Favored 'General case' 0 N--CA 1.488 1.455 0 O-C-N 121.364 -0.835 . . . . 3.95 109.241 179.564 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' C' C ' 324' ' ' ASP . . . . . 0.502 ' CB ' ' OH ' ' C' ' 327' ' ' TYR . 37.0 m-20 -78.64 158.63 28.37 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.214 -0.929 . . . . 1.63 109.376 -179.917 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' C' C ' 325' ' ' GLY . . . . . . . . . . . . . . . -67.86 -172.08 6.24 Favored Glycine 0 N--CA 1.489 2.187 0 N-CA-C 109.354 -1.498 . . . . 0.73 109.354 -179.987 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' C' C ' 326' ' ' GLU . . . . . 0.484 ' OE1' ' HB2' ' A' ' 335' ' ' ARG . 2.3 mt-10 -58.11 -172.78 0.01 OUTLIER 'General case' 0 N--CA 1.488 1.463 0 O-C-N 121.235 -1.156 . . . . 2.17 109.415 -179.933 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' C' C ' 327' ' ' TYR . . . . . 0.532 ' CE1' ' HG2' ' A' ' 333' ' ' ARG . 42.6 m-85 -148.98 103.41 3.35 Favored 'General case' 0 N--CA 1.489 1.493 0 O-C-N 121.269 -0.894 . . . . 0.48 109.175 179.941 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' C' C ' 328' ' ' PHE . . . . . . . . . . . . . 52.9 m-85 -107.13 -167.41 1.27 Allowed 'General case' 0 N--CA 1.488 1.469 0 O-C-N 121.292 -0.88 . . . . 0.33 109.378 -179.944 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' C' C ' 329' ' ' THR . . . . . 0.421 ' HA ' ' O ' ' A' ' 330' ' ' LEU . 4.5 p -152.07 167.85 27.16 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.26 -0.9 . . . . 0.23 109.043 179.907 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' C' C ' 330' ' ' LEU . . . . . 0.449 ' O ' ' HA ' ' A' ' 329' ' ' THR . 27.0 tp -151.15 129.5 12.04 Favored 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.127 -0.983 . . . . 0.28 109.946 -179.525 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' C' C ' 331' ' ' GLN . . . . . 0.493 ' NE2' ' HB3' ' A' ' 327' ' ' TYR . 0.8 OUTLIER -89.41 114.91 26.43 Favored 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.3 -0.875 . . . . 1.48 109.438 179.724 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' C' C ' 332' ' ' ILE . . . . . 0.478 HD12 ' CD1' ' C' ' 338' ' ' PHE . 60.2 mt -103.76 113.29 40.23 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.622 0 O-C-N 121.11 -0.994 . . . . 0.24 109.648 179.964 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' C' C ' 333' ' ' ARG . . . . . 0.589 ' HG2' ' CE1' ' A' ' 327' ' ' TYR . 34.7 mtt180 -73.44 139.91 46.15 Favored 'General case' 0 N--CA 1.489 1.478 0 O-C-N 121.171 -0.956 . . . . 2.74 109.443 179.772 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' C' C ' 334' ' ' GLY . . . . . . . . . . . . . . . 81.43 125.64 0.75 Allowed Glycine 0 N--CA 1.491 2.325 0 N-CA-C 109.597 -1.401 . . . . 0.35 109.597 179.946 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' C' C ' 335' ' ' ARG . . . . . 0.552 ' HD3' ' CZ ' ' A' ' 328' ' ' PHE . 0.0 OUTLIER -76.57 -25.57 54.16 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.194 -1.18 . . . . 2.53 109.696 -179.986 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' C' C ' 336' ' ' GLU . . . . . . . . . . . . . 1.9 tt0 -55.85 -69.49 0.14 Allowed 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.135 -0.978 . . . . 2.62 109.72 -179.716 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' C' C ' 337' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -60.72 -23.83 65.21 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.164 -0.96 . . . . 2.81 109.566 -179.862 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' C' C ' 338' ' ' PHE . . . . . 0.478 ' CD1' HD12 ' C' ' 332' ' ' ILE . 61.2 t80 -54.67 -59.4 4.76 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.215 -0.928 . . . . 0.4 109.491 -179.971 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' C' C ' 339' ' ' GLU . . . . . . . . . . . . . 2.1 mt-10 -52.1 -33.37 39.22 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.231 -0.918 . . . . 2.05 109.945 -179.794 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' C' C ' 340' ' ' MET . . . . . . . . . . . . . 41.5 ttp -63.21 -50.73 69.12 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.067 -1.021 . . . . 0.32 109.896 -179.618 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' C' C ' 341' ' ' PHE . . . . . 0.514 ' CZ ' ' HA ' ' A' ' 345' ' ' ASN . 46.9 m-85 -62.16 -50.34 72.23 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.142 -0.974 . . . . 0.18 109.785 -179.796 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' C' C ' 342' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -48.19 -42.2 29.2 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.224 -0.923 . . . . 2.91 110.068 -179.61 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' C' C ' 343' ' ' GLU . . . . . . . . . . . . . 10.2 tp10 -57.9 -48.1 80.85 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.251 -0.905 . . . . 2.14 109.618 -179.673 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' C' C ' 344' ' ' LEU . . . . . . . . . . . . . 79.6 mt -62.33 -26.51 68.47 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.292 -0.88 . . . . 0.22 109.603 -179.95 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' C' C ' 345' ' ' ASN . . . . . 0.414 HD22 HD11 ' A' ' 330' ' ' LEU . 56.9 t-20 -58.5 -57.63 12.11 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.288 -0.883 . . . . 1.08 110.019 -179.786 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' C' C ' 346' ' ' GLU . . . . . 0.469 ' O ' ' HG2' ' C' ' 346' ' ' GLU . 25.4 tt0 -60.96 -27.81 68.53 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.185 -0.947 . . . . 2.21 110.043 -179.415 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' C' C ' 347' ' ' ALA . . . . . 0.896 ' HB1' ' HB1' ' D' ' 347' ' ' ALA . . . -61.93 -58.4 8.07 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.037 -1.039 . . . . 0.18 110.276 -179.498 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' C' C ' 348' ' ' LEU . . . . . 0.535 HD22 ' N ' ' C' ' 348' ' ' LEU . 3.7 mm? -62.09 -48.94 77.96 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.206 -0.934 . . . . 0.32 110.538 -179.065 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' C' C ' 349' ' ' GLU . . . . . . . . . . . . . 16.5 mm-40 -57.49 -34.99 69.64 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.091 -1.005 . . . . 2.19 110.267 -179.135 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' C' C ' 350' ' ' LEU . . . . . 0.64 HD22 HD22 ' D' ' 350' ' ' LEU . 8.5 tt -64.48 -40.46 95.73 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.056 -1.028 . . . . 0.46 109.563 -179.794 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' C' C ' 351' ' ' LYS . . . . . 0.408 ' NZ ' ' HG3' ' D' ' 343' ' ' GLU . 7.0 ttmt -59.33 -48.97 79.62 Favored 'General case' 0 N--CA 1.489 1.477 0 O-C-N 121.293 -0.879 . . . . 1.35 109.612 -179.837 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' C' C ' 352' ' ' ASP . . . . . . . . . . . . . 62.1 m-20 -56.94 -54.57 45.15 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.338 -0.851 . . . . 1.19 110.232 -179.732 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' C' C ' 353' ' ' ALA . . . . . . . . . . . . . . . -67.33 -10.87 55.18 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.141 -0.975 . . . . 0.57 110.063 -179.327 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' C' C ' 354' ' ' GLN . . . . . 0.416 ' O ' ' HG2' ' C' ' 354' ' ' GLN . 6.6 tt0 -84.13 -12.79 54.4 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.105 -0.997 . . . . 1.47 109.852 -179.845 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' C' C ' 355' ' ' ALA . . . . . . . . . . . . . . . -71.68 -9.39 58.18 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.106 -0.996 . . . . 0.93 109.437 179.907 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' C' C ' 356' ' ' GLY . . . . . . . . . . . . . . . -81.09 11.72 41.24 Favored Glycine 0 N--CA 1.49 2.251 0 N-CA-C 110.31 -1.116 . . . . 1.33 110.31 -179.869 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' C' C ' 357' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -85.07 98.0 10.18 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 120.897 -1.355 . . . . 4.01 109.435 -179.849 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' C' C ' 358' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -51.86 155.69 2.89 Favored Pre-proline 0 N--CA 1.49 1.538 0 O-C-N 121.499 -0.751 . . . . 5.75 110.089 -179.773 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' C' C ' 359' ' ' PRO . . . . . . . . . . . . . 2.8 Cg_endo -69.2 -0.72 6.85 Favored 'Trans proline' 0 C--N 1.312 -1.374 0 C-N-CA 122.549 2.166 . . . . 4.94 110.853 179.724 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' C' C ' 360' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.302 0 CA-C-O 117.945 -1.475 . . . . 6.5 109.622 -179.8 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' D' D ' 319' ' ' LYS . . . . . . . . . . . . . 1.4 mtmt . . . . . 0 N--CA 1.49 1.557 0 N-CA-C 109.449 -0.574 . . . . 7.53 109.449 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' D' D ' 320' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 63.21 -139.82 0.37 Allowed 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.222 -0.924 . . . . 6.41 109.562 179.793 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' D' D ' 321' ' ' LYS . . . . . . . . . . . . . 2.2 ttmt -155.68 103.6 2.15 Favored Pre-proline 0 N--CA 1.491 1.589 0 O-C-N 121.022 -1.049 . . . . 6.11 109.416 -179.997 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' D' D ' 322' ' ' PRO . . . . . . . . . . . . . 3.2 Cg_endo -69.27 6.21 1.23 Allowed 'Trans proline' 0 C--N 1.314 -1.277 0 C-N-CA 122.368 2.045 . . . . 2.82 111.575 -179.908 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' D' D ' 323' ' ' LEU . . . . . . . . . . . . . 11.4 mt -83.58 58.46 4.59 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 120.769 -1.207 . . . . 2.83 110.062 -179.796 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' D' D ' 324' ' ' ASP . . . . . . . . . . . . . 26.7 m-20 -80.82 165.22 22.06 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.102 -0.999 . . . . 1.54 109.287 179.716 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' D' D ' 325' ' ' GLY . . . . . . . . . . . . . . . -68.12 -179.68 17.42 Favored Glycine 0 N--CA 1.491 2.361 0 N-CA-C 109.35 -1.5 . . . . 0.59 109.35 179.958 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' D' D ' 326' ' ' GLU . . . . . . . . . . . . . 1.8 mm-40 -57.3 -173.06 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.213 -1.169 . . . . 2.13 109.243 179.892 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' D' D ' 327' ' ' TYR . . . . . 0.489 ' CE1' ' HG2' ' B' ' 333' ' ' ARG . 46.7 m-85 -149.36 105.38 3.47 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.066 -1.021 . . . . 0.47 109.924 -179.834 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' D' D ' 328' ' ' PHE . . . . . 0.423 ' C ' HG23 ' D' ' 329' ' ' THR . 97.1 m-85 -112.29 -163.57 0.86 Allowed 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.307 -0.871 . . . . 0.3 109.451 179.838 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' D' D ' 329' ' ' THR . . . . . 0.423 HG23 ' C ' ' D' ' 328' ' ' PHE . 72.5 p -154.71 166.38 33.62 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.309 -0.869 . . . . 0.22 108.924 179.817 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' D' D ' 330' ' ' LEU . . . . . . . . . . . . . 32.5 tp -151.07 132.09 14.29 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.056 -1.028 . . . . 0.28 109.823 -179.782 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' D' D ' 331' ' ' GLN . . . . . . . . . . . . . 19.4 tp60 -86.96 114.98 24.04 Favored 'General case' 0 N--CA 1.489 1.488 0 O-C-N 121.37 -0.832 . . . . 0.93 109.021 179.672 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' D' D ' 332' ' ' ILE . . . . . 0.565 HG21 ' HA ' ' D' ' 338' ' ' PHE . 52.5 mt -103.43 106.87 20.96 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.542 0 O-C-N 121.209 -0.932 . . . . 0.25 109.662 -179.8 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' D' D ' 333' ' ' ARG . . . . . 0.58 ' HG2' ' CE1' ' B' ' 327' ' ' TYR . 9.9 mtp180 -72.19 140.14 48.58 Favored 'General case' 0 N--CA 1.488 1.441 0 O-C-N 121.273 -0.892 . . . . 2.93 109.393 179.824 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' D' D ' 334' ' ' GLY . . . . . . . . . . . . . . . 88.96 127.23 2.93 Favored Glycine 0 N--CA 1.492 2.414 0 N-CA-C 109.689 -1.365 . . . . 0.41 109.689 179.93 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' D' D ' 335' ' ' ARG . . . . . 0.476 ' O ' ' HB3' ' D' ' 338' ' ' PHE . 7.9 ttt180 -78.2 -34.52 49.39 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.258 -1.142 . . . . 3.03 109.63 179.947 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' D' D ' 336' ' ' GLU . . . . . . . . . . . . . 9.2 tt0 -58.05 -62.19 2.0 Allowed 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.276 -0.89 . . . . 2.26 109.659 -179.819 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' D' D ' 337' ' ' ARG . . . . . 0.516 ' NH1' ' HG2' ' D' ' 337' ' ' ARG . 0.0 OUTLIER -60.99 -27.58 68.4 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.317 -0.864 . . . . 2.92 109.706 -179.774 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' D' D ' 338' ' ' PHE . . . . . 0.565 ' HA ' HG21 ' D' ' 332' ' ' ILE . 52.9 t80 -53.84 -64.66 0.76 Allowed 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.248 -0.907 . . . . 0.37 109.777 -179.792 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' D' D ' 339' ' ' GLU . . . . . . . . . . . . . 42.8 mt-10 -50.6 -29.17 10.24 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.25 -0.906 . . . . 1.99 109.687 -179.765 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' D' D ' 340' ' ' MET . . . . . 0.441 ' HB3' ' O ' ' D' ' 337' ' ' ARG . 7.0 ttp -64.39 -52.26 59.12 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.236 -0.915 . . . . 0.31 109.793 -179.763 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' D' D ' 341' ' ' PHE . . . . . 0.461 ' CZ ' ' HA ' ' B' ' 345' ' ' ASN . 39.8 m-85 -62.71 -44.53 95.98 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.303 -0.873 . . . . 0.18 109.991 -179.594 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' D' D ' 342' ' ' ARG . . . . . . . . . . . . . 1.9 ttp180 -49.86 -41.93 46.42 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.158 -0.964 . . . . 2.41 109.921 -179.656 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' D' D ' 343' ' ' GLU . . . . . 0.408 ' HG3' ' NZ ' ' C' ' 351' ' ' LYS . 38.1 tt0 -59.08 -47.19 86.16 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.133 -0.98 . . . . 2.35 109.885 -179.701 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' D' D ' 344' ' ' LEU . . . . . . . . . . . . . 79.3 mt -62.66 -32.55 73.63 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.191 -0.943 . . . . 0.19 109.909 -179.717 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' D' D ' 345' ' ' ASN . . . . . 0.546 ' HA ' ' CZ ' ' B' ' 341' ' ' PHE . 53.7 t-20 -57.11 -56.12 25.94 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.283 -0.886 . . . . 1.09 110.04 -179.613 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' D' D ' 346' ' ' GLU . . . . . . . . . . . . . 4.0 tp10 -61.45 -26.51 67.93 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.152 -0.968 . . . . 1.69 110.144 -179.498 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' D' D ' 347' ' ' ALA . . . . . 0.896 ' HB1' ' HB1' ' C' ' 347' ' ' ALA . . . -61.57 -58.34 8.5 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.169 -0.957 . . . . 0.18 110.172 -179.566 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' D' D ' 348' ' ' LEU . . . . . 0.583 HD22 ' N ' ' D' ' 348' ' ' LEU . 4.0 mm? -62.05 -50.63 71.22 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.212 -0.93 . . . . 0.31 110.294 -179.29 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' D' D ' 349' ' ' GLU . . . . . . . . . . . . . 66.9 mt-10 -57.19 -30.99 64.98 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.135 -0.978 . . . . 1.95 110.134 -179.226 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' D' D ' 350' ' ' LEU . . . . . 0.64 HD22 HD22 ' C' ' 350' ' ' LEU . 8.9 tt -65.08 -45.13 86.51 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.09 -1.006 . . . . 0.43 109.675 -179.884 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' D' D ' 351' ' ' LYS . . . . . . . . . . . . . 40.9 tttm -57.74 -43.3 85.29 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.302 -0.874 . . . . 1.4 109.593 -179.643 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' D' D ' 352' ' ' ASP . . . . . . . . . . . . . 14.3 m-20 -55.81 -54.92 38.59 Favored 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.253 -0.905 . . . . 1.17 109.561 179.926 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' D' D ' 353' ' ' ALA . . . . . . . . . . . . . . . -68.45 -11.43 59.73 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.247 -0.908 . . . . 0.59 109.779 -179.872 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' D' D ' 354' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -84.86 -16.28 41.79 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.149 -0.969 . . . . 1.44 109.798 -179.826 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' D' D ' 355' ' ' ALA . . . . . . . . . . . . . . . -73.93 -18.07 60.94 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.129 -0.982 . . . . 0.98 109.542 179.947 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' D' D ' 356' ' ' GLY . . . . . . . . . . . . . . . -80.8 3.19 76.55 Favored Glycine 0 N--CA 1.49 2.278 0 N-CA-C 109.734 -1.346 . . . . 1.28 109.734 -179.863 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' D' D ' 357' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -91.6 -44.4 9.07 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.16 -1.2 . . . . 4.09 109.745 -179.746 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' D' D ' 358' ' ' GLU . . . . . . . . . . . . . 57.0 tt0 -48.6 134.68 13.45 Favored Pre-proline 0 N--CA 1.49 1.539 0 O-C-N 121.149 -0.97 . . . . 5.71 109.308 -179.928 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' D' D ' 359' ' ' PRO . . . . . . . . . . . . . 2.3 Cg_endo -62.56 -174.86 0.18 Allowed 'Trans proline' 0 C--N 1.312 -1.373 0 C-N-CA 121.879 1.72 . . . . 4.97 110.133 -179.932 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' D' D ' 360' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.243 0 N-CA-C 109.512 -1.435 . . . . 6.97 109.512 -179.97 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 319' ' ' LYS . . . . . . . . . . . . . 1.9 tttp . . . . . 0 N--CA 1.49 1.543 0 N-CA-C 109.303 -0.629 . . . . 7.55 109.303 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 320' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 67.84 -152.27 0.18 Allowed 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.228 -0.92 . . . . 6.43 109.739 179.577 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 321' ' ' LYS . . . . . . . . . . . . . 1.1 mttt -82.97 144.41 47.64 Favored Pre-proline 0 N--CA 1.49 1.526 0 O-C-N 121.229 -0.92 . . . . 6.13 109.664 -179.814 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 322' ' ' PRO . . . . . . . . . . . . . 1.6 Cg_endo -66.18 -81.3 0.01 OUTLIER 'Trans proline' 0 C--N 1.312 -1.344 0 C-N-CA 122.263 1.975 . . . . 2.83 109.937 179.843 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 323' ' ' LEU . . . . . . . . . . . . . 19.4 mt -81.8 124.13 29.39 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.189 -0.944 . . . . 2.83 109.452 179.766 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 324' ' ' ASP . . . . . . . . . . . . . 7.3 m-20 -81.39 -146.26 0.06 Allowed 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.218 -0.926 . . . . 1.53 109.241 179.765 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 325' ' ' GLY . . . . . . . . . . . . . . . -67.61 -177.8 11.44 Favored Glycine 0 N--CA 1.49 2.257 0 N-CA-C 109.572 -1.411 . . . . 0.61 109.572 -179.944 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 326' ' ' GLU . . . . . . . . . . . . . 3.6 mt-10 -57.62 -172.96 0.01 OUTLIER 'General case' 0 N--CA 1.488 1.47 0 O-C-N 121.294 -1.121 . . . . 2.13 109.545 -179.687 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 327' ' ' TYR . . . . . 0.449 ' CE1' ' HG2' ' C' ' 333' ' ' ARG . 47.2 m-85 -149.85 112.76 4.83 Favored 'General case' 0 N--CA 1.489 1.491 0 O-C-N 121.377 -0.827 . . . . 0.48 109.43 -179.9 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 328' ' ' PHE . . . . . 0.481 ' O ' ' OE1' ' C' ' 331' ' ' GLN . 77.4 m-85 -113.46 -170.18 1.64 Allowed 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.257 -0.902 . . . . 0.31 109.385 -179.934 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 329' ' ' THR . . . . . 0.424 ' HA ' ' O ' ' C' ' 330' ' ' LEU . 52.4 p -154.58 169.26 24.25 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.082 -1.012 . . . . 0.22 109.438 -179.775 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 330' ' ' LEU . . . . . 0.497 HD11 HD22 ' C' ' 345' ' ' ASN . 33.6 tp -152.12 129.09 11.01 Favored 'General case' 0 N--CA 1.488 1.474 0 O-C-N 121.081 -1.012 . . . . 0.28 110.144 -179.927 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 331' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -87.83 109.62 19.89 Favored 'General case' 0 N--CA 1.487 1.404 0 O-C-N 121.302 -0.874 . . . . 0.91 108.841 179.271 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 332' ' ' ILE . . . . . . . . . . . . . 18.3 mt -103.03 104.91 17.32 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.523 0 O-C-N 121.14 -0.975 . . . . 0.26 109.682 -179.586 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 333' ' ' ARG . . . . . 0.629 ' CG ' ' CE1' ' C' ' 327' ' ' TYR . 0.0 OUTLIER -72.01 152.92 42.1 Favored 'General case' 0 C--N 1.303 -1.455 0 O-C-N 121.564 -0.71 . . . . 2.92 109.25 179.714 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 334' ' ' GLY . . . . . . . . . . . . . . . 76.45 129.69 0.34 Allowed Glycine 0 N--CA 1.489 2.202 0 N-CA-C 109.545 -1.422 . . . . 0.4 109.545 179.997 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 335' ' ' ARG . . . . . . . . . . . . . 9.2 ttm180 -79.15 -26.0 42.82 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.317 -1.107 . . . . 3.01 109.785 -179.939 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 336' ' ' GLU . . . . . . . . . . . . . 16.3 mt-10 -57.42 -68.89 0.19 Allowed 'General case' 0 N--CA 1.495 1.786 0 O-C-N 121.225 -0.922 . . . . 2.29 109.83 -179.728 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 337' ' ' ARG . . . . . . . . . . . . . 6.1 mpt_? -59.41 -29.39 67.71 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.226 -0.921 . . . . 2.93 109.586 -179.738 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 338' ' ' PHE . . . . . . . . . . . . . 72.4 t80 -53.99 -59.6 4.43 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.431 -0.793 . . . . 0.38 109.645 -179.829 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 339' ' ' GLU . . . . . . . . . . . . . 58.9 mt-10 -50.54 -34.89 27.15 Favored 'General case' 0 N--CA 1.488 1.473 0 O-C-N 121.197 -0.939 . . . . 1.97 110.181 -179.456 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 340' ' ' MET . . . . . . . . . . . . . 52.9 ttp -64.2 -50.08 69.5 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.193 -0.942 . . . . 0.31 110.408 -179.288 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 341' ' ' PHE . . . . . . . . . . . . . 55.6 m-85 -62.08 -39.95 94.17 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.238 -0.914 . . . . 0.18 109.996 -179.344 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 342' ' ' ARG . . . . . . . . . . . . . 31.8 ttt180 -51.41 -47.59 62.91 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.182 -0.949 . . . . 2.42 110.175 -179.5 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 343' ' ' GLU . . . . . . . . . . . . . 9.4 tp10 -60.13 -43.02 96.0 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 120.992 -1.067 . . . . 2.35 110.201 -179.379 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 344' ' ' LEU . . . . . . . . . . . . . 52.7 mt -61.28 -37.04 81.72 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.085 -1.01 . . . . 0.18 110.03 -179.416 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 345' ' ' ASN . . . . . 0.552 HD22 HD11 ' C' ' 330' ' ' LEU . 46.4 t-20 -58.24 -53.27 60.16 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.166 -0.959 . . . . 1.09 109.8 -179.786 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 346' ' ' GLU . . . . . . . . . . . . . 1.2 tt0 -61.29 -30.95 70.79 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.208 -0.932 . . . . 1.65 109.768 -179.674 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 347' ' ' ALA . . . . . 0.949 ' HB1' ' HB1' ' B' ' 347' ' ' ALA . . . -61.59 -57.59 11.47 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.236 -0.915 . . . . 0.18 110.245 -179.501 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 348' ' ' LEU . . . . . 0.546 HD22 ' N ' ' A' ' 348' ' ' LEU . 3.8 mm? -61.56 -44.78 96.4 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.147 -0.97 . . . . 0.3 110.04 -179.324 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 349' ' ' GLU . . . . . . . . . . . . . 76.0 mt-10 -57.99 -35.21 70.9 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.228 -0.92 . . . . 1.94 109.95 -179.496 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 350' ' ' LEU . . . . . 0.735 HD22 HD13 ' B' ' 350' ' ' LEU . 6.8 tt -63.89 -48.39 76.82 Favored 'General case' 0 C--N 1.302 -1.474 0 O-C-N 121.098 -1.001 . . . . 0.46 109.593 -179.623 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 351' ' ' LYS . . . . . . . . . . . . . 43.4 tttm -59.11 -42.03 89.59 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.307 -0.87 . . . . 1.4 109.664 -179.794 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 352' ' ' ASP . . . . . 0.515 ' OD2' ' CZ ' ' C' ' 337' ' ' ARG . 1.0 OUTLIER -58.51 -38.96 78.81 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.084 -1.01 . . . . 1.16 109.742 -179.896 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 353' ' ' ALA . . . . . . . . . . . . . . . -67.19 -21.72 65.76 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.289 -0.882 . . . . 0.63 109.94 -179.483 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 354' ' ' GLN . . . . . . . . . . . . . 9.3 mt-30 -83.06 -15.58 50.38 Favored 'General case' 0 N--CA 1.489 1.489 0 O-C-N 121.174 -0.953 . . . . 1.47 109.361 179.903 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 355' ' ' ALA . . . . . . . . . . . . . . . -74.0 -2.4 24.02 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.185 -0.947 . . . . 1.01 109.571 179.623 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 356' ' ' GLY . . . . . . . . . . . . . . . -79.29 -8.01 88.08 Favored Glycine 0 N--CA 1.49 2.286 0 N-CA-C 109.643 -1.383 . . . . 1.3 109.643 -179.767 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 357' ' ' LYS . . . . . . . . . . . . . 32.5 mttp -87.18 134.7 33.5 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.282 -1.128 . . . . 4.1 108.709 179.487 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 358' ' ' GLU . . . . . 0.441 ' CG ' ' HD2' ' A' ' 359' ' ' PRO . 0.0 OUTLIER -48.47 157.84 0.67 Allowed Pre-proline 0 N--CA 1.49 1.535 0 O-C-N 121.104 -0.997 . . . . 5.75 109.781 -179.54 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 359' ' ' PRO . . . . . 0.441 ' HD2' ' CG ' ' A' ' 358' ' ' GLU . 2.4 Cg_endo -62.17 -177.76 0.29 Allowed 'Trans proline' 0 C--N 1.31 -1.495 0 C-N-CA 122.34 2.027 . . . . 5.0 110.043 179.662 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 360' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.312 0 CA-C-O 118.041 -1.421 . . . . 6.97 109.724 179.958 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' B' B ' 319' ' ' LYS . . . . . . . . . . . . . 2.6 tttp . . . . . 0 N--CA 1.492 1.673 0 N-CA-C 109.55 -0.537 . . . . 7.55 109.55 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' B' B ' 320' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 62.85 -152.1 0.34 Allowed 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.313 -0.867 . . . . 6.44 109.914 179.867 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 321' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -82.55 145.42 51.16 Favored Pre-proline 0 N--CA 1.491 1.587 0 O-C-N 121.377 -0.827 . . . . 6.13 109.679 -179.859 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 322' ' ' PRO . . . . . . . . . . . . . 2.6 Cg_endo -66.64 -81.25 0.01 OUTLIER 'Trans proline' 0 C--N 1.309 -1.503 0 C-N-CA 122.312 2.008 . . . . 2.82 109.892 179.836 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 323' ' ' LEU . . . . . . . . . . . . . 20.7 mt -80.98 123.37 28.28 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.291 -0.881 . . . . 2.84 109.685 179.905 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 324' ' ' ASP . . . . . . . . . . . . . 5.0 m-20 -81.62 -149.21 0.07 Allowed 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.282 -0.887 . . . . 1.53 109.195 179.596 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 325' ' ' GLY . . . . . . . . . . . . . . . -65.12 -177.67 6.33 Favored Glycine 0 N--CA 1.489 2.208 0 N-CA-C 109.628 -1.389 . . . . 0.59 109.628 -179.941 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 326' ' ' GLU . . . . . . . . . . . . . 3.8 mt-10 -57.93 -173.34 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.389 -1.065 . . . . 2.13 109.619 -179.78 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 327' ' ' TYR . . . . . 0.583 ' CE1' ' CG ' ' D' ' 333' ' ' ARG . 44.7 m-85 -149.55 112.11 4.75 Favored 'General case' 0 N--CA 1.488 1.443 0 O-C-N 121.105 -0.997 . . . . 0.48 109.651 -179.907 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 328' ' ' PHE . . . . . . . . . . . . . 80.4 m-85 -113.02 -170.88 1.76 Allowed 'General case' 0 C--N 1.303 -1.444 0 O-C-N 121.27 -0.894 . . . . 0.32 109.462 -179.67 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 329' ' ' THR . . . . . 0.413 ' HA ' ' O ' ' D' ' 330' ' ' LEU . 43.6 p -153.61 169.83 22.3 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.25 -0.906 . . . . 0.23 109.381 -179.689 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 330' ' ' LEU . . . . . 0.542 HD11 HD22 ' D' ' 345' ' ' ASN . 32.8 tp -152.7 128.83 10.43 Favored 'General case' 0 N--CA 1.489 1.479 0 O-C-N 121.021 -1.049 . . . . 0.28 110.198 -179.991 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 331' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -87.58 109.89 19.97 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.404 -0.81 . . . . 0.91 108.863 179.131 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 332' ' ' ILE . . . . . . . . . . . . . 20.4 mt -103.24 105.23 17.9 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.488 0 O-C-N 121.157 -0.964 . . . . 0.24 109.876 -179.63 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 333' ' ' ARG . . . . . 0.577 ' CG ' ' CE1' ' D' ' 327' ' ' TYR . 0.0 OUTLIER -72.46 151.86 42.29 Favored 'General case' 0 N--CA 1.489 1.486 0 O-C-N 121.324 -0.86 . . . . 2.93 109.241 179.735 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' B' B ' 334' ' ' GLY . . . . . . . . . . . . . . . 77.57 128.86 0.42 Allowed Glycine 0 N--CA 1.489 2.175 0 N-CA-C 109.837 -1.305 . . . . 0.4 109.837 179.935 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 335' ' ' ARG . . . . . . . . . . . . . 9.3 ttm180 -78.89 -27.05 43.91 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.473 -1.016 . . . . 3.01 109.739 -179.917 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 336' ' ' GLU . . . . . . . . . . . . . 18.1 mt-10 -57.48 -68.21 0.26 Allowed 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.205 -0.935 . . . . 2.28 109.805 -179.632 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 337' ' ' ARG . . . . . . . . . . . . . 5.7 mpt_? -60.13 -29.42 68.62 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.251 -0.906 . . . . 2.93 109.584 -179.844 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 338' ' ' PHE . . . . . . . . . . . . . 69.1 t80 -54.03 -58.25 8.02 Favored 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.317 -0.864 . . . . 0.37 109.608 -179.774 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 339' ' ' GLU . . . . . . . . . . . . . 58.0 mt-10 -51.44 -34.43 35.12 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.381 -0.824 . . . . 1.98 110.2 -179.594 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 340' ' ' MET . . . . . . . . . . . . . 52.0 ttp -65.05 -49.74 68.9 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.204 -0.935 . . . . 0.32 110.485 -179.258 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 341' ' ' PHE . . . . . . . . . . . . . 56.4 m-85 -62.1 -40.43 95.85 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.144 -0.972 . . . . 0.18 109.942 -179.343 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 342' ' ' ARG . . . . . . . . . . . . . 23.8 ttt180 -50.66 -47.51 58.62 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.217 -0.927 . . . . 2.42 110.18 -179.596 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 343' ' ' GLU . . . . . . . . . . . . . 11.8 tp10 -59.96 -42.42 94.07 Favored 'General case' 0 N--CA 1.494 1.759 0 O-C-N 121.218 -0.927 . . . . 2.35 110.142 -179.304 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 344' ' ' LEU . . . . . . . . . . . . . 45.2 mt -62.21 -37.1 84.06 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.106 -0.996 . . . . 0.18 110.039 -179.5 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 345' ' ' ASN . . . . . 0.54 HD22 HD11 ' D' ' 330' ' ' LEU . 50.8 t-20 -58.17 -53.58 56.61 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.155 -0.965 . . . . 1.09 110.008 -179.618 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 346' ' ' GLU . . . . . . . . . . . . . 1.2 tt0 -61.27 -31.2 71.02 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.249 -0.907 . . . . 1.66 109.789 -179.611 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 347' ' ' ALA . . . . . 0.949 ' HB1' ' HB1' ' A' ' 347' ' ' ALA . . . -61.14 -57.67 11.54 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.216 -0.928 . . . . 0.17 110.308 -179.525 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 348' ' ' LEU . . . . . 0.53 HD22 ' N ' ' B' ' 348' ' ' LEU . 3.8 mm? -60.96 -45.16 95.84 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.257 -0.902 . . . . 0.29 110.127 -179.412 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 349' ' ' GLU . . . . . . . . . . . . . 77.9 mt-10 -57.99 -35.36 71.1 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.11 -0.994 . . . . 1.95 110.056 -179.482 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 350' ' ' LEU . . . . . 0.735 HD13 HD22 ' A' ' 350' ' ' LEU . 6.9 tt -63.28 -48.29 78.74 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.145 -0.972 . . . . 0.45 109.451 -179.828 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 351' ' ' LYS . . . . . . . . . . . . . 45.9 tttm -59.24 -42.34 90.87 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.275 -0.89 . . . . 1.38 109.835 -179.734 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 352' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -58.63 -37.88 76.87 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.167 -0.958 . . . . 1.16 109.668 -179.982 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 353' ' ' ALA . . . . . . . . . . . . . . . -67.84 -22.17 65.15 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.362 -0.836 . . . . 0.61 109.728 -179.386 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 354' ' ' GLN . . . . . . . . . . . . . 8.5 mt-30 -82.99 -15.69 50.19 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.148 -0.97 . . . . 1.45 109.471 -179.844 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 355' ' ' ALA . . . . . . . . . . . . . . . -73.72 -2.52 23.66 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.213 -0.93 . . . . 0.98 109.737 179.873 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 356' ' ' GLY . . . . . . . . . . . . . . . -79.77 -7.95 88.09 Favored Glycine 0 N--CA 1.491 2.359 0 N-CA-C 109.705 -1.358 . . . . 1.29 109.705 -179.747 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 357' ' ' LYS . . . . . . . . . . . . . 32.1 mttp -86.8 135.82 33.21 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.175 -1.191 . . . . 4.09 109.006 179.459 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 358' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -47.78 157.37 0.61 Allowed Pre-proline 0 N--CA 1.491 1.625 0 O-C-N 121.158 -0.964 . . . . 5.72 109.683 -179.597 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 359' ' ' PRO . . . . . . . . . . . . . 2.4 Cg_endo -62.27 -177.76 0.3 Allowed 'Trans proline' 0 C--N 1.311 -1.41 0 C-N-CA 122.316 2.01 . . . . 4.98 109.842 179.951 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 360' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.172 0 N-CA-C 109.332 -1.507 . . . . 6.98 109.332 179.989 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' C' C ' 319' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.491 1.583 0 CA-C-O 121.345 0.593 . . . . 6.82 109.661 . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' C' C ' 320' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -81.45 168.9 17.8 Favored 'General case' 0 N--CA 1.488 1.456 0 O-C-N 121.296 -0.877 . . . . 6.49 109.229 179.816 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' C' C ' 321' ' ' LYS . . . . . 0.405 ' O ' ' O ' ' C' ' 322' ' ' PRO . 0.0 OUTLIER -157.71 87.44 2.54 Favored Pre-proline 0 C--N 1.301 -1.53 0 O-C-N 121.416 -0.802 . . . . 6.4 109.101 179.89 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' C' C ' 322' ' ' PRO . . . . . 0.405 ' O ' ' O ' ' C' ' 321' ' ' LYS . 5.0 Cg_exo -58.1 -151.71 0.01 OUTLIER 'Trans proline' 0 C--N 1.308 -1.553 0 C-N-CA 122.065 1.843 . . . . 3.42 109.953 -179.995 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' C' C ' 323' ' ' LEU . . . . . . . . . . . . . 14.3 mt -78.96 141.37 37.59 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.163 -0.961 . . . . 3.95 109.446 -179.974 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' C' C ' 324' ' ' ASP . . . . . 0.521 ' CB ' ' OH ' ' C' ' 327' ' ' TYR . 4.5 m-20 -78.73 155.49 29.35 Favored 'General case' 0 N--CA 1.489 1.495 0 O-C-N 121.279 -0.888 . . . . 1.63 109.563 -179.662 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' C' C ' 325' ' ' GLY . . . . . 0.438 ' O ' ' O ' ' C' ' 326' ' ' GLU . . . -67.55 -177.18 10.17 Favored Glycine 0 N--CA 1.49 2.29 0 N-CA-C 109.106 -1.598 . . . . 0.73 109.106 179.704 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' C' C ' 326' ' ' GLU . . . . . 0.438 ' O ' ' O ' ' C' ' 325' ' ' GLY . 16.7 mt-10 -55.98 -168.98 0.0 OUTLIER 'General case' 0 N--CA 1.489 1.475 0 O-C-N 121.079 -1.248 . . . . 2.17 108.884 179.862 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' C' C ' 327' ' ' TYR . . . . . 0.629 ' CE1' ' CG ' ' A' ' 333' ' ' ARG . 43.8 m-85 -149.72 113.63 5.1 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.025 -1.047 . . . . 0.48 109.827 -179.824 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' C' C ' 328' ' ' PHE . . . . . . . . . . . . . 97.6 m-85 -113.03 -166.53 1.09 Allowed 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.162 -0.961 . . . . 0.33 109.726 179.718 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' C' C ' 329' ' ' THR . . . . . 0.405 ' HA ' ' O ' ' A' ' 330' ' ' LEU . 27.2 p -153.32 167.14 30.37 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.212 -0.93 . . . . 0.23 109.564 -179.721 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' C' C ' 330' ' ' LEU . . . . . 0.552 HD11 HD22 ' A' ' 345' ' ' ASN . 18.4 tp -150.26 124.93 9.72 Favored 'General case' 0 N--CA 1.488 1.43 0 O-C-N 121.194 -0.941 . . . . 0.28 109.707 -179.727 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' C' C ' 331' ' ' GLN . . . . . 0.481 ' OE1' ' O ' ' A' ' 328' ' ' PHE . 7.2 tp-100 -89.23 109.01 19.94 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.245 -0.91 . . . . 1.48 109.14 179.794 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' C' C ' 332' ' ' ILE . . . . . 0.433 HD13 ' CD2' ' C' ' 341' ' ' PHE . 93.9 mt -102.78 113.75 40.35 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.647 0 O-C-N 121.081 -1.012 . . . . 0.24 109.737 -179.722 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' C' C ' 333' ' ' ARG . . . . . 0.449 ' HG2' ' CE1' ' A' ' 327' ' ' TYR . 0.6 OUTLIER -73.53 148.75 42.77 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.295 -0.878 . . . . 2.74 109.6 179.81 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' C' C ' 334' ' ' GLY . . . . . . . . . . . . . . . 70.89 134.57 0.11 Allowed Glycine 0 N--CA 1.492 2.385 0 N-CA-C 109.677 -1.369 . . . . 0.35 109.677 179.958 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' C' C ' 335' ' ' ARG . . . . . 0.55 ' HG2' ' NH1' ' C' ' 335' ' ' ARG . 0.0 OUTLIER -75.34 -26.33 58.51 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.329 -1.1 . . . . 2.53 109.622 -179.985 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' C' C ' 336' ' ' GLU . . . . . . . . . . . . . 9.2 tt0 -54.2 -65.06 0.64 Allowed 'General case' 0 C--N 1.301 -1.535 0 O-C-N 121.192 -0.943 . . . . 2.62 109.561 -179.509 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' C' C ' 337' ' ' ARG . . . . . 0.515 ' CZ ' ' OD2' ' A' ' 352' ' ' ASP . 2.0 mpt_? -59.58 -28.45 67.16 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.259 -0.9 . . . . 2.81 109.206 179.874 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' C' C ' 338' ' ' PHE . . . . . 0.474 ' HB3' ' O ' ' C' ' 335' ' ' ARG . 84.5 t80 -56.53 -64.54 0.83 Allowed 'General case' 0 N--CA 1.489 1.5 0 O-C-N 121.451 -0.781 . . . . 0.4 110.026 -179.813 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' C' C ' 339' ' ' GLU . . . . . 0.458 ' OE2' ' HG2' ' C' ' 335' ' ' ARG . 10.6 mt-10 -48.66 -37.0 17.24 Favored 'General case' 0 N--CA 1.495 1.802 0 O-C-N 121.132 -0.98 . . . . 2.05 110.398 -179.45 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' C' C ' 340' ' ' MET . . . . . . . . . . . . . 30.9 ttp -61.46 -49.63 76.04 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.054 -1.029 . . . . 0.32 109.727 -179.542 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' C' C ' 341' ' ' PHE . . . . . 0.433 ' CD2' HD13 ' C' ' 332' ' ' ILE . 44.2 m-85 -64.16 -41.1 97.29 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.207 -0.933 . . . . 0.18 110.161 -179.79 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' C' C ' 342' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -52.47 -48.02 66.15 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.258 -0.901 . . . . 2.91 110.032 -179.63 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' C' C ' 343' ' ' GLU . . . . . . . . . . . . . 14.4 tt0 -57.76 -45.93 85.23 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.345 -0.847 . . . . 2.14 110.063 -179.593 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' C' C ' 344' ' ' LEU . . . . . 0.432 ' O ' HD23 ' C' ' 348' ' ' LEU . 94.6 mt -63.06 -33.69 75.98 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.09 -1.006 . . . . 0.22 109.693 -179.729 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' C' C ' 345' ' ' ASN . . . . . 0.497 HD22 HD11 ' A' ' 330' ' ' LEU . 50.5 t-20 -59.48 -56.82 17.11 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.126 -0.984 . . . . 1.08 109.498 -179.995 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' C' C ' 346' ' ' GLU . . . . . . . . . . . . . 5.9 tp10 -61.97 -26.71 68.37 Favored 'General case' 0 C--N 1.302 -1.475 0 O-C-N 121.202 -0.936 . . . . 2.21 109.515 179.942 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' C' C ' 347' ' ' ALA . . . . . 0.96 ' HB1' ' HB1' ' D' ' 347' ' ' ALA . . . -64.07 -61.27 2.37 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.214 -0.929 . . . . 0.18 110.041 -179.799 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' C' C ' 348' ' ' LEU . . . . . 0.585 HD22 ' N ' ' C' ' 348' ' ' LEU . 3.9 mm? -60.5 -50.53 73.18 Favored 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.319 -0.863 . . . . 0.32 110.241 -179.051 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' C' C ' 349' ' ' GLU . . . . . . . . . . . . . 16.0 mm-40 -58.87 -34.52 71.71 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.233 -0.917 . . . . 2.19 109.998 -179.406 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' C' C ' 350' ' ' LEU . . . . . 0.74 HD21 HD22 ' D' ' 350' ' ' LEU . 3.5 tt -64.66 -37.97 89.39 Favored 'General case' 0 C--N 1.302 -1.493 0 O-C-N 121.049 -1.032 . . . . 0.46 109.378 -179.942 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' C' C ' 351' ' ' LYS . . . . . 0.446 ' HE2' ' OE2' ' D' ' 343' ' ' GLU . 11.3 tttp -58.55 -40.2 82.37 Favored 'General case' 0 N--CA 1.488 1.455 0 O-C-N 121.254 -0.904 . . . . 1.35 108.884 179.752 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' C' C ' 352' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 -56.63 -43.75 80.57 Favored 'General case' 0 C--N 1.304 -1.403 0 O-C-N 121.432 -0.792 . . . . 1.19 109.423 179.612 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' C' C ' 353' ' ' ALA . . . . . . . . . . . . . . . -69.59 -22.4 63.52 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.379 -0.825 . . . . 0.57 110.047 -179.764 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' C' C ' 354' ' ' GLN . . . . . 0.405 ' CD ' HD11 ' D' ' 350' ' ' LEU . 8.3 tt0 -82.4 -6.5 59.32 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.108 -0.995 . . . . 1.47 109.684 -179.675 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' C' C ' 355' ' ' ALA . . . . . . . . . . . . . . . -70.04 -38.36 75.81 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.223 -0.923 . . . . 0.93 109.398 179.977 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' C' C ' 356' ' ' GLY . . . . . . . . . . . . . . . -80.77 7.27 59.3 Favored Glycine 0 N--CA 1.492 2.39 0 N-CA-C 110.351 -1.1 . . . . 1.33 110.351 -179.675 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' C' C ' 357' ' ' LYS . . . . . 0.435 ' O ' ' HD3' ' C' ' 359' ' ' PRO . 11.4 mmtm -84.28 -172.05 3.95 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 120.917 -1.343 . . . . 4.01 109.571 -179.705 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' C' C ' 358' ' ' GLU . . . . . . . . . . . . . 24.3 mt-10 -47.81 106.77 0.64 Allowed Pre-proline 0 N--CA 1.49 1.53 0 O-C-N 121.296 -0.877 . . . . 5.75 109.537 -179.83 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' C' C ' 359' ' ' PRO . . . . . 0.435 ' HD3' ' O ' ' C' ' 357' ' ' LYS . 4.9 Cg_exo -60.47 -151.9 0.01 OUTLIER 'Trans proline' 0 C--N 1.31 -1.45 0 C-N-CA 122.114 1.876 . . . . 4.94 110.085 179.927 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' C' C ' 360' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.21 0 N-CA-C 109.53 -1.428 . . . . 6.5 109.53 -179.955 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' D' D ' 319' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 N--CA 1.489 1.508 0 N-CA-C 109.469 -0.567 . . . . 7.53 109.469 . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' D' D ' 320' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 62.94 -153.92 0.34 Allowed 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.096 -1.002 . . . . 6.41 109.502 -179.999 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' D' D ' 321' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -81.01 146.51 59.24 Favored Pre-proline 0 N--CA 1.491 1.61 0 O-C-N 121.258 -0.901 . . . . 6.11 109.504 -179.937 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' D' D ' 322' ' ' PRO . . . . . . . . . . . . . 1.8 Cg_endo -67.37 -81.04 0.01 OUTLIER 'Trans proline' 0 C--N 1.308 -1.563 0 C-N-CA 122.309 2.006 . . . . 2.82 109.543 179.649 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' D' D ' 323' ' ' LEU . . . . . . . . . . . . . 17.1 mt -80.53 123.62 28.25 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.414 -0.804 . . . . 2.83 109.867 -179.85 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' D' D ' 324' ' ' ASP . . . . . . . . . . . . . 4.1 m-20 -81.55 -147.43 0.07 Allowed 'General case' 0 N--CA 1.488 1.451 0 O-C-N 121.301 -0.874 . . . . 1.54 109.198 179.547 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' D' D ' 325' ' ' GLY . . . . . . . . . . . . . . . -67.67 -175.2 8.26 Favored Glycine 0 N--CA 1.49 2.257 0 N-CA-C 109.737 -1.345 . . . . 0.59 109.737 -179.706 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' D' D ' 326' ' ' GLU . . . . . . . . . . . . . 3.4 mt-10 -58.65 -175.02 0.02 OUTLIER 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.325 -1.103 . . . . 2.13 109.765 -179.866 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' D' D ' 327' ' ' TYR . . . . . 0.577 ' CE1' ' CG ' ' B' ' 333' ' ' ARG . 44.6 m-85 -149.03 112.26 4.94 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.446 -0.784 . . . . 0.47 109.476 -179.937 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' D' D ' 328' ' ' PHE . . . . . . . . . . . . . 83.0 m-85 -113.49 -170.85 1.77 Allowed 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.317 -0.864 . . . . 0.3 109.426 -179.841 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' D' D ' 329' ' ' THR . . . . . . . . . . . . . 38.6 p -153.4 169.37 23.3 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.241 -0.912 . . . . 0.22 109.598 -179.864 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' D' D ' 330' ' ' LEU . . . . . 0.54 HD11 HD22 ' B' ' 345' ' ' ASN . 33.5 tp -152.56 128.89 10.56 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.228 -0.92 . . . . 0.28 110.267 179.968 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' D' D ' 331' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -88.27 109.21 19.77 Favored 'General case' 0 N--CA 1.491 1.602 0 N-CA-C 108.806 -0.813 . . . . 0.93 108.806 179.125 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' D' D ' 332' ' ' ILE . . . . . . . . . . . . . 20.2 mt -102.18 104.98 17.24 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.495 0 O-C-N 121.146 -0.971 . . . . 0.25 109.817 -179.646 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' D' D ' 333' ' ' ARG . . . . . 0.583 ' CG ' ' CE1' ' B' ' 327' ' ' TYR . 0.0 OUTLIER -72.23 151.87 42.58 Favored 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.323 -0.861 . . . . 2.93 109.141 179.553 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' D' D ' 334' ' ' GLY . . . . . . . . . . . . . . . 78.23 128.57 0.48 Allowed Glycine 0 N--CA 1.49 2.258 0 N-CA-C 109.689 -1.365 . . . . 0.41 109.689 179.963 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' D' D ' 335' ' ' ARG . . . . . . . . . . . . . 8.8 ttm180 -78.99 -28.25 43.45 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.414 -1.05 . . . . 3.03 109.858 -179.903 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' D' D ' 336' ' ' GLU . . . . . . . . . . . . . 12.8 mt-10 -57.08 -68.05 0.26 Allowed 'General case' 0 N--CA 1.495 1.786 0 O-C-N 121.301 -0.874 . . . . 2.26 109.772 -179.551 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' D' D ' 337' ' ' ARG . . . . . . . . . . . . . 5.8 mpt_? -59.87 -29.98 68.69 Favored 'General case' 0 N--CA 1.488 1.446 0 O-C-N 121.271 -0.893 . . . . 2.92 109.665 -179.81 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' D' D ' 338' ' ' PHE . . . . . . . . . . . . . 70.5 t80 -54.09 -58.59 6.76 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.256 -0.902 . . . . 0.37 109.566 -179.88 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' D' D ' 339' ' ' GLU . . . . . . . . . . . . . 55.3 mt-10 -51.05 -34.81 31.39 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.333 -0.854 . . . . 1.99 110.059 -179.721 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' D' D ' 340' ' ' MET . . . . . . . . . . . . . 51.9 ttp -64.64 -49.42 71.11 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.156 -0.965 . . . . 0.31 110.26 -179.116 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' D' D ' 341' ' ' PHE . . . . . 0.426 ' HA ' HD12 ' D' ' 344' ' ' LEU . 55.8 m-85 -62.25 -42.82 99.66 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.073 -1.017 . . . . 0.18 110.125 -179.403 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' D' D ' 342' ' ' ARG . . . . . . . . . . . . . 23.2 ttt180 -48.8 -47.03 42.43 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.183 -0.948 . . . . 2.41 110.166 -179.705 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' D' D ' 343' ' ' GLU . . . . . 0.446 ' OE2' ' HE2' ' C' ' 351' ' ' LYS . 13.9 tp10 -60.05 -42.8 95.26 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.04 -1.038 . . . . 2.35 110.012 -179.447 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' D' D ' 344' ' ' LEU . . . . . 0.426 HD12 ' HA ' ' D' ' 341' ' ' PHE . 38.0 mt -61.68 -37.38 83.9 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.128 -0.982 . . . . 0.19 109.956 -179.476 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' D' D ' 345' ' ' ASN . . . . . 0.542 HD22 HD11 ' B' ' 330' ' ' LEU . 51.5 t-20 -58.17 -52.6 64.89 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.071 -1.018 . . . . 1.09 109.935 -179.539 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' D' D ' 346' ' ' GLU . . . . . . . . . . . . . 1.3 tt0 -61.44 -32.11 72.07 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.21 -0.931 . . . . 1.69 109.862 -179.65 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' D' D ' 347' ' ' ALA . . . . . 0.96 ' HB1' ' HB1' ' C' ' 347' ' ' ALA . . . -60.87 -57.73 11.43 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.219 -0.926 . . . . 0.18 110.249 -179.7 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' D' D ' 348' ' ' LEU . . . . . 0.544 HD22 ' N ' ' D' ' 348' ' ' LEU . 3.7 mm? -60.99 -44.24 97.69 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.077 -1.014 . . . . 0.31 110.038 -179.301 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' D' D ' 349' ' ' GLU . . . . . . . . . . . . . 71.8 mt-10 -58.51 -35.01 71.59 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.043 -1.036 . . . . 1.95 110.075 -179.32 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' D' D ' 350' ' ' LEU . . . . . 0.74 HD22 HD21 ' C' ' 350' ' ' LEU . 6.6 tt -63.75 -48.01 78.71 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.011 -1.056 . . . . 0.43 109.594 -179.796 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' D' D ' 351' ' ' LYS . . . . . . . . . . . . . 48.4 tttm -58.55 -42.91 88.94 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.32 -0.862 . . . . 1.4 109.715 -179.835 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' D' D ' 352' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -58.58 -37.03 74.91 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.093 -1.004 . . . . 1.17 109.698 -179.977 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' D' D ' 353' ' ' ALA . . . . . . . . . . . . . . . -68.1 -22.65 64.89 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.204 -0.935 . . . . 0.59 110.003 -179.5 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' D' D ' 354' ' ' GLN . . . . . . . . . . . . . 9.5 mt-30 -83.85 -15.34 48.56 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.107 -0.996 . . . . 1.44 109.677 -179.707 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' D' D ' 355' ' ' ALA . . . . . . . . . . . . . . . -73.49 -3.0 24.9 Favored 'General case' 0 N--CA 1.489 1.525 0 O-C-N 121.127 -0.983 . . . . 0.98 109.494 179.707 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' D' D ' 356' ' ' GLY . . . . . . . . . . . . . . . -79.99 -7.13 88.78 Favored Glycine 0 N--CA 1.49 2.269 0 N-CA-C 109.891 -1.284 . . . . 1.28 109.891 -179.656 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' D' D ' 357' ' ' LYS . . . . . . . . . . . . . 32.2 mttp -87.65 135.72 33.25 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.005 -1.291 . . . . 4.09 109.059 179.693 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' D' D ' 358' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -47.62 154.95 0.82 Allowed Pre-proline 0 N--CA 1.492 1.632 0 O-C-N 121.089 -1.007 . . . . 5.71 109.755 -179.492 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' D' D ' 359' ' ' PRO . . . . . . . . . . . . . 1.9 Cg_endo -62.57 178.09 1.05 Allowed 'Trans proline' 0 C--N 1.31 -1.461 0 C-N-CA 122.235 1.957 . . . . 4.97 110.321 179.955 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' D' D ' 360' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.243 0 CA-C-O 118.058 -1.412 . . . . 6.97 109.735 179.981 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 319' ' ' LYS . . . . . . . . . . . . . 21.1 mttt . . . . . 0 N--CA 1.49 1.551 0 N-CA-C 109.495 -0.557 . . . . 7.55 109.495 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 320' ' ' LYS . . . . . . . . . . . . . 1.2 mttt 59.85 163.81 0.05 Allowed 'General case' 0 C--N 1.301 -1.524 0 O-C-N 121.416 -0.803 . . . . 6.43 109.597 179.779 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 321' ' ' LYS . . . . . . . . . . . . . 3.1 mttt -156.87 99.22 2.02 Favored Pre-proline 0 N--CA 1.488 1.471 0 O-C-N 121.277 -0.889 . . . . 6.13 108.932 -179.858 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 322' ' ' PRO . . . . . . . . . . . . . 1.8 Cg_endo -68.78 5.28 1.39 Allowed 'Trans proline' 0 C--N 1.311 -1.422 0 C-N-CA 122.27 1.98 . . . . 2.83 111.44 -179.778 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 323' ' ' LEU . . . . . 0.486 ' HA ' HD23 ' A' ' 323' ' ' LEU . 19.7 mt -82.42 36.32 0.47 Allowed 'General case' 0 N--CA 1.491 1.595 0 O-C-N 120.668 -1.27 . . . . 2.83 110.014 -179.856 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 324' ' ' ASP . . . . . . . . . . . . . 7.0 m-20 -84.91 -153.27 0.16 Allowed 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.103 -0.998 . . . . 1.53 109.588 -179.965 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 325' ' ' GLY . . . . . 0.447 ' O ' ' CE2' ' A' ' 327' ' ' TYR . . . -68.57 176.64 27.8 Favored Glycine 0 N--CA 1.486 1.968 0 N-CA-C 109.572 -1.411 . . . . 0.61 109.572 179.611 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 326' ' ' GLU . . . . . . . . . . . . . 2.1 mm-40 -58.27 175.89 0.2 Allowed 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.341 -1.093 . . . . 2.13 109.14 179.632 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 327' ' ' TYR . . . . . 0.607 ' CE1' ' HG3' ' C' ' 333' ' ' ARG . 51.0 m-85 -148.5 108.9 4.14 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.408 -0.808 . . . . 0.48 109.411 -179.829 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 328' ' ' PHE . . . . . 0.443 ' O ' HG23 ' A' ' 329' ' ' THR . 83.4 m-85 -113.42 -165.97 1.05 Allowed 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.414 -0.804 . . . . 0.31 109.592 179.98 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 329' ' ' THR . . . . . 0.443 HG23 ' O ' ' A' ' 328' ' ' PHE . 22.2 p -154.75 167.68 29.38 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.295 -0.878 . . . . 0.22 109.432 -179.839 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 330' ' ' LEU . . . . . . . . . . . . . 25.0 tp -150.49 127.05 10.83 Favored 'General case' 0 C--N 1.302 -1.5 0 O-C-N 121.248 -0.907 . . . . 0.28 109.917 -179.787 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 331' ' ' GLN . . . . . . . . . . . . . 1.2 tp60 -86.32 108.4 18.41 Favored 'General case' 0 C--N 1.303 -1.451 0 O-C-N 121.257 -0.902 . . . . 0.91 108.854 179.144 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 332' ' ' ILE . . . . . 0.423 HG21 ' CD2' ' A' ' 341' ' ' PHE . 21.1 mt -102.83 112.94 38.04 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.516 0 O-C-N 121.311 -0.868 . . . . 0.26 109.509 -179.802 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 333' ' ' ARG . . . . . 0.406 ' HG2' ' CE2' ' C' ' 327' ' ' TYR . 54.9 mtm180 -72.84 154.91 40.41 Favored 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.491 -0.756 . . . . 2.92 109.535 179.845 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 334' ' ' GLY . . . . . . . . . . . . . . . 75.98 129.28 0.29 Allowed Glycine 0 N--CA 1.49 2.254 0 N-CA-C 109.728 -1.349 . . . . 0.4 109.728 179.868 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 335' ' ' ARG . . . . . 0.568 ' HB2' ' CZ ' ' C' ' 328' ' ' PHE . 31.3 ttp180 -78.91 -32.45 45.69 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.107 -1.231 . . . . 3.01 109.305 179.705 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 336' ' ' GLU . . . . . . . . . . . . . 1.9 tt0 -57.48 -62.99 1.39 Allowed 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.34 -0.85 . . . . 2.29 109.634 -179.799 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 337' ' ' ARG . . . . . 0.461 ' NH1' ' CG ' ' A' ' 337' ' ' ARG . 0.0 OUTLIER -59.2 -29.05 67.2 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.257 -0.902 . . . . 2.93 109.446 -179.651 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 338' ' ' PHE . . . . . 0.444 ' HB3' ' O ' ' A' ' 335' ' ' ARG . 75.5 t80 -54.76 -57.19 12.51 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.37 -0.831 . . . . 0.38 109.833 -179.872 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 339' ' ' GLU . . . . . . . . . . . . . 3.2 mt-10 -52.27 -33.47 42.08 Favored 'General case' 0 N--CA 1.493 1.692 0 O-C-N 121.205 -0.934 . . . . 1.97 109.678 -179.757 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 340' ' ' MET . . . . . . . . . . . . . 31.0 ttp -63.27 -50.2 71.08 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.482 -0.761 . . . . 0.31 109.947 -179.753 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 341' ' ' PHE . . . . . 0.423 ' CD2' HG21 ' A' ' 332' ' ' ILE . 52.4 m-85 -62.46 -44.24 96.88 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.147 -0.97 . . . . 0.18 109.792 -179.733 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 342' ' ' ARG . . . . . 0.446 ' CG ' HH11 ' A' ' 342' ' ' ARG . 0.1 OUTLIER -51.82 -43.16 63.01 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.319 -0.863 . . . . 2.42 109.866 -179.885 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 343' ' ' GLU . . . . . . . . . . . . . 1.8 tt0 -59.14 -48.37 81.86 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.254 -0.904 . . . . 2.35 110.281 -179.597 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 344' ' ' LEU . . . . . 0.403 HD23 ' HA ' ' A' ' 344' ' ' LEU . 74.4 mt -62.07 -32.85 73.43 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.121 -0.987 . . . . 0.18 109.244 -179.75 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 345' ' ' ASN . . . . . 0.615 HD22 HD11 ' C' ' 330' ' ' LEU . 46.4 t-20 -59.68 -52.35 65.87 Favored 'General case' 0 C--N 1.301 -1.523 0 O-C-N 121.364 -0.835 . . . . 1.09 109.823 -179.908 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 346' ' ' GLU . . . . . . . . . . . . . 41.9 tt0 -62.44 -27.04 68.83 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.138 -0.976 . . . . 1.65 109.568 -179.736 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 347' ' ' ALA . . . . . 0.852 ' HB1' ' HB1' ' B' ' 347' ' ' ALA . . . -62.44 -59.7 4.6 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.441 -0.787 . . . . 0.18 109.941 -179.808 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 348' ' ' LEU . . . . . 0.589 HD22 ' N ' ' A' ' 348' ' ' LEU . 3.5 mm? -61.13 -44.03 97.96 Favored 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.144 -0.973 . . . . 0.3 109.849 -179.753 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 349' ' ' GLU . . . . . . . . . . . . . 3.5 mm-40 -56.75 -36.32 69.64 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.056 -1.028 . . . . 1.94 109.683 -179.753 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 350' ' ' LEU . . . . . 0.579 HD13 HD22 ' B' ' 350' ' ' LEU . 5.9 tt -62.9 -45.05 94.33 Favored 'General case' 0 N--CA 1.489 1.488 0 O-C-N 120.942 -1.099 . . . . 0.46 109.354 -179.904 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 351' ' ' LYS . . . . . . . . . . . . . 30.0 tttt -57.88 -48.22 80.48 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.223 -0.923 . . . . 1.4 109.584 -179.843 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 352' ' ' ASP . . . . . . . . . . . . . 62.4 m-20 -59.88 -39.03 83.91 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.254 -0.904 . . . . 1.16 109.818 -179.809 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 353' ' ' ALA . . . . . . . . . . . . . . . -67.48 -18.16 64.96 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.296 -0.878 . . . . 0.63 110.038 -179.372 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 354' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -85.33 -20.35 30.1 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.268 -0.895 . . . . 1.47 109.531 -179.985 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 355' ' ' ALA . . . . . . . . . . . . . . . -73.31 -8.31 55.29 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.215 -0.928 . . . . 1.01 109.425 179.804 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 356' ' ' GLY . . . . . . . . . . . . . . . -79.21 -4.23 88.82 Favored Glycine 0 N--CA 1.493 2.439 0 N-CA-C 109.606 -1.397 . . . . 1.3 109.606 -179.776 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 357' ' ' LYS . . . . . . . . . . . . . 7.2 tttt -83.88 163.12 20.26 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.247 -1.149 . . . . 4.1 109.344 -179.946 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 358' ' ' GLU . . . . . . . . . . . . . 8.2 pt-20 -53.29 147.61 18.36 Favored Pre-proline 0 N--CA 1.493 1.676 0 O-C-N 121.239 -0.913 . . . . 5.75 109.805 -179.988 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 359' ' ' PRO . . . . . . . . . . . . . 1.6 Cg_endo -62.9 -159.21 0.03 OUTLIER 'Trans proline' 0 C--N 1.31 -1.466 0 C-N-CA 122.328 2.019 . . . . 5.0 109.511 179.58 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 360' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.486 1.983 0 CA-C-O 117.928 -1.484 . . . . 6.97 109.624 179.8 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' B' B ' 319' ' ' LYS . . . . . . . . . . . . . 22.3 mttt . . . . . 0 N--CA 1.49 1.562 0 CA-C-O 121.344 0.592 . . . . 7.55 109.478 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' B' B ' 320' ' ' LYS . . . . . . . . . . . . . 1.2 mttt 59.85 165.22 0.06 Allowed 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.429 -0.794 . . . . 6.44 109.565 179.955 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 321' ' ' LYS . . . . . . . . . . . . . 2.9 mttt -155.57 100.47 2.22 Favored Pre-proline 0 N--CA 1.489 1.484 0 O-C-N 121.271 -0.893 . . . . 6.13 109.233 179.799 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 322' ' ' PRO . . . . . . . . . . . . . 1.8 Cg_endo -68.43 4.34 1.71 Allowed 'Trans proline' 0 C--N 1.312 -1.358 0 C-N-CA 122.419 2.079 . . . . 2.82 111.119 -179.867 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 323' ' ' LEU . . . . . 0.476 ' HA ' HD23 ' B' ' 323' ' ' LEU . 17.2 mt -81.85 35.23 0.41 Allowed 'General case' 0 N--CA 1.49 1.552 0 O-C-N 120.772 -1.205 . . . . 2.84 110.116 179.936 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 324' ' ' ASP . . . . . . . . . . . . . 9.0 m-20 -83.29 -154.62 0.15 Allowed 'General case' 0 C--N 1.305 -1.345 0 O-C-N 120.849 -1.157 . . . . 1.53 109.12 179.757 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 325' ' ' GLY . . . . . 0.441 ' O ' ' CE2' ' B' ' 327' ' ' TYR . . . -68.59 179.21 22.18 Favored Glycine 0 N--CA 1.491 2.327 0 N-CA-C 109.633 -1.387 . . . . 0.59 109.633 179.711 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 326' ' ' GLU . . . . . . . . . . . . . 2.2 mm-40 -59.93 176.35 0.31 Allowed 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.318 -1.107 . . . . 2.13 109.659 -179.888 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 327' ' ' TYR . . . . . 0.441 ' CE2' ' O ' ' B' ' 325' ' ' GLY . 51.3 m-85 -148.84 109.27 4.17 Favored 'General case' 0 C--N 1.301 -1.531 0 O-C-N 120.998 -1.064 . . . . 0.48 109.388 -179.997 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 328' ' ' PHE . . . . . 0.439 ' CE2' ' HB2' ' D' ' 335' ' ' ARG . 79.3 m-85 -113.62 -167.89 1.27 Allowed 'General case' 0 N--CA 1.488 1.443 0 O-C-N 121.217 -0.927 . . . . 0.32 109.451 179.898 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 329' ' ' THR . . . . . 0.409 ' HA ' ' O ' ' D' ' 330' ' ' LEU . 27.4 p -152.57 167.25 29.48 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.505 -0.747 . . . . 0.23 109.41 179.808 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 330' ' ' LEU . . . . . 0.742 HD11 HD22 ' D' ' 345' ' ' ASN . 30.7 tp -149.26 126.22 11.25 Favored 'General case' 0 N--CA 1.488 1.434 0 O-C-N 121.202 -0.936 . . . . 0.28 109.817 -179.785 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 331' ' ' GLN . . . . . . . . . . . . . 1.4 tp60 -85.75 107.93 17.83 Favored 'General case' 0 C--N 1.304 -1.41 0 O-C-N 121.211 -0.931 . . . . 0.91 108.773 179.325 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 332' ' ' ILE . . . . . . . . . . . . . 24.7 mt -103.17 113.96 41.43 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.493 0 O-C-N 121.094 -1.004 . . . . 0.24 109.585 -179.417 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 333' ' ' ARG . . . . . . . . . . . . . 54.7 mtm180 -73.62 153.99 39.94 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.388 -0.82 . . . . 2.93 109.648 179.85 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 334' ' ' GLY . . . . . . . . . . . . . . . 77.5 129.47 0.44 Allowed Glycine 0 N--CA 1.488 2.109 0 N-CA-C 109.834 -1.306 . . . . 0.4 109.834 179.577 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 335' ' ' ARG . . . . . 0.413 ' O ' ' HB3' ' B' ' 338' ' ' PHE . 32.3 ttp180 -79.82 -32.78 40.67 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.431 -1.04 . . . . 3.01 109.303 -179.977 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 336' ' ' GLU . . . . . . . . . . . . . 2.4 tt0 -57.92 -62.2 1.98 Allowed 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.518 -0.739 . . . . 2.28 109.795 179.884 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 337' ' ' ARG . . . . . 0.468 ' NH1' ' CG ' ' B' ' 337' ' ' ARG . 0.0 OUTLIER -59.25 -29.0 67.23 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.372 -0.83 . . . . 2.93 109.588 179.953 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' B' B ' 338' ' ' PHE . . . . . 0.413 ' HB3' ' O ' ' B' ' 335' ' ' ARG . 73.5 t80 -55.36 -57.21 12.76 Favored 'General case' 0 N--CA 1.487 1.405 0 O-C-N 121.289 -0.882 . . . . 0.37 109.502 -179.941 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 339' ' ' GLU . . . . . . . . . . . . . 3.1 mt-10 -51.95 -33.7 38.8 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.259 -0.901 . . . . 1.98 109.777 -179.719 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 340' ' ' MET . . . . . . . . . . . . . 31.3 ttp -63.18 -50.79 68.95 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.298 -0.876 . . . . 0.32 110.23 -179.458 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 341' ' ' PHE . . . . . . . . . . . . . 51.8 m-85 -62.49 -43.35 99.02 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.02 -1.05 . . . . 0.18 109.551 -179.484 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 342' ' ' ARG . . . . . 0.45 ' CG ' HH11 ' B' ' 342' ' ' ARG . 0.0 OUTLIER -51.63 -43.82 62.72 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.452 -0.78 . . . . 2.42 109.813 -179.887 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' B' B ' 343' ' ' GLU . . . . . . . . . . . . . 2.1 tt0 -59.05 -47.39 85.39 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.43 -0.794 . . . . 2.35 110.154 -179.426 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 344' ' ' LEU . . . . . 0.418 ' HA ' HD23 ' B' ' 344' ' ' LEU . 76.3 mt -62.37 -33.38 74.63 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.094 -1.004 . . . . 0.18 109.51 -179.913 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 345' ' ' ASN . . . . . 0.758 HD22 HD11 ' D' ' 330' ' ' LEU . 45.2 t-20 -59.32 -52.89 63.68 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.253 -0.905 . . . . 1.09 109.87 -179.98 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 346' ' ' GLU . . . . . . . . . . . . . 45.3 tt0 -61.53 -28.3 69.22 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.101 -1.0 . . . . 1.66 109.642 -179.769 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 347' ' ' ALA . . . . . 0.852 ' HB1' ' HB1' ' A' ' 347' ' ' ALA . . . -61.89 -58.59 7.34 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.354 -0.841 . . . . 0.17 109.973 -179.829 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 348' ' ' LEU . . . . . 0.56 HD22 ' N ' ' B' ' 348' ' ' LEU . 3.5 mm? -62.38 -43.41 98.89 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.092 -1.005 . . . . 0.29 109.715 -179.65 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 349' ' ' GLU . . . . . . . . . . . . . 3.7 mm-40 -56.78 -35.4 68.63 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.182 -0.949 . . . . 1.95 110.125 -179.424 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 350' ' ' LEU . . . . . 0.579 HD22 HD13 ' A' ' 350' ' ' LEU . 6.2 tt -64.04 -46.15 85.68 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.056 -1.028 . . . . 0.45 109.704 -179.769 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 351' ' ' LYS . . . . . . . . . . . . . 33.6 tttt -56.77 -49.7 74.52 Favored 'General case' 0 N--CA 1.488 1.45 0 O-C-N 121.429 -0.794 . . . . 1.38 109.388 -179.894 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 352' ' ' ASP . . . . . . . . . . . . . 60.6 m-20 -58.45 -39.67 80.52 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.278 -0.889 . . . . 1.16 109.888 -179.895 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 353' ' ' ALA . . . . . . . . . . . . . . . -66.48 -20.48 66.05 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.341 -0.849 . . . . 0.61 109.814 -179.545 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 354' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -83.19 -18.96 37.48 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 120.893 -1.129 . . . . 1.45 109.424 -179.925 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 355' ' ' ALA . . . . . . . . . . . . . . . -73.45 -9.82 59.09 Favored 'General case' 0 N--CA 1.489 1.479 0 O-C-N 121.244 -0.91 . . . . 0.98 109.482 179.731 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 356' ' ' GLY . . . . . . . . . . . . . . . -79.57 -3.25 88.82 Favored Glycine 0 N--CA 1.489 2.227 0 N-CA-C 109.536 -1.426 . . . . 1.29 109.536 179.871 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 357' ' ' LYS . . . . . . . . . . . . . 7.7 mttt -84.37 161.79 20.25 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.075 -1.25 . . . . 4.09 109.213 -179.979 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 358' ' ' GLU . . . . . . . . . . . . . 8.8 pt-20 -52.04 148.15 11.51 Favored Pre-proline 0 N--CA 1.49 1.57 0 O-C-N 121.104 -0.997 . . . . 5.72 109.59 179.991 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 359' ' ' PRO . . . . . . . . . . . . . 2.2 Cg_endo -62.46 -158.73 0.03 OUTLIER 'Trans proline' 0 C--N 1.313 -1.329 0 C-N-CA 122.262 1.974 . . . . 4.98 109.529 179.456 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 360' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.192 0 CA-C-O 117.926 -1.485 . . . . 6.98 109.537 179.796 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' C' C ' 319' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.493 1.718 0 N-CA-C 109.384 -0.598 . . . . 6.82 109.384 . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' C' C ' 320' ' ' LYS . . . . . . . . . . . . . 13.1 mtpt 54.31 99.65 0.01 OUTLIER 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.349 -0.844 . . . . 6.49 109.898 179.871 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' C' C ' 321' ' ' LYS . . . . . . . . . . . . . 19.5 mtpt -83.0 137.81 43.14 Favored Pre-proline 0 N--CA 1.496 1.837 0 O-C-N 121.147 -0.971 . . . . 6.4 109.95 179.886 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' C' C ' 322' ' ' PRO . . . . . . . . . . . . . 1.8 Cg_endo -67.43 -2.07 7.62 Favored 'Trans proline' 0 C--N 1.316 -1.164 0 C-N-CA 122.362 2.041 . . . . 3.42 110.957 179.662 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' C' C ' 323' ' ' LEU . . . . . . . . . . . . . 87.8 mt -83.59 32.36 0.46 Allowed 'General case' 0 N--CA 1.495 1.822 0 O-C-N 121.107 -0.996 . . . . 3.95 110.144 -179.837 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' C' C ' 324' ' ' ASP . . . . . . . . . . . . . 54.1 m-20 -77.58 -172.26 2.49 Favored 'General case' 0 N--CA 1.488 1.461 0 O-C-N 120.98 -1.075 . . . . 1.63 108.997 179.682 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' C' C ' 325' ' ' GLY . . . . . 0.509 ' O ' ' CE1' ' C' ' 327' ' ' TYR . . . -67.76 174.68 28.24 Favored Glycine 0 N--CA 1.488 2.151 0 N-CA-C 109.02 -1.632 . . . . 0.73 109.02 179.689 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' C' C ' 326' ' ' GLU . . . . . . . . . . . . . 3.0 mm-40 -55.99 -178.88 0.02 OUTLIER 'General case' 0 N--CA 1.488 1.467 0 O-C-N 121.207 -1.172 . . . . 2.17 109.099 179.943 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' C' C ' 327' ' ' TYR . . . . . 0.509 ' CE1' ' O ' ' C' ' 325' ' ' GLY . 47.4 m-85 -147.27 113.43 5.86 Favored 'General case' 0 C--N 1.3 -1.556 0 O-C-N 121.465 -0.772 . . . . 0.48 109.003 179.822 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' C' C ' 328' ' ' PHE . . . . . 0.568 ' CZ ' ' HB2' ' A' ' 335' ' ' ARG . 86.3 m-85 -111.61 -167.95 1.25 Allowed 'General case' 0 C--N 1.303 -1.435 0 O-C-N 121.068 -1.02 . . . . 0.33 109.578 -179.618 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' C' C ' 329' ' ' THR . . . . . . . . . . . . . 76.4 p -150.37 163.79 37.47 Favored 'General case' 0 N--CA 1.487 1.407 0 O-C-N 121.248 -0.908 . . . . 0.23 109.387 -179.831 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' C' C ' 330' ' ' LEU . . . . . 0.615 HD11 HD22 ' A' ' 345' ' ' ASN . 29.6 tp -150.07 130.04 13.44 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.434 -0.791 . . . . 0.28 109.609 -179.623 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' C' C ' 331' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -85.37 115.14 22.94 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.258 -0.901 . . . . 1.48 109.234 179.847 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' C' C ' 332' ' ' ILE . . . . . 0.911 HG21 ' HA ' ' C' ' 338' ' ' PHE . 50.8 mt -103.88 99.88 9.31 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.482 0 O-C-N 121.165 -0.959 . . . . 0.24 109.916 -179.768 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' C' C ' 333' ' ' ARG . . . . . 0.607 ' HG3' ' CE1' ' A' ' 327' ' ' TYR . 0.0 OUTLIER -71.48 144.69 49.59 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.132 -0.98 . . . . 2.74 109.527 179.892 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' C' C ' 334' ' ' GLY . . . . . . . . . . . . . . . 86.99 126.75 2.18 Favored Glycine 0 N--CA 1.492 2.394 0 N-CA-C 109.379 -1.488 . . . . 0.35 109.379 -179.991 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' C' C ' 335' ' ' ARG . . . . . 0.417 ' CG ' HH11 ' C' ' 335' ' ' ARG . 0.0 OUTLIER -77.86 -32.34 51.98 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.332 -1.099 . . . . 2.53 109.848 -179.865 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' C' C ' 336' ' ' GLU . . . . . . . . . . . . . 1.6 mt-10 -59.84 -62.58 1.77 Allowed 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.02 -1.05 . . . . 2.62 110.062 -179.672 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' C' C ' 337' ' ' ARG . . . . . . . . . . . . . 10.5 mpt_? -62.08 -29.35 70.25 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.269 -0.895 . . . . 2.81 110.263 -179.621 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' C' C ' 338' ' ' PHE . . . . . 0.911 ' HA ' HG21 ' C' ' 332' ' ' ILE . 68.1 t80 -52.4 -60.21 3.49 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.137 -0.977 . . . . 0.4 109.621 -179.752 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' C' C ' 339' ' ' GLU . . . . . . . . . . . . . 3.6 mt-10 -51.89 -31.11 26.86 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.382 -0.824 . . . . 2.05 109.882 -179.836 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' C' C ' 340' ' ' MET . . . . . . . . . . . . . 38.5 ttp -63.28 -52.72 60.83 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.232 -0.917 . . . . 0.32 109.471 -179.847 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' C' C ' 341' ' ' PHE . . . . . . . . . . . . . 40.2 m-85 -60.69 -42.21 96.7 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.148 -0.97 . . . . 0.18 109.735 -179.745 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' C' C ' 342' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -52.29 -43.08 64.27 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.215 -0.928 . . . . 2.91 109.683 179.928 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' C' C ' 343' ' ' GLU . . . . . . . . . . . . . 7.5 tp10 -59.77 -45.51 92.03 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 120.912 -1.118 . . . . 2.14 110.32 -179.49 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' C' C ' 344' ' ' LEU . . . . . . . . . . . . . 48.9 mt -62.5 -42.81 99.75 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.324 -0.86 . . . . 0.22 110.081 -179.387 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' C' C ' 345' ' ' ASN . . . . . . . . . . . . . 22.5 t-20 -54.12 -50.93 65.76 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.211 -0.931 . . . . 1.08 109.627 -179.379 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' C' C ' 346' ' ' GLU . . . . . . . . . . . . . 1.2 tt0 -61.03 -36.36 79.35 Favored 'General case' 0 C--N 1.301 -1.514 0 O-C-N 121.521 -0.737 . . . . 2.21 109.919 -179.773 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' C' C ' 347' ' ' ALA . . . . . 0.876 ' HB1' ' HB1' ' D' ' 347' ' ' ALA . . . -58.88 -52.76 64.35 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.075 -1.016 . . . . 0.18 110.1 -179.529 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' C' C ' 348' ' ' LEU . . . . . 0.529 HD22 ' N ' ' C' ' 348' ' ' LEU . 2.7 mm? -62.22 -40.6 96.65 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.327 -0.858 . . . . 0.32 109.721 -179.768 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' C' C ' 349' ' ' GLU . . . . . . . . . . . . . 4.1 mt-10 -59.73 -36.77 77.26 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.138 -0.976 . . . . 2.19 110.653 -179.247 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' C' C ' 350' ' ' LEU . . . . . 0.646 HD13 HD22 ' D' ' 350' ' ' LEU . 5.3 tt -62.61 -45.96 90.49 Favored 'General case' 0 N--CA 1.494 1.74 0 O-C-N 121.126 -0.984 . . . . 0.46 109.726 -178.953 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' C' C ' 351' ' ' LYS . . . . . . . . . . . . . 24.2 tttm -59.65 -43.73 93.81 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.111 -0.993 . . . . 1.35 109.903 -179.497 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' C' C ' 352' ' ' ASP . . . . . . . . . . . . . 13.2 m-20 -58.58 -32.16 68.69 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.06 -1.025 . . . . 1.19 109.417 -179.616 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' C' C ' 353' ' ' ALA . . . . . . . . . . . . . . . -68.29 -24.58 64.88 Favored 'General case' 0 C--N 1.301 -1.504 0 O-C-N 121.234 -0.916 . . . . 0.57 110.378 -179.37 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' C' C ' 354' ' ' GLN . . . . . . . . . . . . . 15.2 mt-30 -84.31 -19.15 34.22 Favored 'General case' 0 N--CA 1.494 1.763 0 O-C-N 121.049 -1.032 . . . . 1.47 110.122 -179.42 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' C' C ' 355' ' ' ALA . . . . . . . . . . . . . . . -73.29 -0.8 15.59 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.273 -0.892 . . . . 0.93 109.699 179.429 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' C' C ' 356' ' ' GLY . . . . . . . . . . . . . . . -79.72 -72.94 1.17 Allowed Glycine 0 N--CA 1.492 2.386 0 N-CA-C 110.244 -1.142 . . . . 1.33 110.244 -179.694 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' C' C ' 357' ' ' LYS . . . . . . . . . . . . . 3.4 ptmt -81.37 127.41 32.73 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 120.993 -1.298 . . . . 4.01 109.758 -179.241 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' C' C ' 358' ' ' GLU . . . . . . . . . . . . . 1.6 mt-10 -50.55 110.22 1.62 Allowed Pre-proline 0 C--N 1.304 -1.381 0 O-C-N 121.073 -1.017 . . . . 5.75 109.07 179.794 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' C' C ' 359' ' ' PRO . . . . . . . . . . . . . 3.3 Cg_exo -60.18 -80.97 0.01 OUTLIER 'Trans proline' 0 C--N 1.312 -1.386 0 C-N-CA 122.055 1.836 . . . . 4.94 110.488 -179.923 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' C' C ' 360' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 2.403 0 CA-C-O 118.079 -1.4 . . . . 6.5 109.661 -179.861 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' D' D ' 319' ' ' LYS . . . . . . . . . . . . . 20.0 mttt . . . . . 0 N--CA 1.492 1.63 0 CA-C-O 121.492 0.663 . . . . 7.53 109.538 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' D' D ' 320' ' ' LYS . . . . . . . . . . . . . 1.3 mttt 60.74 165.36 0.08 Allowed 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.451 -0.78 . . . . 6.41 109.553 179.856 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' D' D ' 321' ' ' LYS . . . . . . . . . . . . . 2.2 mttt -154.92 101.29 2.32 Favored Pre-proline 0 N--CA 1.494 1.771 0 O-C-N 121.367 -0.833 . . . . 6.11 109.53 179.917 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' D' D ' 322' ' ' PRO . . . . . . . . . . . . . 1.5 Cg_endo -66.91 2.46 2.09 Favored 'Trans proline' 0 C--N 1.313 -1.316 0 C-N-CA 122.48 2.12 . . . . 2.82 110.972 179.954 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' D' D ' 323' ' ' LEU . . . . . 0.447 ' HA ' HD23 ' D' ' 323' ' ' LEU . 20.2 mt -81.19 34.97 0.37 Allowed 'General case' 0 N--CA 1.494 1.728 0 O-C-N 120.76 -1.213 . . . . 2.83 110.519 179.983 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' D' D ' 324' ' ' ASP . . . . . 0.444 ' HB2' ' OH ' ' D' ' 327' ' ' TYR . 10.8 m-20 -82.95 -154.19 0.14 Allowed 'General case' 0 C--N 1.304 -1.386 0 O-C-N 121.026 -1.046 . . . . 1.54 109.234 179.394 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' D' D ' 325' ' ' GLY . . . . . 0.486 ' O ' ' CE2' ' D' ' 327' ' ' TYR . . . -69.42 177.33 29.71 Favored Glycine 0 N--CA 1.494 2.503 0 N-CA-C 109.54 -1.424 . . . . 0.59 109.54 -179.966 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' D' D ' 326' ' ' GLU . . . . . . . . . . . . . 1.6 mm-40 -58.65 175.57 0.25 Allowed 'General case' 0 C--N 1.302 -1.493 0 O-C-N 121.33 -1.1 . . . . 2.13 109.162 179.921 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' D' D ' 327' ' ' TYR . . . . . 0.486 ' CE2' ' O ' ' D' ' 325' ' ' GLY . 54.7 m-85 -148.26 109.42 4.32 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.183 -0.948 . . . . 0.47 109.659 -179.854 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' D' D ' 328' ' ' PHE . . . . . . . . . . . . . 68.8 m-85 -114.37 -168.18 1.33 Allowed 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.504 -0.747 . . . . 0.3 109.732 -179.878 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' D' D ' 329' ' ' THR . . . . . 0.416 ' HA ' ' O ' ' B' ' 330' ' ' LEU . 32.9 p -152.87 166.25 32.9 Favored 'General case' 0 N--CA 1.489 1.49 0 O-C-N 121.179 -0.95 . . . . 0.22 109.298 -179.829 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' D' D ' 330' ' ' LEU . . . . . 0.758 HD11 HD22 ' B' ' 345' ' ' ASN . 24.1 tp -148.32 125.99 11.8 Favored 'General case' 0 N--CA 1.488 1.461 0 O-C-N 121.297 -0.877 . . . . 0.28 109.723 -179.734 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' D' D ' 331' ' ' GLN . . . . . . . . . . . . . 1.4 tp60 -85.36 108.69 17.95 Favored 'General case' 0 C--N 1.302 -1.473 0 O-C-N 121.314 -0.866 . . . . 0.93 108.75 179.591 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' D' D ' 332' ' ' ILE . . . . . . . . . . . . . 31.9 mt -103.33 114.52 43.16 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.641 0 O-C-N 121.146 -0.971 . . . . 0.25 110.003 -179.498 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' D' D ' 333' ' ' ARG . . . . . . . . . . . . . 53.4 mtm180 -73.83 151.78 40.43 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.2 -0.938 . . . . 2.93 109.839 179.932 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' D' D ' 334' ' ' GLY . . . . . . . . . . . . . . . 79.3 128.32 0.6 Allowed Glycine 0 N--CA 1.49 2.273 0 N-CA-C 109.894 -1.282 . . . . 0.41 109.894 179.237 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' D' D ' 335' ' ' ARG . . . . . 0.439 ' HB2' ' CE2' ' B' ' 328' ' ' PHE . 33.2 ttp180 -78.75 -32.09 46.51 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.224 -1.162 . . . . 3.03 109.356 179.904 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' D' D ' 336' ' ' GLU . . . . . . . . . . . . . 2.1 tt0 -58.02 -62.26 1.95 Allowed 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.344 -0.847 . . . . 2.26 109.515 -179.993 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' D' D ' 337' ' ' ARG . . . . . 0.452 ' NH1' ' CG ' ' D' ' 337' ' ' ARG . 0.0 OUTLIER -59.38 -29.62 67.83 Favored 'General case' 0 C--N 1.301 -1.502 0 O-C-N 121.229 -0.919 . . . . 2.92 109.719 -179.608 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' D' D ' 338' ' ' PHE . . . . . 0.42 ' HB3' ' O ' ' D' ' 335' ' ' ARG . 68.0 t80 -54.22 -56.44 18.24 Favored 'General case' 0 C--N 1.3 -1.574 0 O-C-N 121.491 -0.756 . . . . 0.37 109.429 179.953 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' D' D ' 339' ' ' GLU . . . . . . . . . . . . . 3.3 mt-10 -52.49 -34.65 50.36 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.022 -1.049 . . . . 1.99 109.924 -179.893 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' D' D ' 340' ' ' MET . . . . . . . . . . . . . 32.4 ttp -62.83 -50.24 71.75 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.137 -0.977 . . . . 0.31 110.143 -179.308 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' D' D ' 341' ' ' PHE . . . . . . . . . . . . . 46.8 m-85 -62.77 -44.24 96.7 Favored 'General case' 0 C--N 1.301 -1.511 0 O-C-N 120.944 -1.097 . . . . 0.18 109.669 -179.484 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' D' D ' 342' ' ' ARG . . . . . 0.453 ' NH1' ' CG ' ' D' ' 342' ' ' ARG . 0.0 OUTLIER -51.9 -41.65 62.11 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.236 -0.915 . . . . 2.41 109.821 -179.478 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' D' D ' 343' ' ' GLU . . . . . . . . . . . . . 3.6 tt0 -60.4 -46.62 89.32 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.183 -0.948 . . . . 2.35 109.84 -179.346 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' D' D ' 344' ' ' LEU . . . . . 0.451 ' HA ' HD23 ' D' ' 344' ' ' LEU . 71.6 mt -62.44 -34.68 77.28 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.283 -0.886 . . . . 0.19 109.469 -179.844 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' D' D ' 345' ' ' ASN . . . . . 0.742 HD22 HD11 ' B' ' 330' ' ' LEU . 43.2 t-20 -58.49 -52.19 66.68 Favored 'General case' 0 C--N 1.302 -1.492 0 O-C-N 121.319 -0.863 . . . . 1.09 109.723 -179.741 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' D' D ' 346' ' ' GLU . . . . . . . . . . . . . 42.7 tt0 -62.27 -29.25 70.29 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.39 -0.819 . . . . 1.69 109.678 -179.68 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' D' D ' 347' ' ' ALA . . . . . 0.876 ' HB1' ' HB1' ' C' ' 347' ' ' ALA . . . -61.88 -57.23 12.6 Favored 'General case' 0 N--CA 1.493 1.713 0 O-C-N 121.421 -0.799 . . . . 0.18 109.966 -179.614 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' D' D ' 348' ' ' LEU . . . . . 0.552 HD22 ' N ' ' D' ' 348' ' ' LEU . 3.4 mm? -63.16 -44.06 96.55 Favored 'General case' 0 N--CA 1.488 1.472 0 O-C-N 121.186 -0.946 . . . . 0.31 109.762 -179.804 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' D' D ' 349' ' ' GLU . . . . . . . . . . . . . 3.5 mm-40 -57.22 -34.13 68.24 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.109 -0.995 . . . . 1.95 110.066 -179.232 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' D' D ' 350' ' ' LEU . . . . . 0.646 HD22 HD13 ' C' ' 350' ' ' LEU . 6.2 tt -64.08 -46.13 85.64 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.181 -0.95 . . . . 0.43 109.413 179.885 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' D' D ' 351' ' ' LYS . . . . . . . . . . . . . 42.0 tttt -57.6 -48.43 79.42 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.252 -0.905 . . . . 1.4 109.59 -179.939 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' D' D ' 352' ' ' ASP . . . . . . . . . . . . . 72.4 m-20 -58.66 -38.89 79.13 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.401 -0.812 . . . . 1.17 109.462 179.458 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' D' D ' 353' ' ' ALA . . . . . . . . . . . . . . . -67.65 -20.71 65.35 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.485 -0.759 . . . . 0.59 109.958 -179.514 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' D' D ' 354' ' ' GLN . . . . . 0.44 ' NE2' HD11 ' C' ' 350' ' ' LEU . 1.1 mt-30 -84.11 -19.2 34.64 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.365 -0.834 . . . . 1.44 109.675 -179.887 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' D' D ' 355' ' ' ALA . . . . . . . . . . . . . . . -73.52 -10.61 59.89 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.36 -0.837 . . . . 0.98 109.681 -179.93 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' D' D ' 356' ' ' GLY . . . . . . . . . . . . . . . -79.4 -2.71 88.06 Favored Glycine 0 N--CA 1.492 2.378 0 N-CA-C 109.282 -1.527 . . . . 1.28 109.282 179.958 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' D' D ' 357' ' ' LYS . . . . . . . . . . . . . 8.0 mttt -84.17 162.0 20.38 Favored 'General case' 0 N--CA 1.487 1.422 0 O-C-N 121.199 -1.177 . . . . 4.09 109.213 -179.81 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' D' D ' 358' ' ' GLU . . . . . . . . . . . . . 4.4 pt-20 -52.4 147.39 14.21 Favored Pre-proline 0 N--CA 1.495 1.795 0 O-C-N 121.115 -0.991 . . . . 5.71 109.605 -179.773 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' D' D ' 359' ' ' PRO . . . . . . . . . . . . . 2.7 Cg_endo -61.74 -158.68 0.02 OUTLIER 'Trans proline' 0 C--N 1.311 -1.429 0 C-N-CA 122.212 1.941 . . . . 4.97 110.57 -179.954 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' D' D ' 360' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.486 2.025 0 N-CA-C 109.13 -1.588 . . . . 6.97 109.13 179.777 . . . . . . . . 0 0 . 1 . 021 nuclear nobuild full ' A' A ' 319' ' ' LYS . . . . . . . . . . . . . 3.6 mmtm . . . . . 0 N--CA 1.491 1.588 0 N-CA-C 109.477 -0.564 . . . . 7.55 109.477 . . . . . . . . . 0 0 . 1 . 021 nuclear nobuild full ' A' A ' 320' ' ' LYS . . . . . . . . . . . . . 5.8 tttm 60.07 96.71 0.03 OUTLIER 'General case' 0 N--CA 1.489 1.476 0 O-C-N 121.254 -0.903 . . . . 6.43 109.347 179.953 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 321' ' ' LYS . . . . . 0.426 ' HB2' ' HD2' ' A' ' 322' ' ' PRO . 15.7 pttt -80.86 155.78 72.84 Favored Pre-proline 0 N--CA 1.491 1.607 0 O-C-N 121.251 -0.905 . . . . 6.13 109.232 -179.978 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 322' ' ' PRO . . . . . 0.426 ' HD2' ' HB2' ' A' ' 321' ' ' LYS . 5.4 Cg_exo -58.27 -157.04 0.01 OUTLIER 'Trans proline' 0 C--N 1.308 -1.564 0 C-N-CA 121.991 1.794 . . . . 2.83 110.081 179.996 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 323' ' ' LEU . . . . . 0.407 HD23 ' HA ' ' A' ' 323' ' ' LEU . 34.8 mt -79.6 150.52 31.01 Favored 'General case' 0 N--CA 1.489 1.484 0 O-C-N 121.137 -0.977 . . . . 2.83 109.39 -179.972 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 324' ' ' ASP . . . . . 0.41 ' HB2' ' OH ' ' A' ' 327' ' ' TYR . 42.5 m-20 -78.45 -165.49 0.7 Allowed 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.208 -0.932 . . . . 1.53 109.668 -179.713 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 325' ' ' GLY . . . . . . . . . . . . . . . -69.8 -160.98 2.92 Favored Glycine 0 N--CA 1.489 2.221 0 N-CA-C 109.686 -1.366 . . . . 0.61 109.686 -179.884 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 326' ' ' GLU . . . . . . . . . . . . . 7.1 mt-10 -59.07 -169.55 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.313 -1.11 . . . . 2.13 109.634 179.982 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 327' ' ' TYR . . . . . 0.575 ' CE1' ' HG2' ' C' ' 333' ' ' ARG . 41.4 m-85 -149.79 115.52 5.59 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.394 -0.816 . . . . 0.48 109.628 179.975 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 328' ' ' PHE . . . . . 0.482 ' CE1' ' HA ' ' C' ' 335' ' ' ARG . 76.6 m-85 -113.51 -170.52 1.71 Allowed 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.36 -0.837 . . . . 0.31 109.385 179.928 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 329' ' ' THR . . . . . 0.405 HG23 ' O ' ' A' ' 328' ' ' PHE . 27.3 p -154.08 167.47 29.69 Favored 'General case' 0 N--CA 1.489 1.483 0 O-C-N 121.302 -0.874 . . . . 0.22 109.39 -179.849 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 330' ' ' LEU . . . . . . . . . . . . . 14.7 tp -148.51 126.9 12.27 Favored 'General case' 0 N--CA 1.489 1.487 0 O-C-N 121.251 -0.906 . . . . 0.28 109.359 -179.944 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 331' ' ' GLN . . . . . . . . . . . . . 1.1 tp60 -86.95 111.38 20.78 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.236 -0.915 . . . . 0.91 109.473 -179.996 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 332' ' ' ILE . . . . . . . . . . . . . 32.2 mt -103.61 110.26 29.47 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.501 0 O-C-N 121.245 -0.909 . . . . 0.26 109.486 -179.946 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 333' ' ' ARG . . . . . 0.406 ' CG ' ' CE2' ' C' ' 327' ' ' TYR . 2.4 mpt_? -72.36 143.44 48.61 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.287 -0.883 . . . . 2.92 109.241 179.793 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 334' ' ' GLY . . . . . . . . . . . . . . . 83.74 130.24 1.76 Allowed Glycine 0 N--CA 1.491 2.327 0 N-CA-C 109.525 -1.43 . . . . 0.4 109.525 -179.869 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 335' ' ' ARG . . . . . 0.497 ' HB2' ' CZ ' ' C' ' 328' ' ' PHE . 6.1 ttm180 -79.07 -28.48 43.11 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.344 -1.092 . . . . 3.01 109.622 -179.834 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 336' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -56.79 -67.16 0.34 Allowed 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.208 -0.933 . . . . 2.29 109.799 -179.701 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 337' ' ' ARG . . . . . 0.45 HH11 ' HG2' ' A' ' 337' ' ' ARG . 0.8 OUTLIER -60.38 -25.79 66.16 Favored 'General case' 0 N--CA 1.488 1.47 0 O-C-N 121.251 -0.905 . . . . 2.93 109.68 -179.766 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 338' ' ' PHE . . . . . 0.441 ' HB3' ' O ' ' A' ' 335' ' ' ARG . 67.6 t80 -55.39 -60.59 3.2 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.3 -0.875 . . . . 0.38 109.677 179.982 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 339' ' ' GLU . . . . . . . . . . . . . 79.0 mt-10 -51.36 -31.71 23.16 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.281 -0.887 . . . . 1.97 109.998 -179.738 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 340' ' ' MET . . . . . . . . . . . . . 9.5 ttp -63.27 -52.58 61.49 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.159 -0.963 . . . . 0.31 109.954 -179.575 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 341' ' ' PHE . . . . . . . . . . . . . 48.3 m-85 -61.85 -41.68 98.12 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.226 -0.921 . . . . 0.18 109.74 -179.587 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 342' ' ' ARG . . . . . 0.488 ' HG2' ' NH1' ' A' ' 342' ' ' ARG . 0.0 OUTLIER -50.9 -41.73 58.74 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.17 -0.956 . . . . 2.42 109.888 -179.867 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 343' ' ' GLU . . . . . . . . . . . . . 28.3 tt0 -59.67 -50.71 72.78 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.235 -0.916 . . . . 2.35 110.195 -179.544 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 344' ' ' LEU . . . . . 0.763 HD22 HD22 ' B' ' 344' ' ' LEU . 41.0 mt -61.29 -30.04 70.23 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.121 -0.987 . . . . 0.18 109.92 -179.477 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 345' ' ' ASN . . . . . 0.462 ' HB2' HD21 ' C' ' 330' ' ' LEU . 29.3 t-20 -57.52 -56.96 15.18 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.235 -0.916 . . . . 1.09 109.993 -179.659 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 346' ' ' GLU . . . . . . . . . . . . . 70.9 tt0 -61.47 -29.47 69.99 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.219 -0.926 . . . . 1.65 110.183 -179.452 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 347' ' ' ALA . . . . . 0.896 ' HB1' ' HB1' ' B' ' 347' ' ' ALA . . . -60.07 -55.89 28.37 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.115 -0.991 . . . . 0.18 110.066 -179.522 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 348' ' ' LEU . . . . . 0.582 HD22 ' N ' ' A' ' 348' ' ' LEU . 4.2 mm? -61.84 -44.62 96.47 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.257 -0.902 . . . . 0.3 110.07 -179.434 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 349' ' ' GLU . . . . . 0.413 ' HG3' ' O ' ' A' ' 345' ' ' ASN . 55.8 mt-10 -57.4 -35.7 70.36 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.077 -1.015 . . . . 1.94 109.945 -179.438 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 350' ' ' LEU . . . . . 0.706 HD11 ' NE2' ' B' ' 354' ' ' GLN . 6.1 tt -64.45 -40.41 95.68 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.208 -0.933 . . . . 0.46 109.63 -179.765 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 351' ' ' LYS . . . . . . . . . . . . . 2.3 ttmt -57.67 -56.63 19.43 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.285 -0.884 . . . . 1.4 109.895 -179.577 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 352' ' ' ASP . . . . . . . . . . . . . 11.8 m-20 -56.55 -37.54 70.66 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.155 -0.966 . . . . 1.16 109.815 -179.842 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 353' ' ' ALA . . . . . . . . . . . . . . . -67.34 -26.35 66.45 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.228 -0.92 . . . . 0.63 110.183 -179.439 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 354' ' ' GLN . . . . . 0.644 ' NE2' HD11 ' B' ' 350' ' ' LEU . 0.1 OUTLIER -83.61 -12.96 55.37 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.023 -1.048 . . . . 1.47 109.797 -179.751 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 355' ' ' ALA . . . . . . . . . . . . . . . -72.78 -21.86 60.93 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.066 -1.021 . . . . 1.01 109.269 179.836 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 356' ' ' GLY . . . . . . . . . . . . . . . -81.68 16.84 17.64 Favored Glycine 0 N--CA 1.492 2.375 0 N-CA-C 110.316 -1.114 . . . . 1.3 110.316 179.947 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 357' ' ' LYS . . . . . . . . . . . . . 41.8 tttt -85.43 111.5 20.01 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 120.989 -1.301 . . . . 4.1 109.722 -179.619 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 358' ' ' GLU . . . . . . . . . . . . . 5.5 mt-10 -48.43 112.98 2.57 Favored Pre-proline 0 N--CA 1.489 1.495 0 O-C-N 121.256 -0.902 . . . . 5.75 109.252 179.818 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 359' ' ' PRO . . . . . . . . . . . . . 2.4 Cg_endo -61.72 137.77 70.56 Favored 'Trans proline' 0 C--N 1.312 -1.347 0 C-N-CA 121.953 1.769 . . . . 5.0 110.214 -179.82 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 360' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.245 0 CA-C-O 118.024 -1.431 . . . . 6.97 109.538 179.972 . . . . . . . . 0 0 . 1 . 021 nuclear nobuild full ' B' B ' 319' ' ' LYS . . . . . . . . . . . . . 3.5 mmtm . . . . . 0 N--CA 1.489 1.511 0 N-CA-C 109.41 -0.589 . . . . 7.55 109.41 . . . . . . . . . 0 0 . 1 . 021 nuclear nobuild full ' B' B ' 320' ' ' LYS . . . . . . . . . . . . . 5.1 tttm 59.37 97.01 0.03 OUTLIER 'General case' 0 N--CA 1.489 1.492 0 O-C-N 121.237 -0.914 . . . . 6.44 109.423 179.99 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 321' ' ' LYS . . . . . 0.412 ' HB2' ' HD2' ' B' ' 322' ' ' PRO . 15.2 pttt -81.11 155.78 72.21 Favored Pre-proline 0 N--CA 1.489 1.499 0 O-C-N 121.201 -0.937 . . . . 6.13 109.215 179.971 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' B' B ' 322' ' ' PRO . . . . . 0.412 ' HD2' ' HB2' ' B' ' 321' ' ' LYS . 5.5 Cg_exo -58.36 -156.9 0.01 OUTLIER 'Trans proline' 0 C--N 1.308 -1.6 0 C-N-CA 122.006 1.804 . . . . 2.82 110.105 179.987 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' B' B ' 323' ' ' LEU . . . . . 0.43 HD23 ' HA ' ' B' ' 323' ' ' LEU . 36.6 mt -79.55 150.54 31.08 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.12 -0.987 . . . . 2.84 109.393 -179.983 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' B' B ' 324' ' ' ASP . . . . . 0.407 ' HB2' ' OH ' ' B' ' 327' ' ' TYR . 43.7 m-20 -78.43 -165.18 0.65 Allowed 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.26 -0.9 . . . . 1.53 109.583 -179.802 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' B' B ' 325' ' ' GLY . . . . . . . . . . . . . . . -70.25 -160.94 3.27 Favored Glycine 0 N--CA 1.49 2.248 0 N-CA-C 109.731 -1.348 . . . . 0.59 109.731 -179.819 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 326' ' ' GLU . . . . . . . . . . . . . 7.1 mt-10 -58.86 -169.41 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.341 -1.093 . . . . 2.13 109.625 179.989 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 327' ' ' TYR . . . . . 0.534 ' CE1' ' CG ' ' D' ' 333' ' ' ARG . 41.7 m-85 -149.84 115.42 5.55 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.339 -0.851 . . . . 0.48 109.607 179.96 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' B' B ' 328' ' ' PHE . . . . . 0.482 ' CZ ' ' HB2' ' D' ' 335' ' ' ARG . 75.9 m-85 -113.54 -170.72 1.75 Allowed 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.352 -0.843 . . . . 0.32 109.321 179.885 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' B' B ' 329' ' ' THR . . . . . 0.482 ' HA ' ' O ' ' D' ' 330' ' ' LEU . 27.7 p -153.89 167.64 29.02 Favored 'General case' 0 N--CA 1.488 1.471 0 O-C-N 121.311 -0.868 . . . . 0.23 109.383 -179.978 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' B' B ' 330' ' ' LEU . . . . . 0.49 ' O ' ' HA ' ' D' ' 329' ' ' THR . 14.5 tp -148.74 126.06 11.54 Favored 'General case' 0 N--CA 1.488 1.45 0 O-C-N 121.207 -0.933 . . . . 0.28 109.491 -179.859 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' B' B ' 331' ' ' GLN . . . . . . . . . . . . . 1.1 tt0 -86.24 111.32 20.31 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.243 -0.911 . . . . 0.91 109.624 -179.905 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 332' ' ' ILE . . . . . . . . . . . . . 31.9 mt -103.36 110.63 30.39 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.538 0 O-C-N 121.23 -0.919 . . . . 0.24 109.564 179.922 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 333' ' ' ARG . . . . . 0.595 ' CG ' ' CE1' ' D' ' 327' ' ' TYR . 2.4 mpt_? -72.57 143.53 48.23 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.19 -0.944 . . . . 2.93 109.261 179.822 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' B' B ' 334' ' ' GLY . . . . . . . . . . . . . . . 83.55 130.04 1.67 Allowed Glycine 0 N--CA 1.49 2.254 0 N-CA-C 109.521 -1.431 . . . . 0.4 109.521 -179.981 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 335' ' ' ARG . . . . . 0.504 ' HB2' ' CZ ' ' D' ' 328' ' ' PHE . 6.2 ttm180 -78.68 -28.41 45.29 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.289 -1.124 . . . . 3.01 109.737 -179.947 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' B' B ' 336' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -56.7 -67.42 0.31 Allowed 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.236 -0.915 . . . . 2.28 109.796 -179.714 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' B' B ' 337' ' ' ARG . . . . . 0.438 HH11 ' HG2' ' B' ' 337' ' ' ARG . 0.8 OUTLIER -60.3 -25.52 65.81 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.271 -0.893 . . . . 2.93 109.676 -179.798 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' B' B ' 338' ' ' PHE . . . . . 0.437 ' HB3' ' O ' ' B' ' 335' ' ' ARG . 66.8 t80 -55.67 -60.7 3.07 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.221 -0.924 . . . . 0.37 109.517 -179.96 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' B' B ' 339' ' ' GLU . . . . . . . . . . . . . 79.1 mt-10 -51.32 -31.77 22.89 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.365 -0.834 . . . . 1.98 109.965 -179.673 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 340' ' ' MET . . . . . . . . . . . . . 9.4 ttp -63.32 -52.52 61.54 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.149 -0.969 . . . . 0.32 110.041 -179.597 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 341' ' ' PHE . . . . . . . . . . . . . 48.3 m-85 -61.64 -42.14 98.48 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.167 -0.958 . . . . 0.18 109.761 -179.695 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 342' ' ' ARG . . . . . 0.494 ' NH1' ' HG2' ' B' ' 342' ' ' ARG . 0.0 OUTLIER -50.32 -42.03 52.13 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.334 -0.854 . . . . 2.42 109.857 -179.894 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' B' B ' 343' ' ' GLU . . . . . . . . . . . . . 27.3 tt0 -59.55 -50.7 72.88 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.255 -0.903 . . . . 2.35 110.258 -179.411 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 344' ' ' LEU . . . . . 0.763 HD22 HD22 ' A' ' 344' ' ' LEU . 40.0 mt -61.38 -29.82 70.15 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.127 -0.983 . . . . 0.18 109.929 -179.537 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' B' B ' 345' ' ' ASN . . . . . 0.412 ' O ' ' HG3' ' B' ' 349' ' ' GLU . 29.2 t-20 -57.58 -57.0 14.67 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.245 -0.909 . . . . 1.09 110.017 -179.688 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' B' B ' 346' ' ' GLU . . . . . . . . . . . . . 71.0 tt0 -61.5 -29.4 69.96 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.214 -0.928 . . . . 1.66 110.246 -179.395 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 347' ' ' ALA . . . . . 0.896 ' HB1' ' HB1' ' A' ' 347' ' ' ALA . . . -60.28 -55.78 29.56 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.136 -0.978 . . . . 0.17 110.061 -179.516 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' B' B ' 348' ' ' LEU . . . . . 0.575 HD22 ' N ' ' B' ' 348' ' ' LEU . 4.2 mm? -61.82 -44.59 96.56 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.203 -0.936 . . . . 0.29 110.005 -179.468 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' B' B ' 349' ' ' GLU . . . . . 0.412 ' HG3' ' O ' ' B' ' 345' ' ' ASN . 56.4 mt-10 -57.38 -35.78 70.42 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.172 -0.955 . . . . 1.95 109.946 -179.471 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' B' B ' 350' ' ' LEU . . . . . 0.644 HD11 ' NE2' ' A' ' 354' ' ' GLN . 6.1 tt -64.4 -40.28 95.48 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.269 -0.894 . . . . 0.45 109.791 -179.826 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' B' B ' 351' ' ' LYS . . . . . . . . . . . . . 2.3 ttmt -57.87 -56.55 20.48 Favored 'General case' 0 N--CA 1.489 1.525 0 O-C-N 121.192 -0.943 . . . . 1.38 109.915 -179.595 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 352' ' ' ASP . . . . . . . . . . . . . 11.5 m-20 -56.69 -37.35 70.75 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.178 -0.951 . . . . 1.16 109.791 -179.882 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 353' ' ' ALA . . . . . . . . . . . . . . . -67.33 -26.28 66.42 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.208 -0.933 . . . . 0.61 110.049 -179.513 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 354' ' ' GLN . . . . . 0.706 ' NE2' HD11 ' A' ' 350' ' ' LEU . 0.1 OUTLIER -83.84 -12.87 54.95 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.05 -1.031 . . . . 1.45 109.936 -179.59 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' B' B ' 355' ' ' ALA . . . . . . . . . . . . . . . -72.94 -21.99 60.79 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.139 -0.975 . . . . 0.98 109.329 179.826 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 356' ' ' GLY . . . . . . . . . . . . . . . -81.38 17.03 14.85 Favored Glycine 0 N--CA 1.491 2.307 0 N-CA-C 110.342 -1.103 . . . . 1.29 110.342 179.868 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 357' ' ' LYS . . . . . . . . . . . . . 42.1 tttt -85.64 111.46 20.1 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 120.831 -1.394 . . . . 4.09 109.747 -179.645 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 358' ' ' GLU . . . . . . . . . . . . . 5.5 mt-10 -48.36 112.61 2.38 Favored Pre-proline 0 N--CA 1.49 1.566 0 O-C-N 121.272 -0.893 . . . . 5.72 109.323 179.805 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 359' ' ' PRO . . . . . . . . . . . . . 2.4 Cg_endo -61.53 138.44 75.79 Favored 'Trans proline' 0 C--N 1.313 -1.329 0 C-N-CA 121.996 1.797 . . . . 4.98 110.306 -179.84 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 360' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.18 0 CA-C-O 117.925 -1.486 . . . . 6.98 109.55 -179.956 . . . . . . . . 0 0 . 1 . 021 nuclear nobuild full ' C' C ' 319' ' ' LYS . . . . . 0.439 ' O ' ' HB2' ' C' ' 320' ' ' LYS . 10.2 mttp . . . . . 0 N--CA 1.49 1.56 0 N-CA-C 109.43 -0.581 . . . . 6.82 109.43 . . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' C' C ' 320' ' ' LYS . . . . . 0.439 ' HB2' ' O ' ' C' ' 319' ' ' LYS . 9.8 mtmt 61.14 166.27 0.09 Allowed 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.279 -0.888 . . . . 6.49 109.678 179.899 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' C' C ' 321' ' ' LYS . . . . . . . . . . . . . 1.7 mttp -157.73 145.11 13.57 Favored Pre-proline 0 N--CA 1.49 1.542 0 O-C-N 121.23 -0.919 . . . . 6.4 109.318 179.875 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' C' C ' 322' ' ' PRO . . . . . . . . . . . . . 3.4 Cg_exo -60.78 178.03 0.56 Allowed 'Trans proline' 0 C--N 1.31 -1.449 0 C-N-CA 122.168 1.912 . . . . 3.42 110.317 -179.865 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' C' C ' 323' ' ' LEU . . . . . . . . . . . . . 44.8 mt -79.38 120.49 23.88 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.343 -0.848 . . . . 3.95 109.208 179.855 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' C' C ' 324' ' ' ASP . . . . . 0.485 ' HB3' ' OH ' ' C' ' 327' ' ' TYR . 90.0 m-20 -79.61 146.08 32.73 Favored 'General case' 0 N--CA 1.489 1.495 0 O-C-N 121.304 -0.872 . . . . 1.63 109.482 -179.779 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' C' C ' 325' ' ' GLY . . . . . . . . . . . . . . . -68.21 -168.14 4.51 Favored Glycine 0 N--CA 1.489 2.199 0 N-CA-C 109.386 -1.486 . . . . 0.73 109.386 179.773 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' C' C ' 326' ' ' GLU . . . . . . . . . . . . . 2.3 mt-10 -58.7 -172.22 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.256 -1.144 . . . . 2.17 109.555 -179.991 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' C' C ' 327' ' ' TYR . . . . . 0.485 ' OH ' ' HB3' ' C' ' 324' ' ' ASP . 37.2 m-85 -149.11 114.21 5.47 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.446 -0.784 . . . . 0.48 109.463 179.809 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' C' C ' 328' ' ' PHE . . . . . 0.497 ' CZ ' ' HB2' ' A' ' 335' ' ' ARG . 77.0 m-85 -112.56 -170.54 1.68 Allowed 'General case' 0 N--CA 1.487 1.42 0 O-C-N 121.269 -0.895 . . . . 0.33 108.951 179.677 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' C' C ' 329' ' ' THR . . . . . 0.423 HG23 ' O ' ' C' ' 328' ' ' PHE . 5.0 p -153.42 170.25 21.17 Favored 'General case' 0 C--N 1.301 -1.512 0 O-C-N 121.27 -0.894 . . . . 0.23 109.226 179.957 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' C' C ' 330' ' ' LEU . . . . . 0.462 HD21 ' HB2' ' A' ' 345' ' ' ASN . 49.5 tp -149.12 134.49 18.44 Favored 'General case' 0 C--N 1.303 -1.454 0 O-C-N 121.213 -0.929 . . . . 0.28 109.325 -179.77 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' C' C ' 331' ' ' GLN . . . . . 0.472 ' NE2' ' O ' ' A' ' 328' ' ' PHE . 57.8 tp60 -84.95 107.17 16.96 Favored 'General case' 0 N--CA 1.489 1.475 0 O-C-N 121.337 -0.852 . . . . 1.48 109.187 -179.994 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' C' C ' 332' ' ' ILE . . . . . 0.771 HG21 ' HA ' ' C' ' 338' ' ' PHE . 64.2 mt -103.05 100.39 10.31 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.505 0 O-C-N 121.162 -0.961 . . . . 0.24 109.424 -179.897 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' C' C ' 333' ' ' ARG . . . . . 0.575 ' HG2' ' CE1' ' A' ' 327' ' ' TYR . 89.2 mtt180 -72.57 159.09 34.46 Favored 'General case' 0 N--CA 1.488 1.456 0 O-C-N 121.311 -0.868 . . . . 2.74 109.289 179.725 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' C' C ' 334' ' ' GLY . . . . . . . . . . . . . . . 72.58 129.13 0.11 Allowed Glycine 0 N--CA 1.491 2.36 0 N-CA-C 109.39 -1.484 . . . . 0.35 109.39 -179.788 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' C' C ' 335' ' ' ARG . . . . . 0.482 ' HA ' ' CE1' ' A' ' 328' ' ' PHE . 10.1 ttm180 -78.08 -30.89 49.86 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.245 -1.15 . . . . 2.53 109.889 -179.769 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' C' C ' 336' ' ' GLU . . . . . . . . . . . . . 1.5 tt0 -58.95 -63.82 1.16 Allowed 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.227 -0.921 . . . . 2.62 110.087 -179.591 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' C' C ' 337' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -59.09 -26.11 64.37 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.155 -0.965 . . . . 2.81 109.802 -179.43 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' C' C ' 338' ' ' PHE . . . . . 0.771 ' HA ' HG21 ' C' ' 332' ' ' ILE . 81.3 t80 -54.78 -61.12 2.52 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.152 -0.968 . . . . 0.4 109.662 -179.944 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' C' C ' 339' ' ' GLU . . . . . . . . . . . . . 22.9 mt-10 -50.97 -31.59 18.38 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.301 -0.874 . . . . 2.05 109.995 -179.669 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' C' C ' 340' ' ' MET . . . . . . . . . . . . . 34.6 ttp -63.47 -52.85 59.6 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.173 -0.954 . . . . 0.32 109.916 -179.564 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' C' C ' 341' ' ' PHE . . . . . . . . . . . . . 48.9 m-85 -62.08 -42.26 99.02 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.153 -0.967 . . . . 0.18 109.848 -179.58 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' C' C ' 342' ' ' ARG . . . . . 0.451 HH11 ' CG ' ' C' ' 342' ' ' ARG . 0.2 OUTLIER -49.94 -45.39 51.19 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.358 -0.839 . . . . 2.91 110.177 -179.574 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' C' C ' 343' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -57.82 -48.71 78.97 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.137 -0.977 . . . . 2.14 110.025 -179.332 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' C' C ' 344' ' ' LEU . . . . . 0.637 HD22 HD22 ' D' ' 344' ' ' LEU . 32.3 mt -62.69 -31.94 72.93 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.2 -0.938 . . . . 0.22 110.132 -179.549 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' C' C ' 345' ' ' ASN . . . . . . . . . . . . . 20.4 t-20 -57.63 -58.62 7.5 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.213 -0.929 . . . . 1.08 109.57 -179.665 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' C' C ' 346' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -61.36 -26.08 67.59 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.317 -0.865 . . . . 2.21 109.669 -179.875 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' C' C ' 347' ' ' ALA . . . . . 0.772 ' HB1' ' HB1' ' D' ' 347' ' ' ALA . . . -60.42 -58.63 7.7 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.173 -0.954 . . . . 0.18 109.772 -179.984 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' C' C ' 348' ' ' LEU . . . . . 0.579 HD22 ' N ' ' C' ' 348' ' ' LEU . 4.3 mm? -62.23 -40.54 96.47 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.237 -0.915 . . . . 0.32 109.86 -179.658 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' C' C ' 349' ' ' GLU . . . . . . . . . . . . . 68.0 mm-40 -57.46 -37.09 72.31 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.186 -0.946 . . . . 2.19 109.726 -179.63 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' C' C ' 350' ' ' LEU . . . . . 0.675 HD13 HD22 ' D' ' 350' ' ' LEU . 5.3 tt -63.02 -38.79 92.62 Favored 'General case' 0 N--CA 1.489 1.481 0 O-C-N 121.109 -0.994 . . . . 0.46 109.065 179.929 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' C' C ' 351' ' ' LYS . . . . . 0.468 ' HA ' ' OE1' ' C' ' 354' ' ' GLN . 20.3 tttt -60.15 -37.12 79.15 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.351 -0.843 . . . . 1.35 109.164 179.765 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' C' C ' 352' ' ' ASP . . . . . . . . . . . . . 8.5 m-20 -56.93 -41.91 79.07 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.31 -0.869 . . . . 1.19 109.539 179.926 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' C' C ' 353' ' ' ALA . . . . . . . . . . . . . . . -67.57 -23.15 65.38 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.272 -0.892 . . . . 0.57 109.575 -179.897 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' C' C ' 354' ' ' GLN . . . . . 0.512 ' OE1' HD23 ' C' ' 350' ' ' LEU . 26.4 mt-30 -82.47 -6.78 59.51 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.193 -0.942 . . . . 1.47 109.621 -179.987 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' C' C ' 355' ' ' ALA . . . . . . . . . . . . . . . -70.66 -86.04 0.03 OUTLIER 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.225 -0.922 . . . . 0.93 109.6 179.971 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' C' C ' 356' ' ' GLY . . . . . . . . . . . . . . . -81.41 66.06 3.89 Favored Glycine 0 N--CA 1.494 2.503 0 N-CA-C 109.907 -1.277 . . . . 1.33 109.907 179.999 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' C' C ' 357' ' ' LYS . . . . . . . . . . . . . 24.0 tttt -86.23 156.26 20.36 Favored 'General case' 0 N--CA 1.488 1.431 0 O-C-N 121.145 -1.209 . . . . 4.01 109.24 179.919 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' C' C ' 358' ' ' GLU . . . . . 0.408 ' HB3' ' HD2' ' C' ' 359' ' ' PRO . 11.9 mm-40 -48.03 156.09 0.79 Allowed Pre-proline 0 N--CA 1.49 1.555 0 O-C-N 121.168 -0.957 . . . . 5.75 109.297 -179.995 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' C' C ' 359' ' ' PRO . . . . . 0.408 ' HD2' ' HB3' ' C' ' 358' ' ' GLU . 5.0 Cg_exo -59.85 174.34 1.32 Allowed 'Trans proline' 0 C--N 1.309 -1.538 0 C-N-CA 122.177 1.918 . . . . 4.94 110.316 -179.766 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' C' C ' 360' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.244 0 N-CA-C 109.556 -1.418 . . . . 6.5 109.556 -179.961 . . . . . . . . 0 0 . 1 . 021 nuclear nobuild full ' D' D ' 319' ' ' LYS . . . . . . . . . . . . . 3.9 mmtm . . . . . 0 N--CA 1.49 1.537 0 N-CA-C 109.421 -0.585 . . . . 7.53 109.421 . . . . . . . . . 0 0 . 1 . 021 nuclear nobuild full ' D' D ' 320' ' ' LYS . . . . . . . . . . . . . 5.1 tttm 60.09 96.7 0.03 OUTLIER 'General case' 0 N--CA 1.488 1.457 0 O-C-N 121.335 -0.853 . . . . 6.41 109.34 -179.936 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' D' D ' 321' ' ' LYS . . . . . 0.412 ' HB2' ' HD2' ' D' ' 322' ' ' PRO . 14.7 pttt -80.73 156.09 72.99 Favored Pre-proline 0 N--CA 1.488 1.447 0 O-C-N 121.202 -0.937 . . . . 6.11 109.303 -179.972 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' D' D ' 322' ' ' PRO . . . . . 0.412 ' HD2' ' HB2' ' D' ' 321' ' ' LYS . 5.5 Cg_exo -58.52 -157.11 0.01 OUTLIER 'Trans proline' 0 C--N 1.308 -1.571 0 C-N-CA 122.053 1.835 . . . . 2.82 110.134 179.929 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' D' D ' 323' ' ' LEU . . . . . 0.414 ' HA ' HD23 ' D' ' 323' ' ' LEU . 35.3 mt -79.37 150.62 31.34 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.181 -0.949 . . . . 2.83 109.353 179.9 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' D' D ' 324' ' ' ASP . . . . . 0.416 ' HB2' ' OH ' ' D' ' 327' ' ' TYR . 44.2 m-20 -78.5 -165.48 0.71 Allowed 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.245 -0.91 . . . . 1.54 109.475 -179.756 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' D' D ' 325' ' ' GLY . . . . . . . . . . . . . . . -69.92 -160.81 2.96 Favored Glycine 0 N--CA 1.491 2.306 0 N-CA-C 109.744 -1.342 . . . . 0.59 109.744 -179.919 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' D' D ' 326' ' ' GLU . . . . . . . . . . . . . 7.3 mt-10 -59.02 -169.29 0.01 OUTLIER 'General case' 0 N--CA 1.488 1.47 0 O-C-N 121.466 -1.02 . . . . 2.13 109.655 -179.92 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' D' D ' 327' ' ' TYR . . . . . 0.595 ' CE1' ' CG ' ' B' ' 333' ' ' ARG . 41.2 m-85 -149.96 115.52 5.53 Favored 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.354 -0.841 . . . . 0.47 109.422 -179.973 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' D' D ' 328' ' ' PHE . . . . . 0.504 ' CZ ' ' HB2' ' B' ' 335' ' ' ARG . 76.4 m-85 -113.49 -170.71 1.74 Allowed 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.317 -0.864 . . . . 0.3 109.313 179.934 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' D' D ' 329' ' ' THR . . . . . 0.49 ' HA ' ' O ' ' B' ' 330' ' ' LEU . 26.9 p -153.74 167.79 28.44 Favored 'General case' 0 N--CA 1.489 1.499 0 O-C-N 121.221 -0.924 . . . . 0.22 109.428 179.986 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' D' D ' 330' ' ' LEU . . . . . 0.482 ' O ' ' HA ' ' B' ' 329' ' ' THR . 14.7 tp -148.95 126.12 11.41 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.193 -0.942 . . . . 0.28 109.478 -179.946 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' D' D ' 331' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -86.28 111.52 20.52 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.218 -0.926 . . . . 0.93 109.55 -179.976 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' D' D ' 332' ' ' ILE . . . . . . . . . . . . . 31.8 mt -103.6 110.54 30.29 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.532 0 O-C-N 121.176 -0.953 . . . . 0.25 109.573 179.827 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' D' D ' 333' ' ' ARG . . . . . 0.534 ' CG ' ' CE1' ' B' ' 327' ' ' TYR . 2.4 mpt_? -72.69 143.22 48.16 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.313 -0.867 . . . . 2.93 109.239 179.847 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' D' D ' 334' ' ' GLY . . . . . . . . . . . . . . . 84.21 129.91 1.86 Allowed Glycine 0 N--CA 1.49 2.274 0 N-CA-C 109.539 -1.425 . . . . 0.41 109.539 -179.856 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' D' D ' 335' ' ' ARG . . . . . 0.482 ' HB2' ' CZ ' ' B' ' 328' ' ' PHE . 6.1 ttm180 -78.79 -28.65 44.63 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.193 -1.18 . . . . 3.03 109.6 -179.949 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' D' D ' 336' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -56.53 -67.17 0.33 Allowed 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.201 -0.937 . . . . 2.26 109.881 -179.779 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' D' D ' 337' ' ' ARG . . . . . 0.442 HH11 ' HG2' ' D' ' 337' ' ' ARG . 0.8 OUTLIER -60.53 -25.79 66.39 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.216 -0.927 . . . . 2.92 109.651 -179.669 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' D' D ' 338' ' ' PHE . . . . . 0.433 ' HB3' ' O ' ' D' ' 335' ' ' ARG . 67.8 t80 -55.47 -60.53 3.29 Favored 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.124 -0.985 . . . . 0.37 109.628 -179.968 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' D' D ' 339' ' ' GLU . . . . . . . . . . . . . 77.2 mt-10 -51.35 -31.84 23.51 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.305 -0.872 . . . . 1.99 109.998 -179.725 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' D' D ' 340' ' ' MET . . . . . . . . . . . . . 9.4 ttp -63.25 -52.65 61.24 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.132 -0.98 . . . . 0.31 109.959 -179.604 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' D' D ' 341' ' ' PHE . . . . . . . . . . . . . 48.6 m-85 -61.57 -41.86 98.01 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.183 -0.948 . . . . 0.18 109.786 -179.633 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' D' D ' 342' ' ' ARG . . . . . 0.48 ' NH1' ' HG2' ' D' ' 342' ' ' ARG . 0.0 OUTLIER -50.72 -41.96 56.76 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.241 -0.912 . . . . 2.41 109.845 -179.809 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' D' D ' 343' ' ' GLU . . . . . . . . . . . . . 28.3 tt0 -59.54 -50.56 73.44 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.258 -0.901 . . . . 2.35 110.251 -179.478 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' D' D ' 344' ' ' LEU . . . . . 0.637 HD22 HD22 ' C' ' 344' ' ' LEU . 40.3 mt -61.47 -29.85 70.22 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.143 -0.973 . . . . 0.19 109.834 -179.463 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' D' D ' 345' ' ' ASN . . . . . 0.417 ' O ' ' HG3' ' D' ' 349' ' ' GLU . 29.3 t-20 -57.59 -57.02 14.53 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.173 -0.954 . . . . 1.09 110.002 -179.659 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' D' D ' 346' ' ' GLU . . . . . . . . . . . . . 70.6 tt0 -61.47 -29.56 70.04 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.182 -0.949 . . . . 1.69 110.203 -179.427 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' D' D ' 347' ' ' ALA . . . . . 0.772 ' HB1' ' HB1' ' C' ' 347' ' ' ALA . . . -60.07 -55.69 30.89 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.059 -1.026 . . . . 0.18 110.096 -179.562 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' D' D ' 348' ' ' LEU . . . . . 0.578 HD22 ' N ' ' D' ' 348' ' ' LEU . 4.2 mm? -62.07 -44.43 96.69 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.234 -0.916 . . . . 0.31 110.074 -179.409 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' D' D ' 349' ' ' GLU . . . . . 0.417 ' HG3' ' O ' ' D' ' 345' ' ' ASN . 56.9 mt-10 -57.64 -35.65 70.79 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.209 -0.932 . . . . 1.95 109.953 -179.479 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' D' D ' 350' ' ' LEU . . . . . 0.675 HD22 HD13 ' C' ' 350' ' ' LEU . 6.1 tt -64.49 -40.07 94.98 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.211 -0.93 . . . . 0.43 109.736 -179.847 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' D' D ' 351' ' ' LYS . . . . . . . . . . . . . 2.3 ttmt -58.02 -56.35 23.2 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.282 -0.886 . . . . 1.4 109.829 -179.633 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' D' D ' 352' ' ' ASP . . . . . . . . . . . . . 11.9 m-20 -56.97 -37.33 71.42 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.145 -0.972 . . . . 1.17 109.773 -179.769 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' D' D ' 353' ' ' ALA . . . . . . . . . . . . . . . -67.4 -26.26 66.35 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.226 -0.921 . . . . 0.59 110.065 -179.493 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' D' D ' 354' ' ' GLN . . . . . 0.591 ' NE2' HD11 ' C' ' 350' ' ' LEU . 0.1 OUTLIER -83.73 -12.54 55.67 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.042 -1.036 . . . . 1.44 109.915 -179.723 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' D' D ' 355' ' ' ALA . . . . . . . . . . . . . . . -73.1 -22.08 60.64 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.035 -1.04 . . . . 0.98 109.363 179.751 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' D' D ' 356' ' ' GLY . . . . . . . . . . . . . . . -81.6 17.0 16.33 Favored Glycine 0 N--CA 1.491 2.341 0 N-CA-C 110.275 -1.13 . . . . 1.28 110.275 -179.959 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' D' D ' 357' ' ' LYS . . . . . . . . . . . . . 41.0 tttt -85.52 111.7 20.25 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 120.941 -1.329 . . . . 4.09 109.653 -179.675 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' D' D ' 358' ' ' GLU . . . . . . . . . . . . . 5.2 mt-10 -48.66 112.93 2.62 Favored Pre-proline 0 N--CA 1.49 1.528 0 O-C-N 121.249 -0.907 . . . . 5.71 109.347 179.826 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' D' D ' 359' ' ' PRO . . . . . . . . . . . . . 2.3 Cg_endo -61.56 137.66 70.64 Favored 'Trans proline' 0 C--N 1.312 -1.378 0 C-N-CA 121.996 1.797 . . . . 4.97 110.25 -179.88 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' D' D ' 360' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.334 0 CA-C-O 117.963 -1.465 . . . . 6.97 109.562 -179.972 . . . . . . . . 0 0 . 1 . 022 nuclear nobuild full ' A' A ' 319' ' ' LYS . . . . . . . . . . . . . 1.2 mtpt . . . . . 0 N--CA 1.49 1.541 0 CA-C-O 121.234 0.54 . . . . 7.55 109.572 . . . . . . . . . 0 0 . 1 . 022 nuclear nobuild full ' A' A ' 320' ' ' LYS . . . . . 0.446 ' O ' ' HG2' ' A' ' 321' ' ' LYS . 4.6 mttm 62.96 168.15 0.13 Allowed 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.357 -0.839 . . . . 6.43 109.811 179.838 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 321' ' ' LYS . . . . . 0.446 ' HG2' ' O ' ' A' ' 320' ' ' LYS . 26.2 mtmt -156.78 91.52 2.49 Favored Pre-proline 0 N--CA 1.491 1.584 0 O-C-N 121.407 -0.808 . . . . 6.13 109.125 179.779 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 322' ' ' PRO . . . . . . . . . . . . . 2.1 Cg_endo -68.13 -1.05 6.41 Favored 'Trans proline' 0 C--N 1.31 -1.487 0 C-N-CA 122.243 1.962 . . . . 2.83 110.954 -179.628 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 323' ' ' LEU . . . . . . . . . . . . . 25.7 mt -80.79 90.69 5.86 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 120.787 -1.195 . . . . 2.83 109.424 179.997 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 324' ' ' ASP . . . . . . . . . . . . . 14.3 m-20 -84.29 -154.8 0.17 Allowed 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.244 -0.91 . . . . 1.53 109.485 179.922 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 325' ' ' GLY . . . . . . . . . . . . . . . -69.85 -161.46 3.17 Favored Glycine 0 N--CA 1.491 2.354 0 N-CA-C 109.709 -1.356 . . . . 0.61 109.709 179.887 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 326' ' ' GLU . . . . . . . . . . . . . 7.1 mt-10 -59.18 -170.32 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.246 -1.149 . . . . 2.13 109.404 179.963 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 327' ' ' TYR . . . . . 0.611 ' CE1' ' HG2' ' C' ' 333' ' ' ARG . 45.4 m-85 -149.85 112.28 4.71 Favored 'General case' 0 N--CA 1.489 1.491 0 O-C-N 121.249 -0.907 . . . . 0.48 109.838 -179.997 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 328' ' ' PHE . . . . . 0.409 ' C ' HG23 ' A' ' 329' ' ' THR . 75.5 m-85 -113.71 -173.85 2.35 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.341 -0.85 . . . . 0.31 109.171 179.709 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 329' ' ' THR . . . . . 0.409 HG23 ' C ' ' A' ' 328' ' ' PHE . 73.2 p -153.38 164.21 38.56 Favored 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.184 -0.948 . . . . 0.22 109.268 -179.891 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 330' ' ' LEU . . . . . . . . . . . . . 15.4 tp -149.74 125.93 10.7 Favored 'General case' 0 N--CA 1.488 1.46 0 O-C-N 121.207 -0.933 . . . . 0.28 109.666 -179.853 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 331' ' ' GLN . . . . . . . . . . . . . 1.6 tt0 -87.4 114.44 24.01 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.302 -0.874 . . . . 0.91 109.321 179.817 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 332' ' ' ILE . . . . . 0.484 HG21 ' HA ' ' A' ' 338' ' ' PHE . 57.9 mt -103.37 104.42 16.62 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.592 0 O-C-N 121.261 -0.9 . . . . 0.26 109.739 -179.867 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 333' ' ' ARG . . . . . . . . . . . . . 9.9 mtm180 -72.05 139.17 48.36 Favored 'General case' 0 N--CA 1.488 1.456 0 O-C-N 121.322 -0.861 . . . . 2.92 109.246 179.64 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 334' ' ' GLY . . . . . . . . . . . . . . . 92.89 131.53 5.77 Favored Glycine 0 N--CA 1.49 2.298 0 N-CA-C 109.407 -1.477 . . . . 0.4 109.407 -179.789 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 335' ' ' ARG . . . . . . . . . . . . . 2.0 ttt180 -78.21 -32.92 50.19 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.303 -1.116 . . . . 3.01 109.488 -179.855 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 336' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -58.17 -61.5 2.52 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.133 -0.979 . . . . 2.29 109.696 -179.895 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 337' ' ' ARG . . . . . . . . . . . . . 5.3 mtt180 -60.45 -34.56 74.18 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.173 -0.955 . . . . 2.93 109.705 -179.889 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 338' ' ' PHE . . . . . 0.484 ' HA ' HG21 ' A' ' 332' ' ' ILE . 78.8 t80 -54.05 -60.45 3.32 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.222 -0.924 . . . . 0.38 109.631 -179.704 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 339' ' ' GLU . . . . . . . . . . . . . 95.7 mt-10 -50.89 -33.88 25.94 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.216 -0.928 . . . . 1.97 109.999 -179.615 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 340' ' ' MET . . . . . . . . . . . . . 32.2 ttp -64.01 -50.98 66.36 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.068 -1.02 . . . . 0.31 110.063 -179.635 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 341' ' ' PHE . . . . . . . . . . . . . 37.1 m-85 -61.57 -47.56 84.94 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.128 -0.983 . . . . 0.18 109.78 -179.497 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 342' ' ' ARG . . . . . . . . . . . . . 1.4 ttt180 -49.46 -39.4 33.3 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.173 -0.954 . . . . 2.42 109.598 -179.913 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 343' ' ' GLU . . . . . . . . . . . . . 2.7 tt0 -58.51 -49.47 77.28 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.14 -0.975 . . . . 2.35 109.437 -179.95 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 344' ' ' LEU . . . . . 0.722 HD22 ' CD2' ' B' ' 344' ' ' LEU . 73.9 mt -62.3 -29.7 70.62 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.278 -0.889 . . . . 0.18 109.334 179.824 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 345' ' ' ASN . . . . . . . . . . . . . 11.2 t-20 -57.77 -54.17 49.92 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.323 -0.861 . . . . 1.09 109.581 179.907 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 346' ' ' GLU . . . . . . . . . . . . . 1.2 tp10 -62.13 -28.68 69.81 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.279 -0.888 . . . . 1.65 109.785 -179.768 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 347' ' ' ALA . . . . . 1.08 ' HB1' ' HB1' ' B' ' 347' ' ' ALA . . . -61.76 -62.2 1.97 Allowed 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.116 -0.99 . . . . 0.18 110.032 -179.632 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 348' ' ' LEU . . . . . 0.546 HD22 ' N ' ' A' ' 348' ' ' LEU . 3.9 mm? -61.36 -44.61 96.87 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.259 -0.901 . . . . 0.3 110.112 -179.369 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 349' ' ' GLU . . . . . . . . . . . . . 3.1 mt-10 -56.9 -35.77 69.36 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.188 -0.945 . . . . 1.94 109.83 -179.388 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 350' ' ' LEU . . . . . 0.698 HD13 HD22 ' B' ' 350' ' ' LEU . 5.9 tt -64.93 -45.67 84.84 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.243 -0.91 . . . . 0.46 109.669 -179.962 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 351' ' ' LYS . . . . . . . . . . . . . 22.0 tttt -59.06 -41.21 87.39 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.246 -0.909 . . . . 1.4 109.303 -179.983 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 352' ' ' ASP . . . . . . . . . . . . . 11.9 m-20 -56.39 -50.22 72.22 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.33 -0.856 . . . . 1.16 109.494 179.855 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 353' ' ' ALA . . . . . . . . . . . . . . . -68.63 -15.8 63.64 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.375 -0.828 . . . . 0.63 109.566 179.987 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 354' ' ' GLN . . . . . 0.479 ' NE2' HD11 ' B' ' 350' ' ' LEU . 0.0 OUTLIER -82.75 -7.02 59.68 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.21 -0.931 . . . . 1.47 109.58 -179.968 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 355' ' ' ALA . . . . . . . . . . . . . . . -70.53 -5.0 25.79 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.215 -0.928 . . . . 1.01 109.623 179.957 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 356' ' ' GLY . . . . . . . . . . . . . . . -75.25 -83.07 0.42 Allowed Glycine 0 N--CA 1.49 2.262 0 N-CA-C 109.379 -1.488 . . . . 1.3 109.379 179.793 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 357' ' ' LYS . . . . . . . . . . . . . 2.4 tttt -86.54 136.47 33.06 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.254 -1.145 . . . . 4.1 109.182 179.832 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 358' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -49.06 159.87 0.55 Allowed Pre-proline 0 N--CA 1.489 1.497 0 O-C-N 121.177 -0.952 . . . . 5.75 109.429 -179.859 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 359' ' ' PRO . . . . . . . . . . . . . 2.5 Cg_endo -61.56 150.33 85.86 Favored 'Trans proline' 0 C--N 1.309 -1.519 0 C-N-CA 122.301 2.001 . . . . 5.0 110.149 179.941 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 360' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.298 0 CA-C-O 117.945 -1.475 . . . . 6.97 109.572 -179.926 . . . . . . . . 0 0 . 1 . 022 nuclear nobuild full ' B' B ' 319' ' ' LYS . . . . . . . . . . . . . 1.3 mtpt . . . . . 0 N--CA 1.49 1.532 0 CA-C-O 121.279 0.562 . . . . 7.55 109.509 . . . . . . . . . 0 0 . 1 . 022 nuclear nobuild full ' B' B ' 320' ' ' LYS . . . . . 0.451 ' O ' ' HG2' ' B' ' 321' ' ' LYS . 4.7 mttm 63.22 168.52 0.14 Allowed 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.392 -0.818 . . . . 6.44 109.831 179.854 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' B' B ' 321' ' ' LYS . . . . . 0.451 ' HG2' ' O ' ' B' ' 320' ' ' LYS . 27.1 mtmt -157.05 91.1 2.45 Favored Pre-proline 0 N--CA 1.491 1.582 0 O-C-N 121.38 -0.825 . . . . 6.13 109.209 179.91 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' B' B ' 322' ' ' PRO . . . . . . . . . . . . . 2.3 Cg_endo -68.03 -0.93 6.16 Favored 'Trans proline' 0 C--N 1.309 -1.544 0 C-N-CA 122.267 1.978 . . . . 2.82 111.018 -179.609 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 323' ' ' LEU . . . . . . . . . . . . . 25.8 mt -80.93 90.41 5.93 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 120.817 -1.177 . . . . 2.84 109.535 179.9 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 324' ' ' ASP . . . . . . . . . . . . . 13.0 m-20 -84.11 -154.14 0.16 Allowed 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.235 -0.916 . . . . 1.53 109.68 179.849 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 325' ' ' GLY . . . . . . . . . . . . . . . -70.59 -161.44 3.79 Favored Glycine 0 N--CA 1.49 2.272 0 N-CA-C 109.596 -1.402 . . . . 0.59 109.596 -179.92 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 326' ' ' GLU . . . . . . . . . . . . . 7.2 mt-10 -58.92 -170.44 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.287 -1.125 . . . . 2.13 109.536 179.983 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 327' ' ' TYR . . . . . . . . . . . . . 44.2 m-85 -149.76 112.26 4.73 Favored 'General case' 0 N--CA 1.489 1.493 0 O-C-N 121.272 -0.893 . . . . 0.48 109.732 -179.97 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 328' ' ' PHE . . . . . 0.481 ' HB2' ' CD1' ' D' ' 338' ' ' PHE . 75.8 m-85 -113.74 -173.72 2.33 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.323 -0.861 . . . . 0.32 109.146 179.676 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' B' B ' 329' ' ' THR . . . . . 0.42 HG23 ' C ' ' B' ' 328' ' ' PHE . 71.6 p -153.47 164.51 38.07 Favored 'General case' 0 N--CA 1.488 1.429 0 O-C-N 121.272 -0.892 . . . . 0.23 109.363 179.921 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' B' B ' 330' ' ' LEU . . . . . . . . . . . . . 15.8 tp -149.89 126.47 10.93 Favored 'General case' 0 C--N 1.302 -1.457 0 O-C-N 121.215 -0.928 . . . . 0.28 109.556 -179.842 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 331' ' ' GLN . . . . . . . . . . . . . 1.6 tt0 -87.85 114.6 24.62 Favored 'General case' 0 N--CA 1.489 1.493 0 O-C-N 121.258 -0.901 . . . . 0.91 109.276 179.829 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 332' ' ' ILE . . . . . 0.498 HG21 ' HA ' ' B' ' 338' ' ' PHE . 57.8 mt -103.41 104.59 16.9 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.493 0 O-C-N 121.217 -0.927 . . . . 0.24 109.709 -179.878 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' B' B ' 333' ' ' ARG . . . . . . . . . . . . . 10.3 mtm180 -72.25 139.06 47.9 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.237 -0.914 . . . . 2.93 109.12 179.717 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 334' ' ' GLY . . . . . . . . . . . . . . . 92.94 131.94 5.93 Favored Glycine 0 N--CA 1.491 2.326 0 N-CA-C 109.392 -1.483 . . . . 0.4 109.392 -179.776 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 335' ' ' ARG . . . . . 0.454 ' HA ' ' CE1' ' D' ' 328' ' ' PHE . 2.0 ttt180 -78.53 -32.93 48.21 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.209 -1.171 . . . . 3.01 109.587 -179.855 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' B' B ' 336' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -58.08 -61.75 2.32 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.235 -0.916 . . . . 2.28 109.633 -179.983 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' B' B ' 337' ' ' ARG . . . . . . . . . . . . . 5.0 mtt180 -60.2 -34.79 74.11 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.242 -0.911 . . . . 2.93 109.695 -179.756 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 338' ' ' PHE . . . . . 0.524 ' CD1' ' HB2' ' D' ' 328' ' ' PHE . 79.9 t80 -53.87 -60.55 3.18 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.319 -0.863 . . . . 0.37 109.763 -179.833 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' B' B ' 339' ' ' GLU . . . . . . . . . . . . . 95.0 mt-10 -50.94 -33.76 25.8 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.233 -0.917 . . . . 1.98 110.114 -179.632 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 340' ' ' MET . . . . . . . . . . . . . 32.7 ttp -64.34 -50.44 67.77 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.101 -0.999 . . . . 0.32 109.975 -179.607 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 341' ' ' PHE . . . . . . . . . . . . . 37.4 m-85 -61.87 -47.2 86.06 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.174 -0.954 . . . . 0.18 110.0 -179.69 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 342' ' ' ARG . . . . . . . . . . . . . 1.5 ttt180 -49.84 -39.3 38.53 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.155 -0.966 . . . . 2.42 109.605 179.947 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 343' ' ' GLU . . . . . . . . . . . . . 2.7 tt0 -58.52 -49.68 76.49 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.292 -0.88 . . . . 2.35 109.352 -179.991 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 344' ' ' LEU . . . . . 0.722 ' CD2' HD22 ' A' ' 344' ' ' LEU . 74.6 mt -62.25 -29.59 70.51 Favored 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.298 -0.876 . . . . 0.18 109.295 179.884 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' B' B ' 345' ' ' ASN . . . . . . . . . . . . . 11.4 t-20 -57.96 -54.07 51.04 Favored 'General case' 0 N--CA 1.488 1.472 0 O-C-N 121.283 -0.886 . . . . 1.09 109.462 -179.946 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 346' ' ' GLU . . . . . . . . . . . . . 1.2 tp10 -62.15 -28.93 69.99 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.287 -0.883 . . . . 1.66 109.765 -179.75 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 347' ' ' ALA . . . . . 1.08 ' HB1' ' HB1' ' A' ' 347' ' ' ALA . . . -61.76 -61.85 2.21 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.191 -0.943 . . . . 0.17 110.209 -179.625 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' B' B ' 348' ' ' LEU . . . . . 0.555 HD22 ' N ' ' B' ' 348' ' ' LEU . 3.9 mm? -61.66 -44.56 96.73 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.151 -0.968 . . . . 0.29 110.074 -179.445 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' B' B ' 349' ' ' GLU . . . . . . . . . . . . . 3.1 mt-10 -56.7 -35.98 69.13 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.167 -0.958 . . . . 1.95 109.848 -179.444 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 350' ' ' LEU . . . . . 0.698 HD22 HD13 ' A' ' 350' ' ' LEU . 6.0 tt -64.72 -45.78 85.08 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.177 -0.952 . . . . 0.45 109.596 -179.946 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' B' B ' 351' ' ' LYS . . . . . . . . . . . . . 22.1 tttt -58.93 -41.21 86.81 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.365 -0.834 . . . . 1.38 109.283 -179.922 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 352' ' ' ASP . . . . . . . . . . . . . 12.1 m-20 -56.28 -50.45 71.34 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.31 -0.869 . . . . 1.16 109.422 179.862 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 353' ' ' ALA . . . . . . . . . . . . . . . -68.68 -15.63 63.58 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.287 -0.883 . . . . 0.61 109.501 -179.909 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 354' ' ' GLN . . . . . 0.43 ' NE2' HD11 ' A' ' 350' ' ' LEU . 0.0 OUTLIER -82.91 -6.95 59.68 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.193 -0.942 . . . . 1.45 109.561 -179.957 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' B' B ' 355' ' ' ALA . . . . . . . . . . . . . . . -70.68 -4.88 25.8 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.223 -0.923 . . . . 0.98 109.629 -179.923 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 356' ' ' GLY . . . . . . . . . . . . . . . -75.41 -82.98 0.44 Allowed Glycine 0 N--CA 1.49 2.291 0 N-CA-C 109.386 -1.486 . . . . 1.29 109.386 179.86 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 357' ' ' LYS . . . . . . . . . . . . . 2.3 tttt -86.66 135.96 33.21 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.275 -1.133 . . . . 4.09 109.209 179.751 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 358' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -48.8 159.72 0.53 Allowed Pre-proline 0 N--CA 1.489 1.514 0 O-C-N 121.211 -0.931 . . . . 5.72 109.555 -179.829 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' B' B ' 359' ' ' PRO . . . . . . . . . . . . . 2.5 Cg_endo -61.5 150.41 85.36 Favored 'Trans proline' 0 C--N 1.31 -1.495 0 C-N-CA 122.192 1.928 . . . . 4.98 110.219 179.851 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 360' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.276 0 CA-C-O 118.015 -1.436 . . . . 6.98 109.563 -179.992 . . . . . . . . 0 0 . 1 . 022 nuclear nobuild full ' C' C ' 319' ' ' LYS . . . . . . . . . . . . . 2.5 ttmt . . . . . 0 N--CA 1.491 1.616 0 N-CA-C 109.407 -0.59 . . . . 6.82 109.407 . . . . . . . . . 0 0 . 1 . 022 nuclear nobuild full ' C' C ' 320' ' ' LYS . . . . . 0.45 ' O ' ' HG3' ' C' ' 321' ' ' LYS . 0.0 OUTLIER 68.75 -162.85 0.19 Allowed 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.254 -0.904 . . . . 6.49 109.596 -179.939 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' C' C ' 321' ' ' LYS . . . . . 0.45 ' HG3' ' O ' ' C' ' 320' ' ' LYS . 4.5 mttt -157.11 158.78 31.27 Favored Pre-proline 0 N--CA 1.491 1.581 0 O-C-N 121.287 -0.883 . . . . 6.4 109.49 -179.809 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' C' C ' 322' ' ' PRO . . . . . . . . . . . . . 2.7 Cg_endo -60.86 171.05 3.98 Favored 'Trans proline' 0 C--N 1.309 -1.501 0 C-N-CA 122.273 1.982 . . . . 3.42 110.306 179.812 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' C' C ' 323' ' ' LEU . . . . . . . . . . . . . 56.2 mt -80.61 149.51 29.84 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.248 -0.908 . . . . 3.95 109.605 179.909 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' C' C ' 324' ' ' ASP . . . . . . . . . . . . . 8.7 m-20 -78.67 165.9 23.12 Favored 'General case' 0 N--CA 1.489 1.494 0 O-C-N 121.243 -0.911 . . . . 1.63 108.897 179.607 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' C' C ' 325' ' ' GLY . . . . . . . . . . . . . . . -66.86 167.7 37.88 Favored Glycine 0 N--CA 1.49 2.245 0 N-CA-C 109.53 -1.428 . . . . 0.73 109.53 -179.808 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' C' C ' 326' ' ' GLU . . . . . . . . . . . . . 3.6 mp0 -58.11 -169.39 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.297 -1.12 . . . . 2.17 109.355 -179.899 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' C' C ' 327' ' ' TYR . . . . . . . . . . . . . 38.4 m-85 -150.18 105.56 3.38 Favored 'General case' 0 N--CA 1.488 1.451 0 O-C-N 121.234 -0.916 . . . . 0.48 110.085 179.922 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' C' C ' 328' ' ' PHE . . . . . 0.42 ' HB3' ' CE1' ' A' ' 338' ' ' PHE . 87.8 m-85 -113.97 -174.42 2.47 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.455 -0.778 . . . . 0.33 108.94 179.531 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' C' C ' 329' ' ' THR . . . . . . . . . . . . . 19.8 p -151.55 164.41 36.89 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.108 -0.995 . . . . 0.23 109.466 -179.942 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' C' C ' 330' ' ' LEU . . . . . . . . . . . . . 15.1 tp -150.86 130.52 13.12 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.151 -0.968 . . . . 0.28 109.824 -179.742 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' C' C ' 331' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -88.51 112.48 23.05 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.342 -0.849 . . . . 1.48 109.394 179.691 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' C' C ' 332' ' ' ILE . . . . . 0.415 HD13 ' CD2' ' C' ' 341' ' ' PHE . 64.5 mt -103.68 102.81 14.22 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.653 0 O-C-N 121.138 -0.976 . . . . 0.24 109.994 -179.83 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' C' C ' 333' ' ' ARG . . . . . 0.611 ' HG2' ' CE1' ' A' ' 327' ' ' TYR . 2.4 mtp180 -72.69 156.32 39.07 Favored 'General case' 0 N--CA 1.488 1.47 0 O-C-N 121.262 -0.899 . . . . 2.74 109.201 179.518 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' C' C ' 334' ' ' GLY . . . . . . . . . . . . . . . 80.06 128.92 0.75 Allowed Glycine 0 N--CA 1.491 2.329 0 N-CA-C 109.66 -1.376 . . . . 0.35 109.66 179.856 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' C' C ' 335' ' ' ARG . . . . . . . . . . . . . 20.8 ttt180 -79.28 -33.03 43.76 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.401 -1.058 . . . . 2.53 109.508 -179.999 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' C' C ' 336' ' ' GLU . . . . . 0.469 ' HA ' ' OE1' ' C' ' 339' ' ' GLU . 0.0 OUTLIER -58.08 -62.05 2.1 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.189 -0.944 . . . . 2.62 109.773 -179.781 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' C' C ' 337' ' ' ARG . . . . . 0.551 ' HG2' ' NH1' ' C' ' 337' ' ' ARG . 0.1 OUTLIER -59.85 -30.88 69.26 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.235 -0.916 . . . . 2.81 109.843 -179.672 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' C' C ' 338' ' ' PHE . . . . . . . . . . . . . 72.4 t80 -55.53 -54.87 38.59 Favored 'General case' 0 N--CA 1.488 1.457 0 O-C-N 121.158 -0.963 . . . . 0.4 109.681 -179.911 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' C' C ' 339' ' ' GLU . . . . . 0.469 ' OE1' ' HA ' ' C' ' 336' ' ' GLU . 3.0 mt-10 -52.58 -39.24 61.37 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.204 -0.935 . . . . 2.05 110.325 -179.582 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' C' C ' 340' ' ' MET . . . . . . . . . . . . . 36.3 ttp -62.35 -46.25 89.53 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.157 -0.965 . . . . 0.32 110.0 -179.334 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' C' C ' 341' ' ' PHE . . . . . 0.415 ' CD2' HD13 ' C' ' 332' ' ' ILE . 32.7 m-85 -63.14 -43.22 98.95 Favored 'General case' 0 N--CA 1.489 1.5 0 O-C-N 121.174 -0.954 . . . . 0.18 110.021 -179.609 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' C' C ' 342' ' ' ARG . . . . . . . . . . . . . 39.7 ttt180 -51.96 -42.92 63.26 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.216 -0.927 . . . . 2.91 110.028 -179.773 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' C' C ' 343' ' ' GLU . . . . . . . . . . . . . 2.5 tt0 -57.32 -48.27 79.4 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.145 -0.972 . . . . 2.14 109.461 -179.649 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' C' C ' 344' ' ' LEU . . . . . 0.471 ' CD2' HD22 ' D' ' 344' ' ' LEU . 37.0 mt -62.96 -30.55 71.66 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.205 -0.935 . . . . 0.22 109.357 179.866 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' C' C ' 345' ' ' ASN . . . . . 0.444 ' O ' ' HG3' ' C' ' 349' ' ' GLU . 18.1 t-20 -59.07 -61.35 2.7 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.311 -0.868 . . . . 1.08 109.687 -179.829 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' C' C ' 346' ' ' GLU . . . . . . . . . . . . . 17.0 tp10 -61.22 -25.69 67.23 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.317 -0.864 . . . . 2.21 109.866 -179.608 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' C' C ' 347' ' ' ALA . . . . . 0.982 ' HB1' ' HB1' ' D' ' 347' ' ' ALA . . . -61.39 -58.34 8.6 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.215 -0.928 . . . . 0.18 109.987 -179.697 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' C' C ' 348' ' ' LEU . . . . . 0.535 HD22 ' N ' ' C' ' 348' ' ' LEU . 3.8 mm? -62.4 -44.39 96.56 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.208 -0.932 . . . . 0.32 110.147 -179.288 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' C' C ' 349' ' ' GLU . . . . . 0.444 ' HG3' ' O ' ' C' ' 345' ' ' ASN . 22.0 mt-10 -56.08 -38.6 70.91 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.141 -0.974 . . . . 2.19 109.887 -179.32 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' C' C ' 350' ' ' LEU . . . . . 0.689 HD22 HD13 ' D' ' 350' ' ' LEU . 6.1 tt -62.78 -40.37 97.11 Favored 'General case' 0 N--CA 1.489 1.493 0 O-C-N 121.156 -0.965 . . . . 0.46 109.537 -179.739 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' C' C ' 351' ' ' LYS . . . . . 0.511 ' HA ' ' OE1' ' C' ' 354' ' ' GLN . 11.3 tttt -60.19 -39.98 88.4 Favored 'General case' 0 N--CA 1.489 1.482 0 O-C-N 121.235 -0.915 . . . . 1.35 109.585 179.999 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' C' C ' 352' ' ' ASP . . . . . 0.456 ' OD1' ' N ' ' C' ' 352' ' ' ASP . 4.6 m-20 -59.25 -42.36 90.95 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.249 -0.907 . . . . 1.19 109.763 -179.99 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' C' C ' 353' ' ' ALA . . . . . . . . . . . . . . . -67.82 -14.78 63.23 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.251 -0.906 . . . . 0.57 110.081 -179.358 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' C' C ' 354' ' ' GLN . . . . . 0.541 ' OE1' ' CD1' ' D' ' 350' ' ' LEU . 36.6 mt-30 -82.37 -16.32 49.58 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.004 -1.06 . . . . 1.47 109.436 -179.943 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' C' C ' 355' ' ' ALA . . . . . . . . . . . . . . . -74.1 -3.04 27.12 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.232 -0.917 . . . . 0.93 109.803 179.628 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' C' C ' 356' ' ' GLY . . . . . . . . . . . . . . . -78.16 -43.46 13.41 Favored Glycine 0 N--CA 1.491 2.361 0 N-CA-C 109.901 -1.28 . . . . 1.33 109.901 -179.639 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' C' C ' 357' ' ' LYS . . . . . 0.404 ' O ' ' HG3' ' C' ' 357' ' ' LYS . 23.0 pttt -85.45 128.07 34.61 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.12 -1.224 . . . . 4.01 109.273 -179.963 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' C' C ' 358' ' ' GLU . . . . . 0.434 ' OE2' ' HA3' ' C' ' 360' ' ' GLY . 0.2 OUTLIER -47.04 155.79 0.61 Allowed Pre-proline 0 N--CA 1.489 1.509 0 O-C-N 121.214 -0.928 . . . . 5.75 109.464 -179.775 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' C' C ' 359' ' ' PRO . . . . . . . . . . . . . 6.0 Cg_exo -58.01 86.33 0.05 OUTLIER 'Trans proline' 0 C--N 1.31 -1.488 0 C-N-CA 122.169 1.913 . . . . 4.94 110.336 -179.927 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' C' C ' 360' ' ' GLY . . . . . 0.434 ' HA3' ' OE2' ' C' ' 358' ' ' GLU . . . . . . . . 0 N--CA 1.49 2.287 0 N-CA-C 109.433 -1.467 . . . . 6.5 109.433 -179.964 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' D' D ' 319' ' ' LYS . . . . . . . . . . . . . 1.4 mtpt . . . . . 0 N--CA 1.491 1.576 0 CA-C-O 121.298 0.57 . . . . 7.53 109.517 . . . . . . . . . 0 0 . 1 . 022 nuclear nobuild full ' D' D ' 320' ' ' LYS . . . . . 0.441 ' O ' ' CG ' ' D' ' 321' ' ' LYS . 4.6 mttm 63.39 168.15 0.14 Allowed 'General case' 0 N--CA 1.489 1.492 0 O-C-N 121.333 -0.855 . . . . 6.41 109.878 179.894 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' D' D ' 321' ' ' LYS . . . . . 0.441 ' CG ' ' O ' ' D' ' 320' ' ' LYS . 27.3 mtmt -156.79 91.37 2.5 Favored Pre-proline 0 N--CA 1.491 1.593 0 O-C-N 121.486 -0.759 . . . . 6.11 109.212 179.897 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' D' D ' 322' ' ' PRO . . . . . . . . . . . . . 2.2 Cg_endo -68.14 -1.25 6.78 Favored 'Trans proline' 0 C--N 1.31 -1.478 0 C-N-CA 122.227 1.951 . . . . 2.82 111.037 -179.73 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' D' D ' 323' ' ' LEU . . . . . . . . . . . . . 27.3 mt -80.67 90.4 5.77 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 120.928 -1.107 . . . . 2.83 109.503 179.945 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' D' D ' 324' ' ' ASP . . . . . . . . . . . . . 13.8 m-20 -84.09 -154.23 0.16 Allowed 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.274 -0.891 . . . . 1.54 109.601 179.891 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' D' D ' 325' ' ' GLY . . . . . . . . . . . . . . . -70.24 -161.33 3.44 Favored Glycine 0 N--CA 1.49 2.281 0 N-CA-C 109.693 -1.363 . . . . 0.59 109.693 179.942 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' D' D ' 326' ' ' GLU . . . . . . . . . . . . . 6.9 mt-10 -59.38 -170.3 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.339 -1.094 . . . . 2.13 109.485 179.919 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' D' D ' 327' ' ' TYR . . . . . . . . . . . . . 44.5 m-85 -150.0 112.45 4.71 Favored 'General case' 0 N--CA 1.489 1.485 0 O-C-N 121.23 -0.919 . . . . 0.47 109.737 -179.935 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' D' D ' 328' ' ' PHE . . . . . 0.524 ' HB2' ' CD1' ' B' ' 338' ' ' PHE . 75.3 m-85 -113.78 -173.55 2.3 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.377 -0.827 . . . . 0.3 109.173 179.673 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' D' D ' 329' ' ' THR . . . . . 0.41 HG23 ' C ' ' D' ' 328' ' ' PHE . 67.3 p -153.41 164.4 38.23 Favored 'General case' 0 N--CA 1.488 1.445 0 O-C-N 121.249 -0.907 . . . . 0.22 109.28 179.987 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' D' D ' 330' ' ' LEU . . . . . . . . . . . . . 15.4 tp -150.04 125.96 10.5 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.218 -0.926 . . . . 0.28 109.551 -179.837 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' D' D ' 331' ' ' GLN . . . . . . . . . . . . . 1.5 tt0 -87.24 114.7 24.08 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.367 -0.833 . . . . 0.93 109.327 179.799 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' D' D ' 332' ' ' ILE . . . . . 0.506 HG21 ' HA ' ' D' ' 338' ' ' PHE . 58.2 mt -103.3 104.55 16.82 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.514 0 O-C-N 121.089 -1.007 . . . . 0.25 109.741 -179.912 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' D' D ' 333' ' ' ARG . . . . . . . . . . . . . 10.4 mtm180 -72.34 138.67 47.46 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.176 -0.953 . . . . 2.93 109.243 179.728 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' D' D ' 334' ' ' GLY . . . . . . . . . . . . . . . 92.93 131.1 5.63 Favored Glycine 0 N--CA 1.49 2.3 0 N-CA-C 109.482 -1.447 . . . . 0.41 109.482 -179.78 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' D' D ' 335' ' ' ARG . . . . . 0.441 ' HA ' ' CE1' ' B' ' 328' ' ' PHE . 2.0 ttt180 -77.33 -33.15 55.55 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.225 -1.162 . . . . 3.03 109.675 -179.858 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' D' D ' 336' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -58.13 -61.13 2.78 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.129 -0.982 . . . . 2.26 109.722 -179.79 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' D' D ' 337' ' ' ARG . . . . . . . . . . . . . 5.4 mtt180 -60.97 -34.11 74.25 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.296 -0.878 . . . . 2.92 109.61 -179.812 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' D' D ' 338' ' ' PHE . . . . . 0.506 ' HA ' HG21 ' D' ' 332' ' ' ILE . 80.3 t80 -54.3 -60.41 3.37 Favored 'General case' 0 N--CA 1.488 1.453 0 O-C-N 121.221 -0.925 . . . . 0.37 109.725 -179.777 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' D' D ' 339' ' ' GLU . . . . . . . . . . . . . 94.2 mt-10 -51.15 -33.47 27.06 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.3 -0.875 . . . . 1.99 110.039 -179.673 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' D' D ' 340' ' ' MET . . . . . . . . . . . . . 33.1 ttp -64.45 -50.76 66.26 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.082 -1.011 . . . . 0.31 109.931 -179.587 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' D' D ' 341' ' ' PHE . . . . . . . . . . . . . 36.9 m-85 -61.56 -47.23 86.47 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.168 -0.957 . . . . 0.18 109.868 -179.525 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' D' D ' 342' ' ' ARG . . . . . . . . . . . . . 1.5 ttt180 -49.92 -39.49 40.33 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.157 -0.964 . . . . 2.41 109.558 -179.902 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' D' D ' 343' ' ' GLU . . . . . . . . . . . . . 2.8 tt0 -58.28 -49.8 75.87 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.294 -0.879 . . . . 2.35 109.398 -179.998 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' D' D ' 344' ' ' LEU . . . . . 0.471 HD22 ' CD2' ' C' ' 344' ' ' LEU . 75.9 mt -62.25 -29.5 70.44 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.184 -0.948 . . . . 0.19 109.293 179.761 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' D' D ' 345' ' ' ASN . . . . . . . . . . . . . 11.3 t-20 -58.0 -54.37 47.72 Favored 'General case' 0 C--N 1.303 -1.414 0 O-C-N 121.398 -0.813 . . . . 1.09 109.45 179.968 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' D' D ' 346' ' ' GLU . . . . . . . . . . . . . 1.2 tt0 -61.81 -29.06 69.9 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.308 -0.87 . . . . 1.69 109.827 -179.857 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' D' D ' 347' ' ' ALA . . . . . 0.982 ' HB1' ' HB1' ' C' ' 347' ' ' ALA . . . -61.73 -62.01 2.11 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.201 -0.937 . . . . 0.18 110.122 -179.66 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' D' D ' 348' ' ' LEU . . . . . 0.547 HD22 ' N ' ' D' ' 348' ' ' LEU . 3.9 mm? -61.52 -44.71 96.57 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.159 -0.963 . . . . 0.31 110.119 -179.394 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' D' D ' 349' ' ' GLU . . . . . . . . . . . . . 3.1 mt-10 -56.64 -35.54 68.46 Favored 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.13 -0.982 . . . . 1.95 109.859 -179.507 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' D' D ' 350' ' ' LEU . . . . . 0.689 HD13 HD22 ' C' ' 350' ' ' LEU . 6.0 tt -65.02 -45.75 84.17 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.154 -0.966 . . . . 0.43 109.576 -179.865 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' D' D ' 351' ' ' LYS . . . . . . . . . . . . . 21.8 tttt -59.03 -41.09 86.96 Favored 'General case' 0 C--N 1.304 -1.404 0 O-C-N 121.258 -0.901 . . . . 1.4 109.381 -179.877 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' D' D ' 352' ' ' ASP . . . . . . . . . . . . . 11.7 m-20 -56.38 -50.47 71.46 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.328 -0.858 . . . . 1.17 109.484 179.886 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' D' D ' 353' ' ' ALA . . . . . . . . . . . . . . . -68.68 -15.4 63.51 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.232 -0.918 . . . . 0.59 109.543 -179.953 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' D' D ' 354' ' ' GLN . . . . . 0.453 ' NE2' HD11 ' C' ' 350' ' ' LEU . 0.0 OUTLIER -83.09 -7.01 59.7 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.154 -0.966 . . . . 1.44 109.52 -179.991 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' D' D ' 355' ' ' ALA . . . . . . . . . . . . . . . -70.54 -4.93 25.41 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.174 -0.953 . . . . 0.98 109.557 179.986 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' D' D ' 356' ' ' GLY . . . . . . . . . . . . . . . -75.22 -83.46 0.4 Allowed Glycine 0 N--CA 1.491 2.344 0 N-CA-C 109.37 -1.492 . . . . 1.28 109.37 179.801 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' D' D ' 357' ' ' LYS . . . . . . . . . . . . . 2.3 tttt -86.32 136.03 33.3 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.313 -1.11 . . . . 4.09 109.206 179.813 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' D' D ' 358' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -49.02 159.47 0.57 Allowed Pre-proline 0 N--CA 1.489 1.524 0 O-C-N 121.153 -0.967 . . . . 5.71 109.446 -179.835 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' D' D ' 359' ' ' PRO . . . . . . . . . . . . . 2.6 Cg_endo -61.48 150.25 86.03 Favored 'Trans proline' 0 C--N 1.31 -1.499 0 C-N-CA 122.208 1.939 . . . . 4.97 110.213 -179.994 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' D' D ' 360' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.327 0 CA-C-O 117.958 -1.468 . . . . 6.97 109.59 179.961 . . . . . . . . 0 0 . 1 . 023 nuclear nobuild full ' A' A ' 319' ' ' LYS . . . . . . . . . . . . . 7.0 pttt . . . . . 0 N--CA 1.491 1.59 0 N-CA-C 109.41 -0.589 . . . . 7.55 109.41 . . . . . . . . . 0 0 . 1 . 023 nuclear nobuild full ' A' A ' 320' ' ' LYS . . . . . . . . . . . . . 38.5 mtmt 54.68 72.85 0.44 Allowed 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.318 -0.864 . . . . 6.43 109.294 -179.97 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 321' ' ' LYS . . . . . . . . . . . . . 7.8 mtpt -82.31 120.13 76.34 Favored Pre-proline 0 N--CA 1.49 1.536 0 O-C-N 121.237 -0.915 . . . . 6.13 109.208 -179.89 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 322' ' ' PRO . . . . . . . . . . . . . 5.0 Cg_exo -60.0 94.99 0.1 OUTLIER 'Trans proline' 0 C--N 1.313 -1.338 0 C-N-CA 121.85 1.7 . . . . 2.83 109.985 179.947 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 323' ' ' LEU . . . . . . . . . . . . . 75.9 mt -80.3 94.18 6.06 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.293 -0.879 . . . . 2.83 109.532 -179.884 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 324' ' ' ASP . . . . . . . . . . . . . 62.9 m-20 -84.09 88.73 7.19 Favored 'General case' 0 N--CA 1.489 1.477 0 O-C-N 121.134 -0.979 . . . . 1.53 109.072 179.536 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 325' ' ' GLY . . . . . 0.537 ' O ' ' CD1' ' A' ' 327' ' ' TYR . . . -71.34 -156.78 2.43 Favored Glycine 0 N--CA 1.49 2.276 0 N-CA-C 109.282 -1.527 . . . . 0.61 109.282 179.721 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 326' ' ' GLU . . . . . . . . . . . . . 59.2 mm-40 -58.6 168.92 1.03 Allowed 'General case' 0 N--CA 1.488 1.475 0 O-C-N 121.218 -1.166 . . . . 2.13 108.945 179.525 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 327' ' ' TYR . . . . . 0.537 ' CD1' ' O ' ' A' ' 325' ' ' GLY . 38.4 m-85 -148.64 105.36 3.57 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.169 -0.957 . . . . 0.48 109.634 179.697 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 328' ' ' PHE . . . . . . . . . . . . . 98.2 m-85 -107.33 -166.92 1.2 Allowed 'General case' 0 C--N 1.303 -1.445 0 N-CA-C 108.851 -0.796 . . . . 0.31 108.851 179.68 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 329' ' ' THR . . . . . . . . . . . . . 68.1 p -151.07 164.71 35.82 Favored 'General case' 0 C--N 1.301 -1.517 0 O-C-N 121.139 -0.976 . . . . 0.22 109.27 -179.984 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 330' ' ' LEU . . . . . . . . . . . . . 16.1 tp -148.76 131.77 16.25 Favored 'General case' 0 C--N 1.302 -1.474 0 O-C-N 121.236 -0.915 . . . . 0.28 109.377 -179.635 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 331' ' ' GLN . . . . . . . . . . . . . 1.6 tp60 -85.87 113.97 22.43 Favored 'General case' 0 N--CA 1.488 1.464 0 O-C-N 121.388 -0.82 . . . . 0.91 109.151 179.955 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 332' ' ' ILE . . . . . 0.651 HG21 ' HA ' ' A' ' 338' ' ' PHE . 53.9 mt -102.83 102.23 13.31 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.497 0 O-C-N 121.295 -0.878 . . . . 0.26 109.38 -179.827 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 333' ' ' ARG . . . . . . . . . . . . . 79.9 mtt180 -72.18 154.64 40.93 Favored 'General case' 0 N--CA 1.489 1.479 0 O-C-N 121.343 -0.848 . . . . 2.92 109.37 179.992 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 334' ' ' GLY . . . . . . . . . . . . . . . 80.07 134.24 1.23 Allowed Glycine 0 N--CA 1.491 2.339 0 N-CA-C 109.598 -1.401 . . . . 0.4 109.598 -179.86 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 335' ' ' ARG . . . . . 0.51 ' NH1' ' HG2' ' A' ' 335' ' ' ARG . 1.3 ttt-85 -79.93 -50.58 10.24 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.271 -1.135 . . . . 3.01 109.83 -179.782 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 336' ' ' GLU . . . . . . . . . . . . . 1.4 pt-20 -55.61 -48.29 75.13 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.179 -0.95 . . . . 2.29 109.611 -179.689 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 337' ' ' ARG . . . . . 0.442 ' NH1' ' CG ' ' A' ' 337' ' ' ARG . 0.0 OUTLIER -60.1 -35.08 74.44 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.209 -0.932 . . . . 2.93 109.474 179.97 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' A' A ' 338' ' ' PHE . . . . . 0.651 ' HA ' HG21 ' A' ' 332' ' ' ILE . 61.9 t80 -55.64 -55.69 29.19 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.321 -0.862 . . . . 0.38 109.531 179.998 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 339' ' ' GLU . . . . . . . . . . . . . 3.6 mm-40 -51.03 -32.68 22.34 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.339 -0.851 . . . . 1.97 110.118 -179.547 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 340' ' ' MET . . . . . . . . . . . . . 19.5 ttp -64.36 -52.92 55.95 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.151 -0.968 . . . . 0.31 110.198 -179.425 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 341' ' ' PHE . . . . . . . . . . . . . 39.8 m-85 -62.46 -46.08 90.14 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.195 -0.941 . . . . 0.18 110.208 -179.274 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 342' ' ' ARG . . . . . . . . . . . . . 10.0 ttp180 -48.51 -41.19 29.24 Favored 'General case' 0 N--CA 1.491 1.625 0 O-C-N 121.061 -1.025 . . . . 2.42 109.813 -179.827 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 343' ' ' GLU . . . . . . . . . . . . . 9.1 tp10 -59.31 -45.46 91.23 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.259 -0.901 . . . . 2.35 109.967 -179.709 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 344' ' ' LEU . . . . . 0.404 ' O ' HD23 ' A' ' 348' ' ' LEU . 53.1 mt -62.77 -44.64 95.66 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.256 -0.903 . . . . 0.18 110.024 -179.704 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 345' ' ' ASN . . . . . 0.425 HD22 HD11 ' C' ' 330' ' ' LEU . 54.7 t-20 -55.38 -49.52 72.12 Favored 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.172 -0.955 . . . . 1.09 109.872 -179.823 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 346' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -61.06 -36.16 78.86 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.243 -0.91 . . . . 1.65 109.585 -179.812 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 347' ' ' ALA . . . . . 0.872 ' HB1' ' HB1' ' B' ' 347' ' ' ALA . . . -60.14 -50.06 75.19 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.235 -0.915 . . . . 0.18 109.962 -179.806 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 348' ' ' LEU . . . . . 0.55 HD12 ' NH2' ' C' ' 337' ' ' ARG . 3.6 mm? -62.24 -48.95 77.67 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.124 -0.985 . . . . 0.3 109.87 -179.63 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 349' ' ' GLU . . . . . . . . . . . . . 76.3 mt-10 -55.53 -35.41 65.63 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.162 -0.961 . . . . 1.94 109.7 -179.479 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 350' ' ' LEU . . . . . 0.783 HD13 HD22 ' B' ' 350' ' ' LEU . 5.6 tt -62.91 -45.3 93.17 Favored 'General case' 0 N--CA 1.488 1.472 0 O-C-N 121.266 -0.896 . . . . 0.46 109.216 179.843 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 351' ' ' LYS . . . . . . . . . . . . . 19.1 tttm -56.37 -38.66 71.74 Favored 'General case' 0 N--CA 1.488 1.469 0 O-C-N 121.365 -0.834 . . . . 1.4 109.481 179.982 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 352' ' ' ASP . . . . . . . . . . . . . 4.7 m-20 -55.61 -45.97 77.39 Favored 'General case' 0 N--CA 1.489 1.495 0 O-C-N 121.223 -0.923 . . . . 1.16 109.429 179.784 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 353' ' ' ALA . . . . . . . . . . . . . . . -67.98 -28.26 67.28 Favored 'General case' 0 N--CA 1.489 1.494 0 O-C-N 121.309 -0.869 . . . . 0.63 109.172 179.734 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 354' ' ' GLN . . . . . . . . . . . . . 3.2 tt0 -81.3 0.92 34.84 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.321 -0.862 . . . . 1.47 109.471 179.756 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 355' ' ' ALA . . . . . . . . . . . . . . . -69.25 -77.96 0.07 Allowed 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.264 -0.898 . . . . 1.01 109.512 -179.807 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 356' ' ' GLY . . . . . . . . . . . . . . . -81.62 58.48 4.88 Favored Glycine 0 N--CA 1.492 2.368 0 N-CA-C 110.432 -1.067 . . . . 1.3 110.432 -179.578 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 357' ' ' LYS . . . . . . . . . . . . . 13.6 ttmt -90.16 92.33 8.91 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 120.821 -1.399 . . . . 4.1 109.148 179.471 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 358' ' ' GLU . . . . . . . . . . . . . 34.9 tp10 -49.49 117.45 6.99 Favored Pre-proline 0 N--CA 1.49 1.561 0 O-C-N 121.14 -0.975 . . . . 5.75 109.484 -179.85 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 359' ' ' PRO . . . . . . . . . . . . . 2.8 Cg_endo -61.66 156.54 47.13 Favored 'Trans proline' 0 C--N 1.313 -1.322 0 C-N-CA 121.92 1.747 . . . . 5.0 109.939 179.81 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 360' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.216 0 N-CA-C 109.473 -1.451 . . . . 6.97 109.473 179.916 . . . . . . . . 0 0 . 1 . 023 nuclear nobuild full ' B' B ' 319' ' ' LYS . . . . . . . . . . . . . 7.3 pttt . . . . . 0 N--CA 1.492 1.628 0 N-CA-C 109.448 -0.575 . . . . 7.55 109.448 . . . . . . . . . 0 0 . 1 . 023 nuclear nobuild full ' B' B ' 320' ' ' LYS . . . . . . . . . . . . . 40.3 mtmt 54.81 72.53 0.46 Allowed 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.255 -0.903 . . . . 6.44 109.479 -179.892 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 321' ' ' LYS . . . . . . . . . . . . . 8.1 mtpt -81.74 120.6 78.17 Favored Pre-proline 0 N--CA 1.488 1.472 0 O-C-N 121.137 -0.977 . . . . 6.13 109.363 -179.999 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 322' ' ' PRO . . . . . . . . . . . . . 5.2 Cg_exo -59.88 95.48 0.1 OUTLIER 'Trans proline' 0 C--N 1.311 -1.401 0 C-N-CA 121.871 1.714 . . . . 2.82 109.954 179.844 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 323' ' ' LEU . . . . . . . . . . . . . 74.4 mt -80.6 93.82 6.18 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.298 -0.877 . . . . 2.84 109.593 -179.804 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 324' ' ' ASP . . . . . . . . . . . . . 62.8 m-20 -83.83 89.61 7.22 Favored 'General case' 0 C--N 1.305 -1.362 0 O-C-N 121.234 -0.916 . . . . 1.53 109.052 179.563 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 325' ' ' GLY . . . . . 0.548 ' O ' ' CD1' ' B' ' 327' ' ' TYR . . . -73.1 -157.1 3.91 Favored Glycine 0 N--CA 1.488 2.152 0 N-CA-C 109.111 -1.596 . . . . 0.59 109.111 179.913 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' B' B ' 326' ' ' GLU . . . . . . . . . . . . . 60.4 mm-40 -58.28 168.5 1.06 Allowed 'General case' 0 C--N 1.304 -1.395 0 O-C-N 121.093 -1.239 . . . . 2.13 108.96 179.746 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 327' ' ' TYR . . . . . 0.548 ' CD1' ' O ' ' B' ' 325' ' ' GLY . 39.2 m-85 -148.35 105.4 3.61 Favored 'General case' 0 C--N 1.301 -1.517 0 O-C-N 121.156 -0.965 . . . . 0.48 109.614 179.846 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' B' B ' 328' ' ' PHE . . . . . . . . . . . . . 98.2 m-85 -107.54 -166.91 1.19 Allowed 'General case' 0 N--CA 1.488 1.455 0 N-CA-C 108.772 -0.825 . . . . 0.32 108.772 179.752 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 329' ' ' THR . . . . . . . . . . . . . 69.7 p -151.04 164.89 35.39 Favored 'General case' 0 C--N 1.301 -1.52 0 O-C-N 121.151 -0.968 . . . . 0.23 109.235 -179.988 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 330' ' ' LEU . . . . . 0.573 HD11 HD22 ' D' ' 345' ' ' ASN . 15.7 tp -148.95 131.6 15.9 Favored 'General case' 0 C--N 1.303 -1.445 0 O-C-N 121.189 -0.945 . . . . 0.28 109.386 -179.689 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' B' B ' 331' ' ' GLN . . . . . . . . . . . . . 1.6 tp60 -85.62 113.87 22.17 Favored 'General case' 0 C--N 1.303 -1.432 0 O-C-N 121.347 -0.845 . . . . 0.91 109.203 179.943 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 332' ' ' ILE . . . . . 0.661 HG21 ' HA ' ' B' ' 338' ' ' PHE . 52.4 mt -102.68 102.57 13.78 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.484 0 O-C-N 121.172 -0.955 . . . . 0.24 109.44 -179.967 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' B' B ' 333' ' ' ARG . . . . . . . . . . . . . 80.2 mtt180 -72.39 154.71 40.76 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.458 -0.776 . . . . 2.93 109.434 -179.911 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 334' ' ' GLY . . . . . . . . . . . . . . . 79.85 134.54 1.21 Allowed Glycine 0 N--CA 1.491 2.316 0 N-CA-C 109.437 -1.465 . . . . 0.4 109.437 -179.899 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 335' ' ' ARG . . . . . 0.511 ' HG2' ' NH1' ' B' ' 335' ' ' ARG . 1.4 ttt-85 -80.15 -50.37 10.38 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.287 -1.125 . . . . 3.01 109.868 -179.866 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' B' B ' 336' ' ' GLU . . . . . . . . . . . . . 1.3 pt-20 -55.54 -48.12 75.23 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.218 -0.926 . . . . 2.28 109.644 -179.715 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 337' ' ' ARG . . . . . 0.441 ' CG ' ' NH1' ' B' ' 337' ' ' ARG . 0.0 OUTLIER -60.27 -35.22 75.03 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.199 -0.938 . . . . 2.93 109.453 179.966 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' B' B ' 338' ' ' PHE . . . . . 0.661 ' HA ' HG21 ' B' ' 332' ' ' ILE . 62.3 t80 -55.55 -55.95 25.96 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.246 -0.909 . . . . 0.37 109.563 -179.998 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' B' B ' 339' ' ' GLU . . . . . . . . . . . . . 3.5 mm-40 -50.92 -32.37 20.49 Favored 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.233 -0.917 . . . . 1.98 110.113 -179.6 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 340' ' ' MET . . . . . . . . . . . . . 19.4 ttp -64.56 -52.97 54.88 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.146 -0.972 . . . . 0.32 110.155 -179.457 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 341' ' ' PHE . . . . . . . . . . . . . 40.1 m-85 -62.56 -46.07 90.01 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.166 -0.959 . . . . 0.18 110.254 -179.246 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 342' ' ' ARG . . . . . . . . . . . . . 10.1 ttp180 -48.46 -41.13 28.64 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.046 -1.034 . . . . 2.42 109.771 -179.752 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 343' ' ' GLU . . . . . . . . . . . . . 9.2 tp10 -59.35 -45.55 91.09 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.238 -0.914 . . . . 2.35 109.908 -179.668 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 344' ' ' LEU . . . . . . . . . . . . . 49.2 mt -62.91 -44.57 95.72 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.288 -0.883 . . . . 0.18 109.968 -179.607 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 345' ' ' ASN . . . . . 0.498 HD22 HD11 ' D' ' 330' ' ' LEU . 55.7 t-20 -55.4 -49.68 71.75 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.22 -0.925 . . . . 1.09 109.685 -179.704 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' B' B ' 346' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -60.81 -36.16 78.34 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.215 -0.928 . . . . 1.66 109.599 -179.773 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' B' B ' 347' ' ' ALA . . . . . 0.872 ' HB1' ' HB1' ' A' ' 347' ' ' ALA . . . -60.34 -49.92 75.68 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.153 -0.967 . . . . 0.17 109.926 -179.816 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' B' B ' 348' ' ' LEU . . . . . 0.525 HD22 ' N ' ' B' ' 348' ' ' LEU . 3.7 mm? -62.25 -49.04 77.28 Favored 'General case' 0 N--CA 1.493 1.692 0 O-C-N 121.182 -0.949 . . . . 0.29 109.834 -179.67 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' B' B ' 349' ' ' GLU . . . . . . . . . . . . . 77.5 mt-10 -55.43 -35.58 65.57 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.251 -0.906 . . . . 1.95 109.642 -179.479 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 350' ' ' LEU . . . . . 0.783 HD22 HD13 ' A' ' 350' ' ' LEU . 5.7 tt -62.88 -45.18 93.76 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.255 -0.903 . . . . 0.45 109.247 179.905 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' B' B ' 351' ' ' LYS . . . . . . . . . . . . . 19.2 tttm -56.38 -38.64 71.73 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.309 -0.869 . . . . 1.38 109.412 179.922 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 352' ' ' ASP . . . . . . . . . . . . . 4.9 m-20 -55.6 -46.03 77.36 Favored 'General case' 0 N--CA 1.489 1.482 0 O-C-N 121.211 -0.931 . . . . 1.16 109.38 179.866 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 353' ' ' ALA . . . . . . . . . . . . . . . -67.96 -27.88 66.97 Favored 'General case' 0 N--CA 1.489 1.497 0 O-C-N 121.251 -0.906 . . . . 0.61 109.179 179.684 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 354' ' ' GLN . . . . . . . . . . . . . 3.1 tt0 -81.6 0.55 37.88 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.343 -0.848 . . . . 1.45 109.466 179.747 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 355' ' ' ALA . . . . . . . . . . . . . . . -69.05 -77.83 0.08 Allowed 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.194 -0.941 . . . . 0.98 109.471 -179.868 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 356' ' ' GLY . . . . . . . . . . . . . . . -81.61 58.48 4.88 Favored Glycine 0 N--CA 1.492 2.383 0 N-CA-C 110.569 -1.012 . . . . 1.29 110.569 -179.64 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 357' ' ' LYS . . . . . . . . . . . . . 12.9 ttmt -90.28 92.37 8.89 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 120.959 -1.318 . . . . 4.09 109.045 179.434 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 358' ' ' GLU . . . . . . . . . . . . . 37.7 tp10 -49.96 117.81 8.01 Favored Pre-proline 0 N--CA 1.489 1.516 0 O-C-N 121.114 -0.991 . . . . 5.72 109.507 -179.785 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 359' ' ' PRO . . . . . . . . . . . . . 2.7 Cg_endo -61.79 156.58 47.54 Favored 'Trans proline' 0 C--N 1.313 -1.311 0 C-N-CA 121.91 1.74 . . . . 4.98 110.031 179.911 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 360' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.273 0 N-CA-C 109.517 -1.433 . . . . 6.98 109.517 179.995 . . . . . . . . 0 0 . 1 . 023 nuclear nobuild full ' C' C ' 319' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.491 1.591 0 N-CA-C 109.348 -0.612 . . . . 6.82 109.348 . . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' C' C ' 320' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER 60.89 84.56 0.13 Allowed 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.281 -0.887 . . . . 6.49 109.669 179.877 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' C' C ' 321' ' ' LYS . . . . . 0.624 ' CB ' ' HD3' ' C' ' 322' ' ' PRO . 0.3 OUTLIER -160.47 -62.45 0.02 OUTLIER Pre-proline 0 N--CA 1.49 1.568 0 O-C-N 121.185 -0.947 . . . . 6.4 109.77 179.497 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' C' C ' 322' ' ' PRO . . . . . 0.624 ' HD3' ' CB ' ' C' ' 321' ' ' LYS . 2.4 Cg_endo -67.03 -4.94 12.39 Favored 'Trans proline' 0 C--N 1.318 -1.075 0 C-N-CA 121.334 1.356 . . . . 3.42 110.334 179.507 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' C' C ' 323' ' ' LEU . . . . . . . . . . . . . 85.5 mt -81.41 96.68 7.44 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.044 -1.035 . . . . 3.95 109.492 -179.955 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' C' C ' 324' ' ' ASP . . . . . 0.484 ' N ' ' OD1' ' C' ' 324' ' ' ASP . 0.5 OUTLIER -84.3 90.87 7.63 Favored 'General case' 0 N--CA 1.489 1.483 0 O-C-N 121.251 -0.906 . . . . 1.63 109.437 179.891 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' C' C ' 325' ' ' GLY . . . . . 0.563 ' O ' ' CD2' ' C' ' 327' ' ' TYR . . . -72.2 -164.7 7.37 Favored Glycine 0 N--CA 1.491 2.327 0 N-CA-C 109.41 -1.476 . . . . 0.73 109.41 179.879 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' C' C ' 326' ' ' GLU . . . . . . . . . . . . . 2.3 mp0 -58.48 164.36 2.64 Favored 'General case' 0 N--CA 1.489 1.491 0 O-C-N 121.282 -1.128 . . . . 2.17 109.057 179.57 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' C' C ' 327' ' ' TYR . . . . . 0.563 ' CD2' ' O ' ' C' ' 325' ' ' GLY . 38.7 m-85 -148.88 108.1 3.92 Favored 'General case' 0 C--N 1.302 -1.467 0 O-C-N 121.121 -0.987 . . . . 0.48 109.865 179.973 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' C' C ' 328' ' ' PHE . . . . . 0.417 ' CE1' ' HA ' ' A' ' 335' ' ' ARG . 88.8 m-85 -112.55 -166.71 1.1 Allowed 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.457 -0.777 . . . . 0.33 108.929 179.743 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' C' C ' 329' ' ' THR . . . . . . . . . . . . . 21.2 p -152.67 165.09 36.36 Favored 'General case' 0 N--CA 1.489 1.48 0 O-C-N 121.089 -1.007 . . . . 0.23 109.608 179.966 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' C' C ' 330' ' ' LEU . . . . . 0.425 HD11 HD22 ' A' ' 345' ' ' ASN . 51.5 tp -150.68 126.18 10.16 Favored 'General case' 0 N--CA 1.488 1.453 0 O-C-N 121.258 -0.901 . . . . 0.28 109.448 179.77 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' C' C ' 331' ' ' GLN . . . . . . . . . . . . . 4.4 tp-100 -86.74 117.37 25.45 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.325 -0.859 . . . . 1.48 109.3 179.883 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' C' C ' 332' ' ' ILE . . . . . 0.521 HD12 ' HD1' ' C' ' 338' ' ' PHE . 21.8 mt -103.49 110.12 28.99 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.554 0 O-C-N 121.119 -0.988 . . . . 0.24 109.684 179.949 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' C' C ' 333' ' ' ARG . . . . . 0.507 ' HG2' ' CE2' ' A' ' 327' ' ' TYR . 11.8 mtm180 -73.71 143.44 46.17 Favored 'General case' 0 N--CA 1.488 1.469 0 O-C-N 121.174 -0.954 . . . . 2.74 109.046 179.355 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' C' C ' 334' ' ' GLY . . . . . . . . . . . . . . . 90.16 134.67 5.71 Favored Glycine 0 N--CA 1.489 2.219 0 N-CA-C 109.618 -1.393 . . . . 0.35 109.618 179.931 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' C' C ' 335' ' ' ARG . . . . . 0.486 ' NH1' ' CG ' ' C' ' 335' ' ' ARG . 0.0 OUTLIER -79.49 -46.09 18.09 Favored 'General case' 0 N--CA 1.488 1.466 0 O-C-N 121.374 -1.074 . . . . 2.53 109.752 -179.939 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' C' C ' 336' ' ' GLU . . . . . . . . . . . . . 3.8 mt-10 -57.34 -48.52 78.79 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.274 -0.891 . . . . 2.62 109.687 -179.747 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' C' C ' 337' ' ' ARG . . . . . 0.55 ' NH2' HD12 ' A' ' 348' ' ' LEU . 1.9 mtp180 -59.31 -34.93 72.91 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.36 -0.837 . . . . 2.81 109.788 -179.712 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' C' C ' 338' ' ' PHE . . . . . 0.521 ' HD1' HD12 ' C' ' 332' ' ' ILE . 51.4 t80 -55.81 -54.06 49.14 Favored 'General case' 0 N--CA 1.489 1.501 0 O-C-N 121.219 -0.926 . . . . 0.4 110.296 -179.65 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' C' C ' 339' ' ' GLU . . . . . . . . . . . . . 7.9 mt-10 -51.27 -34.71 34.04 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.186 -0.946 . . . . 2.05 110.705 -179.161 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' C' C ' 340' ' ' MET . . . . . . . . . . . . . 38.1 ttp -64.78 -55.02 22.28 Favored 'General case' 0 N--CA 1.493 1.722 0 O-C-N 120.962 -1.087 . . . . 0.32 110.626 -179.094 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' C' C ' 341' ' ' PHE . . . . . . . . . . . . . 49.3 m-85 -59.87 -44.8 93.98 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.143 -0.973 . . . . 0.18 110.126 -179.053 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' C' C ' 342' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -50.24 -42.86 52.52 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.164 -0.96 . . . . 2.91 110.27 -179.562 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' C' C ' 343' ' ' GLU . . . . . . . . . . . . . 1.8 tt0 -58.06 -48.93 78.64 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.154 -0.966 . . . . 2.14 110.072 -179.362 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' C' C ' 344' ' ' LEU . . . . . 0.45 ' O ' HD23 ' C' ' 348' ' ' LEU . 66.2 mt -61.79 -36.63 81.65 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.125 -0.984 . . . . 0.22 109.763 -179.714 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' C' C ' 345' ' ' ASN . . . . . . . . . . . . . 23.0 t-20 -57.89 -57.19 13.89 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.228 -0.92 . . . . 1.08 109.785 -179.814 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' C' C ' 346' ' ' GLU . . . . . . . . . . . . . 2.0 tm-20 -60.6 -29.3 69.13 Favored 'General case' 0 N--CA 1.489 1.525 0 O-C-N 121.291 -0.881 . . . . 2.21 109.752 -179.651 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' C' C ' 347' ' ' ALA . . . . . 0.757 ' HB1' ' HB1' ' D' ' 347' ' ' ALA . . . -62.08 -52.93 61.91 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.289 -0.882 . . . . 0.18 109.934 -179.864 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' C' C ' 348' ' ' LEU . . . . . 0.528 HD22 ' N ' ' C' ' 348' ' ' LEU . 3.8 mm? -61.26 -52.33 65.19 Favored 'General case' 0 N--CA 1.492 1.675 0 O-C-N 121.223 -0.923 . . . . 0.32 109.915 -179.487 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' C' C ' 349' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -56.57 -31.64 64.41 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.217 -0.927 . . . . 2.19 109.588 -179.568 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' C' C ' 350' ' ' LEU . . . . . 0.81 ' CD2' HD13 ' D' ' 350' ' ' LEU . 10.0 tt -64.92 -44.2 90.33 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.236 -0.915 . . . . 0.46 109.24 179.816 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' C' C ' 351' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -57.53 -40.84 79.67 Favored 'General case' 0 N--CA 1.488 1.47 0 O-C-N 121.466 -0.771 . . . . 1.35 109.128 179.878 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' C' C ' 352' ' ' ASP . . . . . . . . . . . . . 30.0 m-20 -57.56 -34.71 69.47 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.358 -0.839 . . . . 1.19 109.352 179.7 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' C' C ' 353' ' ' ALA . . . . . . . . . . . . . . . -66.54 -29.0 68.98 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.334 -0.854 . . . . 0.57 109.53 -179.857 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' C' C ' 354' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -81.49 -9.23 59.75 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.124 -0.985 . . . . 1.47 109.269 179.907 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' C' C ' 355' ' ' ALA . . . . . . . . . . . . . . . -72.57 -10.16 59.46 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.243 -0.911 . . . . 0.93 109.464 179.806 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' C' C ' 356' ' ' GLY . . . . . . . . . . . . . . . -80.26 -90.33 0.49 Allowed Glycine 0 N--CA 1.491 2.323 0 N-CA-C 109.418 -1.473 . . . . 1.33 109.418 179.972 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' C' C ' 357' ' ' LYS . . . . . . . . . . . . . 3.0 mtpm? -86.15 117.18 24.81 Favored 'General case' 0 N--CA 1.488 1.47 0 O-C-N 121.287 -1.126 . . . . 4.01 109.168 179.857 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' C' C ' 358' ' ' GLU . . . . . 0.446 ' HB3' ' HD2' ' C' ' 359' ' ' PRO . 23.0 mt-10 -48.67 160.49 0.46 Allowed Pre-proline 0 N--CA 1.49 1.544 0 O-C-N 121.268 -0.895 . . . . 5.75 109.632 -179.602 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' C' C ' 359' ' ' PRO . . . . . 0.446 ' HD2' ' HB3' ' C' ' 358' ' ' GLU . 5.1 Cg_exo -59.77 96.02 0.1 OUTLIER 'Trans proline' 0 C--N 1.312 -1.383 0 C-N-CA 122.259 1.973 . . . . 4.94 110.488 -179.708 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' C' C ' 360' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.296 0 CA-C-O 117.995 -1.447 . . . . 6.5 109.494 179.82 . . . . . . . . 0 0 . 1 . 023 nuclear nobuild full ' D' D ' 319' ' ' LYS . . . . . . . . . . . . . 8.2 pttt . . . . . 0 N--CA 1.49 1.547 0 N-CA-C 109.319 -0.623 . . . . 7.53 109.319 . . . . . . . . . 0 0 . 1 . 023 nuclear nobuild full ' D' D ' 320' ' ' LYS . . . . . . . . . . . . . 41.4 mtmt 55.45 73.01 0.44 Allowed 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.288 -0.883 . . . . 6.41 109.419 -179.727 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' D' D ' 321' ' ' LYS . . . . . . . . . . . . . 8.0 mtpt -82.27 120.79 77.82 Favored Pre-proline 0 N--CA 1.487 1.423 0 O-C-N 121.164 -0.96 . . . . 6.11 109.375 179.989 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' D' D ' 322' ' ' PRO . . . . . . . . . . . . . 5.1 Cg_exo -59.74 95.5 0.1 OUTLIER 'Trans proline' 0 C--N 1.311 -1.41 0 C-N-CA 121.846 1.697 . . . . 2.82 110.041 179.902 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' D' D ' 323' ' ' LEU . . . . . . . . . . . . . 71.7 mt -80.35 94.37 6.12 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.172 -0.955 . . . . 2.83 109.49 -179.891 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' D' D ' 324' ' ' ASP . . . . . . . . . . . . . 64.1 m-20 -84.32 88.82 7.27 Favored 'General case' 0 N--CA 1.488 1.431 0 O-C-N 121.039 -1.038 . . . . 1.54 108.965 179.664 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' D' D ' 325' ' ' GLY . . . . . 0.549 ' O ' ' CD1' ' D' ' 327' ' ' TYR . . . -72.08 -157.21 3.16 Favored Glycine 0 N--CA 1.49 2.247 0 N-CA-C 109.14 -1.584 . . . . 0.59 109.14 179.814 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' D' D ' 326' ' ' GLU . . . . . . . . . . . . . 61.6 mm-40 -58.39 168.99 0.95 Allowed 'General case' 0 C--N 1.303 -1.413 0 O-C-N 121.147 -1.208 . . . . 2.13 108.87 179.555 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' D' D ' 327' ' ' TYR . . . . . 0.549 ' CD1' ' O ' ' D' ' 325' ' ' GLY . 38.7 m-85 -148.88 105.4 3.54 Favored 'General case' 0 C--N 1.301 -1.525 0 O-C-N 121.151 -0.968 . . . . 0.47 109.57 179.874 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' D' D ' 328' ' ' PHE . . . . . . . . . . . . . 98.1 m-85 -107.47 -166.92 1.2 Allowed 'General case' 0 C--N 1.302 -1.464 0 N-CA-C 108.953 -0.758 . . . . 0.3 108.953 179.815 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' D' D ' 329' ' ' THR . . . . . . . . . . . . . 66.8 p -151.24 164.54 36.36 Favored 'General case' 0 C--N 1.301 -1.539 0 O-C-N 121.204 -0.935 . . . . 0.22 109.212 -179.965 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' D' D ' 330' ' ' LEU . . . . . 0.498 HD11 HD22 ' B' ' 345' ' ' ASN . 15.8 tp -148.68 131.52 16.09 Favored 'General case' 0 C--N 1.302 -1.475 0 O-C-N 121.192 -0.943 . . . . 0.28 109.437 -179.557 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' D' D ' 331' ' ' GLN . . . . . . . . . . . . . 1.6 tp60 -85.43 114.22 22.31 Favored 'General case' 0 C--N 1.303 -1.429 0 O-C-N 121.338 -0.852 . . . . 0.93 109.167 179.868 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' D' D ' 332' ' ' ILE . . . . . 0.655 HG21 ' HA ' ' D' ' 338' ' ' PHE . 53.0 mt -102.98 102.52 13.73 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.513 0 O-C-N 121.272 -0.892 . . . . 0.25 109.38 -179.962 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' D' D ' 333' ' ' ARG . . . . . 0.442 ' HG2' ' CE2' ' B' ' 327' ' ' TYR . 80.5 mtt180 -72.46 154.88 40.63 Favored 'General case' 0 N--CA 1.489 1.477 0 O-C-N 121.256 -0.903 . . . . 2.93 109.517 -179.9 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' D' D ' 334' ' ' GLY . . . . . . . . . . . . . . . 79.6 134.57 1.14 Allowed Glycine 0 N--CA 1.49 2.262 0 N-CA-C 109.512 -1.435 . . . . 0.41 109.512 -179.918 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' D' D ' 335' ' ' ARG . . . . . 0.52 ' HG2' ' NH1' ' D' ' 335' ' ' ARG . 1.4 ttt-85 -80.0 -50.4 10.45 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.208 -1.172 . . . . 3.03 109.79 -179.731 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' D' D ' 336' ' ' GLU . . . . . . . . . . . . . 1.2 pt-20 -55.38 -48.11 74.81 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.178 -0.951 . . . . 2.26 109.631 -179.618 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' D' D ' 337' ' ' ARG . . . . . 0.457 HH11 ' CG ' ' D' ' 337' ' ' ARG . 0.0 OUTLIER -60.41 -34.98 74.72 Favored 'General case' 0 N--CA 1.489 1.488 0 O-C-N 121.137 -0.977 . . . . 2.92 109.507 179.914 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' D' D ' 338' ' ' PHE . . . . . 0.655 ' HA ' HG21 ' D' ' 332' ' ' ILE . 62.5 t80 -55.55 -56.02 25.12 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.298 -0.876 . . . . 0.37 109.656 179.937 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' D' D ' 339' ' ' GLU . . . . . . . . . . . . . 3.4 mm-40 -51.02 -32.22 20.75 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.199 -0.938 . . . . 1.99 110.163 -179.643 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' D' D ' 340' ' ' MET . . . . . . . . . . . . . 19.3 ttp -64.45 -53.36 49.5 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.162 -0.961 . . . . 0.31 110.175 -179.433 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' D' D ' 341' ' ' PHE . . . . . . . . . . . . . 40.2 m-85 -62.47 -46.37 88.81 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.123 -0.986 . . . . 0.18 110.166 -179.188 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' D' D ' 342' ' ' ARG . . . . . . . . . . . . . 10.7 ttp180 -48.15 -41.13 25.9 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.08 -1.013 . . . . 2.41 109.787 -179.765 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' D' D ' 343' ' ' GLU . . . . . . . . . . . . . 9.3 tp10 -59.25 -45.77 90.3 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.292 -0.88 . . . . 2.35 109.933 -179.697 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' D' D ' 344' ' ' LEU . . . . . 0.43 HD22 HD22 ' C' ' 344' ' ' LEU . 46.3 mt -62.76 -44.56 95.88 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.164 -0.96 . . . . 0.19 110.013 -179.639 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' D' D ' 345' ' ' ASN . . . . . 0.573 HD22 HD11 ' B' ' 330' ' ' LEU . 56.5 t-20 -55.37 -49.45 72.25 Favored 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.204 -0.935 . . . . 1.09 109.64 -179.643 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' D' D ' 346' ' ' GLU . . . . . . . . . . . . . 1.1 tt0 -61.15 -35.92 78.38 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.236 -0.915 . . . . 1.69 109.652 -179.878 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' D' D ' 347' ' ' ALA . . . . . 0.757 ' HB1' ' HB1' ' C' ' 347' ' ' ALA . . . -60.25 -50.25 74.38 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.182 -0.949 . . . . 0.18 109.89 -179.892 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' D' D ' 348' ' ' LEU . . . . . 0.529 HD22 ' N ' ' D' ' 348' ' ' LEU . 3.7 mm? -62.04 -48.96 77.94 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.146 -0.971 . . . . 0.31 109.889 -179.685 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' D' D ' 349' ' ' GLU . . . . . . . . . . . . . 77.2 mt-10 -55.64 -35.04 65.49 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.114 -0.991 . . . . 1.95 109.81 -179.538 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' D' D ' 350' ' ' LEU . . . . . 0.81 HD13 ' CD2' ' C' ' 350' ' ' LEU . 5.8 tt -63.38 -44.47 94.65 Favored 'General case' 0 N--CA 1.489 1.479 0 O-C-N 121.267 -0.895 . . . . 0.43 109.233 179.943 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' D' D ' 351' ' ' LYS . . . . . . . . . . . . . 19.2 tttm -57.16 -38.28 73.34 Favored 'General case' 0 N--CA 1.489 1.481 0 O-C-N 121.446 -0.784 . . . . 1.4 109.416 179.879 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' D' D ' 352' ' ' ASP . . . . . . . . . . . . . 5.2 m-20 -55.85 -45.9 78.33 Favored 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.242 -0.911 . . . . 1.17 109.355 179.696 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' D' D ' 353' ' ' ALA . . . . . . . . . . . . . . . -68.04 -27.94 66.96 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.201 -0.937 . . . . 0.59 109.179 179.67 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' D' D ' 354' ' ' GLN . . . . . 0.455 ' NE2' ' CD1' ' C' ' 350' ' ' LEU . 3.1 tt0 -81.53 0.45 38.03 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.392 -0.818 . . . . 1.44 109.49 179.791 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' D' D ' 355' ' ' ALA . . . . . . . . . . . . . . . -69.22 -77.54 0.08 Allowed 'General case' 0 N--CA 1.489 1.49 0 O-C-N 121.231 -0.918 . . . . 0.98 109.516 -179.879 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' D' D ' 356' ' ' GLY . . . . . . . . . . . . . . . -81.72 57.71 4.92 Favored Glycine 0 N--CA 1.492 2.404 0 N-CA-C 110.542 -1.023 . . . . 1.28 110.542 -179.563 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' D' D ' 357' ' ' LYS . . . . . . . . . . . . . 12.3 ttmt -89.6 92.02 8.92 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 120.82 -1.4 . . . . 4.09 109.152 179.434 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' D' D ' 358' ' ' GLU . . . . . . . . . . . . . 40.6 tp10 -49.82 117.81 7.83 Favored Pre-proline 0 N--CA 1.492 1.649 0 O-C-N 121.14 -0.975 . . . . 5.71 109.387 -179.864 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' D' D ' 359' ' ' PRO . . . . . . . . . . . . . 2.5 Cg_endo -61.57 157.39 41.96 Favored 'Trans proline' 0 C--N 1.314 -1.288 0 C-N-CA 121.818 1.678 . . . . 4.97 109.873 179.806 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' D' D ' 360' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 2.371 0 CA-C-O 118.018 -1.434 . . . . 6.97 109.633 -179.955 . . . . . . . . 0 0 . 1 . 024 nuclear nobuild full ' A' A ' 319' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 N--CA 1.492 1.666 0 N-CA-C 109.379 -0.6 . . . . 7.55 109.379 . . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 320' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 63.09 115.99 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.384 -0.823 . . . . 6.43 109.659 179.85 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 321' ' ' LYS . . . . . . . . . . . . . 8.4 mttt -81.81 144.03 51.26 Favored Pre-proline 0 N--CA 1.49 1.553 0 O-C-N 121.251 -0.906 . . . . 6.13 109.097 179.851 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 322' ' ' PRO . . . . . . . . . . . . . 2.2 Cg_endo -61.98 -81.61 0.01 OUTLIER 'Trans proline' 0 C--N 1.31 -1.476 0 C-N-CA 122.105 1.87 . . . . 2.83 110.485 -179.624 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 323' ' ' LEU . . . . . . . . . . . . . 46.2 mt -82.91 104.88 13.46 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.178 -0.952 . . . . 2.83 109.791 -179.682 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 324' ' ' ASP . . . . . . . . . . . . . 8.0 m-20 -81.79 -154.82 0.12 Allowed 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.245 -0.91 . . . . 1.53 109.49 179.828 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 325' ' ' GLY . . . . . . . . . . . . . . . -69.69 -168.04 6.18 Favored Glycine 0 N--CA 1.491 2.366 0 N-CA-C 109.748 -1.341 . . . . 0.61 109.748 179.978 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 326' ' ' GLU . . . . . . . . . . . . . 2.2 mm-40 -59.14 -173.72 0.02 OUTLIER 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.352 -1.087 . . . . 2.13 109.627 -179.96 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 327' ' ' TYR . . . . . 0.525 ' CE1' ' HG2' ' C' ' 333' ' ' ARG . 43.2 m-85 -149.83 112.18 4.69 Favored 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.297 -0.877 . . . . 0.48 109.737 179.889 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 328' ' ' PHE . . . . . 0.504 ' CE1' ' HA ' ' C' ' 335' ' ' ARG . 71.0 m-85 -113.93 -168.81 1.4 Allowed 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.252 -0.905 . . . . 0.31 109.187 179.69 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 329' ' ' THR . . . . . 0.403 HG23 ' O ' ' A' ' 328' ' ' PHE . 40.3 p -154.58 167.54 29.77 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.2 -0.938 . . . . 0.22 109.451 -179.992 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 330' ' ' LEU . . . . . . . . . . . . . 24.2 tp -150.37 131.42 14.36 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.254 -0.904 . . . . 0.28 109.477 -179.888 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 331' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -87.13 111.94 21.44 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.3 -0.875 . . . . 0.91 109.436 179.861 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 332' ' ' ILE . . . . . 0.534 HG21 ' HA ' ' A' ' 338' ' ' PHE . 97.0 mt -103.56 104.03 16.07 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.592 0 O-C-N 121.232 -0.918 . . . . 0.26 109.529 -179.986 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 333' ' ' ARG . . . . . 0.596 ' HG2' ' CE2' ' C' ' 327' ' ' TYR . 13.3 mtp180 -72.53 149.99 43.59 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.259 -0.9 . . . . 2.92 109.479 179.868 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 334' ' ' GLY . . . . . . . . . . . . . . . 86.37 131.14 2.86 Favored Glycine 0 N--CA 1.493 2.438 0 N-CA-C 109.84 -1.304 . . . . 0.4 109.84 179.606 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 335' ' ' ARG . . . . . 0.457 ' O ' ' HB3' ' A' ' 338' ' ' PHE . 0.0 OUTLIER -80.26 -39.07 29.66 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.33 -1.1 . . . . 3.01 109.586 179.874 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 336' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -57.99 -61.74 2.32 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.17 -0.956 . . . . 2.29 110.106 -179.561 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 337' ' ' ARG . . . . . 0.497 ' NE ' HD12 ' C' ' 348' ' ' LEU . 0.0 OUTLIER -59.96 -26.37 65.94 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.137 -0.977 . . . . 2.93 109.788 -179.509 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 338' ' ' PHE . . . . . 0.534 ' HA ' HG21 ' A' ' 332' ' ' ILE . 50.8 t80 -55.67 -58.6 7.13 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.149 -0.969 . . . . 0.38 109.732 -179.869 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 339' ' ' GLU . . . . . . . . . . . . . 55.9 mt-10 -50.71 -32.94 20.97 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.269 -0.894 . . . . 1.97 109.876 -179.653 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 340' ' ' MET . . . . . . . . . . . . . 23.0 ttp -63.56 -51.19 66.44 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.107 -0.996 . . . . 0.31 110.044 -179.509 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 341' ' ' PHE . . . . . 0.434 ' HB2' HD13 ' A' ' 332' ' ' ILE . 36.7 m-85 -62.0 -45.84 91.85 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.166 -0.959 . . . . 0.18 110.081 -179.557 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 342' ' ' ARG . . . . . 0.473 ' NH1' ' HG3' ' A' ' 342' ' ' ARG . 0.0 OUTLIER -49.58 -42.55 44.78 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.14 -0.975 . . . . 2.42 110.047 -179.499 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 343' ' ' GLU . . . . . . . . . . . . . 1.6 tt0 -58.61 -47.93 82.69 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.099 -1.0 . . . . 2.35 109.817 -179.57 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 344' ' ' LEU . . . . . 0.592 ' CD2' HD22 ' B' ' 344' ' ' LEU . 50.3 mt -61.39 -33.28 73.4 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.163 -0.961 . . . . 0.18 109.536 -179.794 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 345' ' ' ASN . . . . . . . . . . . . . 21.6 t-20 -57.82 -59.25 5.52 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.249 -0.907 . . . . 1.09 109.807 -179.944 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 346' ' ' GLU . . . . . . . . . . . . . 72.4 tt0 -62.16 -28.19 69.48 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.284 -0.885 . . . . 1.65 110.136 -179.592 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 347' ' ' ALA . . . . . 0.769 ' HB1' ' HB1' ' B' ' 347' ' ' ALA . . . -60.71 -56.91 15.64 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.11 -0.994 . . . . 0.18 110.006 -179.64 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 348' ' ' LEU . . . . . 0.539 HD22 ' N ' ' A' ' 348' ' ' LEU . 4.0 mm? -61.92 -46.49 89.13 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.13 -0.981 . . . . 0.3 110.134 -179.56 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 349' ' ' GLU . . . . . . . . . . . . . 33.3 mm-40 -57.17 -33.22 67.21 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.196 -0.94 . . . . 1.94 109.973 -179.452 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 350' ' ' LEU . . . . . 0.782 HD13 HD22 ' B' ' 350' ' ' LEU . 5.8 tt -64.66 -48.54 74.4 Favored 'General case' 0 N--CA 1.489 1.482 0 O-C-N 121.133 -0.98 . . . . 0.46 109.516 -179.883 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 351' ' ' LYS . . . . . . . . . . . . . 22.1 tttm -58.1 -39.57 78.98 Favored 'General case' 0 N--CA 1.488 1.469 0 O-C-N 121.343 -0.848 . . . . 1.4 109.413 -179.916 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 352' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -57.82 -52.5 65.21 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.295 -0.878 . . . . 1.16 109.856 179.975 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 353' ' ' ALA . . . . . . . . . . . . . . . -66.47 -10.01 40.04 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.26 -0.9 . . . . 0.63 109.823 -179.547 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 354' ' ' GLN . . . . . . . . . . . . . 2.5 tt0 -84.13 -53.83 5.25 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.132 -0.98 . . . . 1.47 109.692 -179.98 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 355' ' ' ALA . . . . . . . . . . . . . . . -71.07 -8.47 53.61 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.254 -0.904 . . . . 1.01 109.815 -179.672 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 356' ' ' GLY . . . . . . . . . . . . . . . -81.38 -23.08 59.31 Favored Glycine 0 N--CA 1.491 2.316 0 N-CA-C 109.445 -1.462 . . . . 1.3 109.445 179.816 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 357' ' ' LYS . . . . . . . . . . . . . 15.1 mtpp -89.54 143.33 26.9 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.309 -1.112 . . . . 4.1 109.38 179.923 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 358' ' ' GLU . . . . . 0.461 ' HG2' ' HD2' ' A' ' 359' ' ' PRO . 2.5 tt0 -49.61 143.67 10.45 Favored Pre-proline 0 N--CA 1.49 1.558 0 O-C-N 121.256 -0.902 . . . . 5.75 109.33 179.928 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 359' ' ' PRO . . . . . 0.461 ' HD2' ' HG2' ' A' ' 358' ' ' GLU . 2.3 Cg_endo -62.31 -164.56 0.04 OUTLIER 'Trans proline' 0 C--N 1.311 -1.396 0 C-N-CA 122.105 1.87 . . . . 5.0 110.228 -179.991 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 360' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.324 0 CA-C-O 117.961 -1.466 . . . . 6.97 109.571 179.974 . . . . . . . . 0 0 . 1 . 024 nuclear nobuild full ' B' B ' 319' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 N--CA 1.49 1.545 0 N-CA-C 109.414 -0.588 . . . . 7.55 109.414 . . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' B' B ' 320' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 62.91 115.82 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.258 -0.901 . . . . 6.44 109.629 179.826 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' B' B ' 321' ' ' LYS . . . . . . . . . . . . . 8.4 mttt -81.59 143.94 51.9 Favored Pre-proline 0 N--CA 1.49 1.534 0 O-C-N 121.223 -0.923 . . . . 6.13 109.195 179.741 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' B' B ' 322' ' ' PRO . . . . . . . . . . . . . 2.1 Cg_endo -61.85 -81.73 0.01 OUTLIER 'Trans proline' 0 C--N 1.31 -1.461 0 C-N-CA 122.148 1.898 . . . . 2.82 110.454 -179.648 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' B' B ' 323' ' ' LEU . . . . . . . . . . . . . 46.6 mt -82.8 105.01 13.47 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.201 -0.937 . . . . 2.84 109.844 -179.725 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' B' B ' 324' ' ' ASP . . . . . . . . . . . . . 8.3 m-20 -81.74 -154.43 0.12 Allowed 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.291 -0.881 . . . . 1.53 109.524 179.841 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' B' B ' 325' ' ' GLY . . . . . . . . . . . . . . . -70.49 -168.1 7.24 Favored Glycine 0 N--CA 1.491 2.307 0 N-CA-C 109.693 -1.363 . . . . 0.59 109.693 -179.952 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' B' B ' 326' ' ' GLU . . . . . . . . . . . . . 2.2 mm-40 -58.96 -173.63 0.02 OUTLIER 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.29 -1.124 . . . . 2.13 109.696 -179.895 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' B' B ' 327' ' ' TYR . . . . . 0.597 ' CE1' ' HG2' ' D' ' 333' ' ' ARG . 42.5 m-85 -149.93 112.11 4.64 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.298 -0.876 . . . . 0.48 109.755 179.977 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' B' B ' 328' ' ' PHE . . . . . 0.463 ' CE1' ' HA ' ' D' ' 335' ' ' ARG . 71.3 m-85 -113.81 -168.75 1.39 Allowed 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.242 -0.911 . . . . 0.32 109.252 179.754 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' B' B ' 329' ' ' THR . . . . . 0.405 HG23 ' O ' ' B' ' 328' ' ' PHE . 40.1 p -154.6 167.3 30.59 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.269 -0.894 . . . . 0.23 109.379 179.981 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' B' B ' 330' ' ' LEU . . . . . . . . . . . . . 24.2 tp -150.25 131.29 14.35 Favored 'General case' 0 N--CA 1.489 1.497 0 O-C-N 121.158 -0.964 . . . . 0.28 109.483 -179.867 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' B' B ' 331' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -87.02 111.95 21.37 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.3 -0.875 . . . . 0.91 109.428 179.927 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' B' B ' 332' ' ' ILE . . . . . 0.527 HG21 ' HA ' ' B' ' 338' ' ' PHE . 97.0 mt -103.51 103.88 15.83 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.534 0 O-C-N 121.226 -0.921 . . . . 0.24 109.602 179.937 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' B' B ' 333' ' ' ARG . . . . . 0.545 ' HG2' ' CE1' ' D' ' 327' ' ' TYR . 12.9 mtp180 -72.5 150.32 43.35 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.364 -0.835 . . . . 2.93 109.544 179.835 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' B' B ' 334' ' ' GLY . . . . . . . . . . . . . . . 86.07 131.0 2.71 Favored Glycine 0 N--CA 1.492 2.41 0 N-CA-C 109.812 -1.315 . . . . 0.4 109.812 179.679 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' B' B ' 335' ' ' ARG . . . . . 0.462 ' O ' ' HB3' ' B' ' 338' ' ' PHE . 0.0 OUTLIER -80.31 -38.85 29.87 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.301 -1.117 . . . . 3.01 109.625 179.905 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' B' B ' 336' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -58.02 -61.83 2.26 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.21 -0.932 . . . . 2.28 110.056 -179.622 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' B' B ' 337' ' ' ARG . . . . . 0.481 ' HG2' ' NH1' ' B' ' 337' ' ' ARG . 0.0 OUTLIER -59.83 -26.55 65.88 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.067 -1.021 . . . . 2.93 109.818 -179.559 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' B' B ' 338' ' ' PHE . . . . . 0.527 ' HA ' HG21 ' B' ' 332' ' ' ILE . 50.5 t80 -55.41 -58.85 6.06 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.11 -0.993 . . . . 0.37 109.692 -179.858 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' B' B ' 339' ' ' GLU . . . . . . . . . . . . . 56.8 mt-10 -50.62 -32.7 19.7 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.348 -0.845 . . . . 1.98 110.045 -179.666 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' B' B ' 340' ' ' MET . . . . . . . . . . . . . 23.9 ttp -63.79 -51.12 66.23 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.126 -0.983 . . . . 0.32 110.013 -179.54 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' B' B ' 341' ' ' PHE . . . . . 0.426 ' HB2' HD13 ' B' ' 332' ' ' ILE . 36.4 m-85 -62.09 -45.84 91.72 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.169 -0.957 . . . . 0.18 109.988 -179.569 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' B' B ' 342' ' ' ARG . . . . . 0.458 ' NH1' ' HG3' ' B' ' 342' ' ' ARG . 0.0 OUTLIER -49.59 -42.67 45.17 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.127 -0.983 . . . . 2.42 110.065 -179.578 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' B' B ' 343' ' ' GLU . . . . . . . . . . . . . 1.6 tt0 -58.61 -47.95 82.64 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.072 -1.017 . . . . 2.35 109.856 -179.575 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' B' B ' 344' ' ' LEU . . . . . 0.592 HD22 ' CD2' ' A' ' 344' ' ' LEU . 50.4 mt -61.32 -33.24 73.28 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.155 -0.966 . . . . 0.18 109.544 -179.848 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' B' B ' 345' ' ' ASN . . . . . . . . . . . . . 21.5 t-20 -57.93 -59.28 5.5 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.225 -0.922 . . . . 1.09 109.731 -179.952 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' B' B ' 346' ' ' GLU . . . . . . . . . . . . . 71.8 tt0 -62.05 -28.53 69.66 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.267 -0.896 . . . . 1.66 110.076 -179.605 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' B' B ' 347' ' ' ALA . . . . . 0.769 ' HB1' ' HB1' ' A' ' 347' ' ' ALA . . . -60.42 -56.94 15.38 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.09 -1.006 . . . . 0.17 109.992 -179.567 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' B' B ' 348' ' ' LEU . . . . . 0.53 HD22 ' N ' ' B' ' 348' ' ' LEU . 4.0 mm? -61.95 -46.64 88.41 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.179 -0.95 . . . . 0.29 110.131 -179.491 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' B' B ' 349' ' ' GLU . . . . . . . . . . . . . 32.7 mm-40 -56.98 -33.26 66.93 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.133 -0.979 . . . . 1.95 110.092 -179.469 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' B' B ' 350' ' ' LEU . . . . . 0.782 HD22 HD13 ' A' ' 350' ' ' LEU . 5.8 tt -64.65 -48.42 74.86 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.17 -0.956 . . . . 0.45 109.48 -179.919 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' B' B ' 351' ' ' LYS . . . . . . . . . . . . . 22.2 tttm -58.27 -39.33 78.97 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.349 -0.844 . . . . 1.38 109.359 -179.907 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' B' B ' 352' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -58.01 -52.47 65.38 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.313 -0.867 . . . . 1.16 109.88 -179.984 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' B' B ' 353' ' ' ALA . . . . . . . . . . . . . . . -66.55 -9.94 40.09 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.298 -0.877 . . . . 0.61 109.847 -179.56 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' B' B ' 354' ' ' GLN . . . . . . . . . . . . . 2.5 tt0 -84.14 -53.9 5.2 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.125 -0.984 . . . . 1.45 109.621 179.955 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' B' B ' 355' ' ' ALA . . . . . . . . . . . . . . . -70.87 -8.83 55.56 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.301 -0.874 . . . . 0.98 109.777 -179.68 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' B' B ' 356' ' ' GLY . . . . . . . . . . . . . . . -81.17 -22.86 60.09 Favored Glycine 0 N--CA 1.49 2.291 0 N-CA-C 109.505 -1.438 . . . . 1.29 109.505 179.968 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' B' B ' 357' ' ' LYS . . . . . . . . . . . . . 15.3 mtpp -89.84 143.16 27.03 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.316 -1.108 . . . . 4.09 109.493 179.88 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' B' B ' 358' ' ' GLU . . . . . 0.461 ' HG2' ' HD2' ' B' ' 359' ' ' PRO . 2.4 tt0 -49.44 143.91 9.56 Favored Pre-proline 0 N--CA 1.491 1.589 0 O-C-N 121.246 -0.909 . . . . 5.72 109.356 179.997 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' B' B ' 359' ' ' PRO . . . . . 0.461 ' HD2' ' HG2' ' B' ' 358' ' ' GLU . 2.3 Cg_endo -62.65 -164.62 0.04 OUTLIER 'Trans proline' 0 C--N 1.31 -1.471 0 C-N-CA 122.144 1.896 . . . . 4.98 110.168 -179.919 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' B' B ' 360' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.359 0 CA-C-O 118.009 -1.439 . . . . 6.98 109.618 179.974 . . . . . . . . 0 0 . 1 . 024 nuclear nobuild full ' C' C ' 319' ' ' LYS . . . . . 0.466 ' O ' ' O ' ' C' ' 320' ' ' LYS . 0.1 OUTLIER . . . . . 0 N--CA 1.49 1.57 0 N-CA-C 109.47 -0.567 . . . . 6.82 109.47 . . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' C' C ' 320' ' ' LYS . . . . . 0.466 ' O ' ' O ' ' C' ' 319' ' ' LYS . 1.9 tptt 59.21 152.63 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.241 -0.912 . . . . 6.49 109.273 -179.965 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' C' C ' 321' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -158.58 84.7 2.51 Favored Pre-proline 0 N--CA 1.49 1.566 0 O-C-N 121.207 -0.933 . . . . 6.4 109.678 -179.84 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' C' C ' 322' ' ' PRO . . . . . . . . . . . . . 2.0 Cg_endo -68.46 -1.03 6.66 Favored 'Trans proline' 0 C--N 1.309 -1.52 0 C-N-CA 122.259 1.973 . . . . 3.42 110.729 179.817 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' C' C ' 323' ' ' LEU . . . . . 0.447 ' HA ' HD23 ' C' ' 323' ' ' LEU . 56.3 mt -79.97 91.99 5.5 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 120.984 -1.072 . . . . 3.95 109.336 179.989 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' C' C ' 324' ' ' ASP . . . . . 0.456 ' HB3' ' CE1' ' C' ' 327' ' ' TYR . 3.8 m-20 -82.3 125.08 30.57 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.215 -0.928 . . . . 1.63 109.614 179.999 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' C' C ' 325' ' ' GLY . . . . . 0.554 ' O ' ' CD1' ' C' ' 327' ' ' TYR . . . -70.07 -168.22 6.77 Favored Glycine 0 N--CA 1.491 2.311 0 N-CA-C 109.565 -1.414 . . . . 0.73 109.565 179.965 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' C' C ' 326' ' ' GLU . . . . . 0.421 ' O ' ' CD1' ' C' ' 327' ' ' TYR . 30.6 mm-40 -59.17 171.68 0.7 Allowed 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.212 -1.169 . . . . 2.17 109.402 179.923 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' C' C ' 327' ' ' TYR . . . . . 0.596 ' CE2' ' HG2' ' A' ' 333' ' ' ARG . 44.1 m-85 -149.36 114.31 5.41 Favored 'General case' 0 N--CA 1.488 1.437 0 O-C-N 121.254 -0.904 . . . . 0.48 109.819 -179.878 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' C' C ' 328' ' ' PHE . . . . . 0.44 ' CE2' ' HA ' ' A' ' 335' ' ' ARG . 86.5 m-85 -113.27 -173.54 2.28 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.316 -0.865 . . . . 0.33 109.132 179.595 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' C' C ' 329' ' ' THR . . . . . . . . . . . . . 22.6 p -152.38 165.2 35.74 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.12 -0.987 . . . . 0.23 109.664 -179.851 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' C' C ' 330' ' ' LEU . . . . . . . . . . . . . 14.4 tp -151.32 129.23 11.7 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.339 -0.851 . . . . 0.28 109.508 -179.853 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' C' C ' 331' ' ' GLN . . . . . 0.417 ' OE1' ' HB3' ' A' ' 327' ' ' TYR . 0.0 OUTLIER -89.13 116.56 27.48 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.174 -0.954 . . . . 1.48 109.837 -179.971 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' C' C ' 332' ' ' ILE . . . . . 0.431 HD13 ' CD2' ' C' ' 341' ' ' PHE . 87.6 mt -104.06 112.36 37.3 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.621 0 O-C-N 121.201 -0.937 . . . . 0.24 109.555 179.661 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' C' C ' 333' ' ' ARG . . . . . 0.525 ' HG2' ' CE1' ' A' ' 327' ' ' TYR . 46.2 mtt180 -72.02 144.04 48.94 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.12 -0.988 . . . . 2.74 109.321 179.711 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' C' C ' 334' ' ' GLY . . . . . . . . . . . . . . . 89.15 128.34 3.27 Favored Glycine 0 N--CA 1.492 2.385 0 N-CA-C 109.48 -1.448 . . . . 0.35 109.48 -179.846 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' C' C ' 335' ' ' ARG . . . . . 0.504 ' HA ' ' CE1' ' A' ' 328' ' ' PHE . 37.1 ttp180 -78.98 -35.59 42.75 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.19 -1.183 . . . . 2.53 109.676 -179.88 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' C' C ' 336' ' ' GLU . . . . . . . . . . . . . 2.0 tt0 -57.0 -60.4 3.64 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.247 -0.908 . . . . 2.62 109.678 -179.808 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' C' C ' 337' ' ' ARG . . . . . 0.45 ' CG ' HH11 ' C' ' 337' ' ' ARG . 0.0 OUTLIER -59.51 -28.31 66.94 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.308 -0.87 . . . . 2.81 109.553 -179.811 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' C' C ' 338' ' ' PHE . . . . . 0.467 ' HB3' ' O ' ' C' ' 335' ' ' ARG . 58.1 t80 -54.07 -55.37 28.14 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.249 -0.907 . . . . 0.4 109.352 -179.962 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' C' C ' 339' ' ' GLU . . . . . . . . . . . . . 41.5 mt-10 -52.42 -32.08 37.46 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.242 -0.911 . . . . 2.05 109.755 -179.997 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' C' C ' 340' ' ' MET . . . . . 0.436 ' HB3' ' O ' ' C' ' 337' ' ' ARG . 3.8 ttp -63.92 -55.03 25.62 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.227 -0.921 . . . . 0.32 110.285 -179.402 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' C' C ' 341' ' ' PHE . . . . . 0.431 ' CD2' HD13 ' C' ' 332' ' ' ILE . 48.5 m-85 -61.0 -46.16 91.9 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.167 -0.958 . . . . 0.18 109.701 -179.448 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' C' C ' 342' ' ' ARG . . . . . 0.404 ' CG ' HH11 ' C' ' 342' ' ' ARG . 0.2 OUTLIER -47.72 -41.47 22.96 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.287 -0.883 . . . . 2.91 109.278 179.761 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' C' C ' 343' ' ' GLU . . . . . . . . . . . . . 43.3 tt0 -61.17 -48.74 80.18 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.245 -0.909 . . . . 2.14 109.951 -179.869 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' C' C ' 344' ' ' LEU . . . . . . . . . . . . . 35.4 mt -60.88 -30.14 69.97 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.135 -0.978 . . . . 0.22 109.828 -179.517 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' C' C ' 345' ' ' ASN . . . . . . . . . . . . . 25.8 t-20 -57.77 -58.31 8.91 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.261 -0.9 . . . . 1.08 109.488 179.879 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' C' C ' 346' ' ' GLU . . . . . 0.434 ' O ' ' HB2' ' C' ' 350' ' ' LEU . 20.1 tt0 -61.67 -25.63 67.51 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.301 -0.875 . . . . 2.21 109.922 -179.71 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' C' C ' 347' ' ' ALA . . . . . 0.469 ' O ' ' HB3' ' C' ' 350' ' ' LEU . . . -62.41 -55.62 26.07 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.106 -0.996 . . . . 0.18 109.715 -179.815 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' C' C ' 348' ' ' LEU . . . . . 0.622 HD22 ' N ' ' C' ' 348' ' ' LEU . 4.1 mm? -63.19 -55.91 21.11 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.131 -0.981 . . . . 0.32 109.969 -179.557 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' C' C ' 349' ' ' GLU . . . . . 0.426 ' OE2' ' HD3' ' A' ' 333' ' ' ARG . 41.6 mt-10 -56.61 -25.89 54.23 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.103 -0.998 . . . . 2.19 109.24 -179.782 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' C' C ' 350' ' ' LEU . . . . . 1.132 HD11 HD22 ' D' ' 350' ' ' LEU . 0.5 OUTLIER -65.62 -49.45 68.66 Favored 'General case' 0 C--N 1.301 -1.516 0 N-CA-C 108.811 -0.811 . . . . 0.46 108.811 179.813 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' C' C ' 351' ' ' LYS . . . . . 0.546 ' N ' HD13 ' C' ' 350' ' ' LEU . 6.3 tttt -62.27 -41.95 98.92 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.291 -0.881 . . . . 1.35 109.298 179.319 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' C' C ' 352' ' ' ASP . . . . . . . . . . . . . 43.3 m-20 -56.06 -28.19 56.56 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.341 -0.849 . . . . 1.19 109.836 -179.867 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' C' C ' 353' ' ' ALA . . . . . . . . . . . . . . . -66.33 -46.52 76.57 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.227 -0.92 . . . . 0.57 109.78 -179.645 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' C' C ' 354' ' ' GLN . . . . . 0.497 ' NE2' ' HA ' ' C' ' 351' ' ' LYS . 0.0 OUTLIER -82.84 14.43 3.25 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.205 -0.934 . . . . 1.47 109.989 -179.773 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' C' C ' 355' ' ' ALA . . . . . . . . . . . . . . . -69.07 -72.71 0.17 Allowed 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.106 -0.996 . . . . 0.93 109.962 -179.813 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' C' C ' 356' ' ' GLY . . . . . . . . . . . . . . . -81.88 58.69 4.91 Favored Glycine 0 N--CA 1.494 2.53 0 N-CA-C 110.442 -1.063 . . . . 1.33 110.442 -179.624 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' C' C ' 357' ' ' LYS . . . . . . . . . . . . . 9.2 pttt -88.45 152.24 22.02 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 120.94 -1.33 . . . . 4.01 109.491 179.787 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' C' C ' 358' ' ' GLU . . . . . . . . . . . . . 2.1 mt-10 -50.54 148.77 6.43 Favored Pre-proline 0 N--CA 1.491 1.624 0 O-C-N 121.163 -0.961 . . . . 5.75 109.58 179.9 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' C' C ' 359' ' ' PRO . . . . . . . . . . . . . 1.4 Cg_endo -64.62 119.5 6.55 Favored 'Trans proline' 0 C--N 1.31 -1.47 0 C-N-CA 122.237 1.958 . . . . 4.94 110.14 179.927 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' C' C ' 360' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.255 0 CA-C-O 117.985 -1.453 . . . . 6.5 109.544 179.945 . . . . . . . . 0 0 . 1 . 024 nuclear nobuild full ' D' D ' 319' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 N--CA 1.491 1.577 0 CA-C-O 121.322 0.582 . . . . 7.53 109.465 . . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' D' D ' 320' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 62.87 116.06 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.202 -0.936 . . . . 6.41 109.628 -179.994 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' D' D ' 321' ' ' LYS . . . . . . . . . . . . . 8.3 mttt -81.67 144.06 51.84 Favored Pre-proline 0 N--CA 1.49 1.56 0 O-C-N 121.175 -0.953 . . . . 6.11 109.149 179.769 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' D' D ' 322' ' ' PRO . . . . . . . . . . . . . 2.1 Cg_endo -62.04 -81.67 0.01 OUTLIER 'Trans proline' 0 C--N 1.31 -1.484 0 C-N-CA 122.059 1.84 . . . . 2.82 110.484 -179.643 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' D' D ' 323' ' ' LEU . . . . . . . . . . . . . 46.4 mt -82.69 104.95 13.32 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.15 -0.969 . . . . 2.83 109.913 -179.747 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' D' D ' 324' ' ' ASP . . . . . . . . . . . . . 8.3 m-20 -81.76 -154.71 0.12 Allowed 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.317 -0.864 . . . . 1.54 109.483 179.807 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' D' D ' 325' ' ' GLY . . . . . . . . . . . . . . . -69.96 -167.99 6.49 Favored Glycine 0 N--CA 1.491 2.306 0 N-CA-C 109.733 -1.347 . . . . 0.59 109.733 -179.971 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' D' D ' 326' ' ' GLU . . . . . . . . . . . . . 2.2 mm-40 -59.21 -173.98 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.383 -1.069 . . . . 2.13 109.551 -179.945 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' D' D ' 327' ' ' TYR . . . . . 0.545 ' CE1' ' HG2' ' B' ' 333' ' ' ARG . 43.0 m-85 -149.71 112.34 4.76 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.367 -0.833 . . . . 0.47 109.74 179.936 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' D' D ' 328' ' ' PHE . . . . . 0.404 ' O ' HG23 ' D' ' 329' ' ' THR . 71.8 m-85 -113.94 -168.68 1.39 Allowed 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.277 -0.889 . . . . 0.3 109.201 179.737 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' D' D ' 329' ' ' THR . . . . . 0.404 HG23 ' O ' ' D' ' 328' ' ' PHE . 39.5 p -154.59 167.34 30.43 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.19 -0.944 . . . . 0.22 109.41 179.987 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' D' D ' 330' ' ' LEU . . . . . . . . . . . . . 24.6 tp -150.24 131.36 14.43 Favored 'General case' 0 N--CA 1.488 1.472 0 O-C-N 121.239 -0.913 . . . . 0.28 109.512 -179.878 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' D' D ' 331' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -87.13 111.85 21.35 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.351 -0.843 . . . . 0.93 109.434 179.971 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' D' D ' 332' ' ' ILE . . . . . 0.545 HG21 ' HA ' ' D' ' 338' ' ' PHE . 97.0 mt -103.46 103.8 15.7 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.533 0 O-C-N 121.145 -0.972 . . . . 0.25 109.708 179.994 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' D' D ' 333' ' ' ARG . . . . . 0.597 ' HG2' ' CE1' ' B' ' 327' ' ' TYR . 13.2 mtp180 -72.57 150.11 43.42 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.256 -0.903 . . . . 2.93 109.458 179.887 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' D' D ' 334' ' ' GLY . . . . . . . . . . . . . . . 86.31 130.94 2.8 Favored Glycine 0 N--CA 1.491 2.333 0 N-CA-C 109.815 -1.314 . . . . 0.41 109.815 179.723 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' D' D ' 335' ' ' ARG . . . . . 0.463 ' HA ' ' CE1' ' B' ' 328' ' ' PHE . 0.0 OUTLIER -80.28 -38.94 29.83 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.308 -1.113 . . . . 3.03 109.575 179.883 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' D' D ' 336' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -58.08 -61.79 2.29 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.241 -0.912 . . . . 2.26 110.031 -179.597 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' D' D ' 337' ' ' ARG . . . . . 0.474 ' NH1' ' HG2' ' D' ' 337' ' ' ARG . 0.0 OUTLIER -59.86 -26.38 65.79 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.175 -0.953 . . . . 2.92 109.862 -179.579 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' D' D ' 338' ' ' PHE . . . . . 0.545 ' HA ' HG21 ' D' ' 332' ' ' ILE . 51.0 t80 -55.58 -58.7 6.71 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.195 -0.941 . . . . 0.37 109.725 -179.869 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' D' D ' 339' ' ' GLU . . . . . . . . . . . . . 55.6 mt-10 -50.63 -32.7 19.72 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.301 -0.874 . . . . 1.99 110.067 -179.711 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' D' D ' 340' ' ' MET . . . . . . . . . . . . . 23.2 ttp -63.78 -51.18 65.99 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.181 -0.95 . . . . 0.31 110.008 -179.62 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' D' D ' 341' ' ' PHE . . . . . 0.449 ' HB2' HD13 ' D' ' 332' ' ' ILE . 36.6 m-85 -62.01 -45.88 91.66 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.224 -0.922 . . . . 0.18 110.064 -179.55 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' D' D ' 342' ' ' ARG . . . . . 0.461 ' NH1' ' HG3' ' D' ' 342' ' ' ARG . 0.0 OUTLIER -49.58 -42.42 44.39 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.086 -1.009 . . . . 2.41 110.094 -179.513 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' D' D ' 343' ' ' GLU . . . . . . . . . . . . . 1.6 tt0 -58.81 -47.69 83.93 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.018 -1.051 . . . . 2.35 109.886 -179.538 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' D' D ' 344' ' ' LEU . . . . . . . . . . . . . 49.5 mt -61.59 -33.13 73.35 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.106 -0.996 . . . . 0.19 109.435 -179.776 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' D' D ' 345' ' ' ASN . . . . . . . . . . . . . 21.7 t-20 -58.03 -59.14 5.73 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.299 -0.875 . . . . 1.09 109.716 -179.851 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' D' D ' 346' ' ' GLU . . . . . . . . . . . . . 72.1 tt0 -62.11 -28.61 69.75 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.337 -0.852 . . . . 1.69 110.059 -179.641 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' D' D ' 347' ' ' ALA . . . . . . . . . . . . . . . -60.24 -57.05 14.45 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.084 -1.01 . . . . 0.18 110.063 -179.641 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' D' D ' 348' ' ' LEU . . . . . 0.533 HD22 ' N ' ' D' ' 348' ' ' LEU . 4.0 mm? -61.92 -46.59 88.69 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.246 -0.909 . . . . 0.31 110.106 -179.426 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' D' D ' 349' ' ' GLU . . . . . . . . . . . . . 33.6 mm-40 -56.97 -33.41 67.06 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.187 -0.946 . . . . 1.95 109.964 -179.397 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' D' D ' 350' ' ' LEU . . . . . 1.132 HD22 HD11 ' C' ' 350' ' ' LEU . 5.8 tt -64.64 -48.19 75.74 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.15 -0.969 . . . . 0.43 109.666 -179.921 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' D' D ' 351' ' ' LYS . . . . . . . . . . . . . 22.3 tttm -58.43 -39.49 79.94 Favored 'General case' 0 N--CA 1.487 1.414 0 O-C-N 121.24 -0.913 . . . . 1.4 109.349 -179.874 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' D' D ' 352' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -57.97 -52.39 65.72 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.28 -0.887 . . . . 1.17 109.829 179.929 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' D' D ' 353' ' ' ALA . . . . . . . . . . . . . . . -66.58 -9.93 40.33 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.21 -0.931 . . . . 0.59 109.783 -179.483 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' D' D ' 354' ' ' GLN . . . . . . . . . . . . . 2.5 tt0 -84.2 -53.97 5.13 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.134 -0.979 . . . . 1.44 109.613 179.996 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' D' D ' 355' ' ' ALA . . . . . . . . . . . . . . . -70.81 -8.77 54.89 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.22 -0.925 . . . . 0.98 109.85 -179.676 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' D' D ' 356' ' ' GLY . . . . . . . . . . . . . . . -81.11 -23.01 59.89 Favored Glycine 0 N--CA 1.491 2.305 0 N-CA-C 109.477 -1.449 . . . . 1.28 109.477 179.807 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' D' D ' 357' ' ' LYS . . . . . . . . . . . . . 15.2 mtpp -89.47 143.21 27.0 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.328 -1.101 . . . . 4.09 109.504 179.85 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' D' D ' 358' ' ' GLU . . . . . 0.475 ' HG2' ' HD2' ' D' ' 359' ' ' PRO . 2.4 tt0 -49.73 144.07 10.31 Favored Pre-proline 0 N--CA 1.489 1.517 0 O-C-N 121.153 -0.967 . . . . 5.71 109.331 -179.996 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' D' D ' 359' ' ' PRO . . . . . 0.475 ' HD2' ' HG2' ' D' ' 358' ' ' GLU . 2.3 Cg_endo -62.53 -164.83 0.04 OUTLIER 'Trans proline' 0 C--N 1.31 -1.491 0 C-N-CA 122.07 1.846 . . . . 4.97 110.23 -179.948 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' D' D ' 360' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.322 0 N-CA-C 109.458 -1.457 . . . . 6.97 109.458 179.929 . . . . . . . . 0 0 . 1 . 025 nuclear nobuild full ' A' A ' 319' ' ' LYS . . . . . . . . . . . . . 9.9 mtmt . . . . . 0 N--CA 1.491 1.601 0 N-CA-C 109.418 -0.586 . . . . 7.55 109.418 . . . . . . . . . 0 0 . 1 . 025 nuclear nobuild full ' A' A ' 320' ' ' LYS . . . . . 0.469 ' O ' ' HD3' ' A' ' 322' ' ' PRO . 6.8 mttt 57.69 45.55 18.81 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.32 -0.862 . . . . 6.43 109.264 -179.932 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 321' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -82.11 114.26 49.57 Favored Pre-proline 0 N--CA 1.492 1.625 0 O-C-N 121.413 -0.805 . . . . 6.13 109.438 -179.882 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 322' ' ' PRO . . . . . 0.469 ' HD3' ' O ' ' A' ' 320' ' ' LYS . 1.9 Cg_endo -68.2 -4.84 13.46 Favored 'Trans proline' 0 C--N 1.313 -1.293 0 C-N-CA 121.83 1.686 . . . . 2.83 110.389 -179.819 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 323' ' ' LEU . . . . . . . . . . . . . 16.7 mt -84.87 46.69 1.29 Allowed 'General case' 0 N--CA 1.488 1.452 0 O-C-N 121.091 -1.006 . . . . 2.83 109.663 179.923 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 324' ' ' ASP . . . . . . . . . . . . . 19.4 m-20 -79.86 140.66 36.7 Favored 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.034 -1.041 . . . . 1.53 109.182 179.927 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 325' ' ' GLY . . . . . . . . . . . . . . . -67.96 179.99 17.31 Favored Glycine 0 N--CA 1.489 2.203 0 N-CA-C 109.475 -1.45 . . . . 0.61 109.475 -179.811 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 326' ' ' GLU . . . . . . . . . . . . . 3.0 mm-40 -57.72 179.61 0.06 Allowed 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.155 -1.203 . . . . 2.13 109.371 -179.938 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 327' ' ' TYR . . . . . 0.417 ' CE1' ' HG2' ' C' ' 333' ' ' ARG . 48.4 m-85 -148.92 106.28 3.63 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.163 -0.96 . . . . 0.48 109.629 -179.919 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 328' ' ' PHE . . . . . . . . . . . . . 68.6 m-85 -112.97 -164.08 0.89 Allowed 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.23 -0.919 . . . . 0.31 109.55 179.834 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 329' ' ' THR . . . . . . . . . . . . . 20.9 p -153.83 173.96 15.21 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.228 -0.92 . . . . 0.22 109.227 179.833 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 330' ' ' LEU . . . . . 0.447 HD21 HD22 ' C' ' 345' ' ' ASN . 28.8 tp -152.16 131.95 13.25 Favored 'General case' 0 N--CA 1.489 1.476 0 O-C-N 120.94 -1.1 . . . . 0.28 109.833 -179.891 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 331' ' ' GLN . . . . . 0.402 ' NE2' ' O ' ' C' ' 328' ' ' PHE . 45.4 tp60 -88.97 107.34 18.97 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.354 -0.841 . . . . 0.91 109.192 179.533 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 332' ' ' ILE . . . . . . . . . . . . . 36.9 mt -103.3 107.21 21.64 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.624 0 O-C-N 121.112 -0.993 . . . . 0.26 109.778 -179.792 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 333' ' ' ARG . . . . . 0.601 ' HG2' ' CE2' ' C' ' 327' ' ' TYR . 0.0 OUTLIER -73.45 155.88 38.82 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.39 -0.819 . . . . 2.92 109.393 179.702 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild full ' A' A ' 334' ' ' GLY . . . . . . . . . . . . . . . 77.13 128.23 0.35 Allowed Glycine 0 N--CA 1.492 2.433 0 N-CA-C 109.898 -1.281 . . . . 0.4 109.898 179.584 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 335' ' ' ARG . . . . . 0.56 ' HG3' ' CE2' ' C' ' 328' ' ' PHE . 1.7 ttt-85 -80.0 -36.1 36.44 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.371 -1.076 . . . . 3.01 109.543 179.862 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 336' ' ' GLU . . . . . . . . . . . . . 2.2 tm-20 -56.22 -64.84 0.73 Allowed 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.27 -0.893 . . . . 2.29 109.723 -179.84 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 337' ' ' ARG . . . . . 0.714 ' HE ' HD12 ' C' ' 348' ' ' LEU . 0.0 OUTLIER -60.78 -28.9 69.09 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.339 -0.851 . . . . 2.93 109.542 -179.675 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild full ' A' A ' 338' ' ' PHE . . . . . . . . . . . . . 52.3 t80 -55.52 -60.17 3.8 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.163 -0.96 . . . . 0.38 109.462 -179.925 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 339' ' ' GLU . . . . . . . . . . . . . 65.0 mm-40 -51.24 -30.09 16.45 Favored 'General case' 0 N--CA 1.488 1.456 0 O-C-N 121.357 -0.839 . . . . 1.97 109.757 -179.903 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 340' ' ' MET . . . . . 0.432 ' HB3' ' O ' ' A' ' 337' ' ' ARG . 7.6 ttp -64.19 -50.45 68.03 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.175 -0.953 . . . . 0.31 109.575 -179.95 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 341' ' ' PHE . . . . . . . . . . . . . 45.5 m-85 -63.0 -45.7 91.14 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.33 -0.856 . . . . 0.18 109.981 -179.703 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 342' ' ' ARG . . . . . . . . . . . . . 5.4 ttm180 -49.29 -40.99 36.82 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.122 -0.986 . . . . 2.42 109.915 -179.535 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 343' ' ' GLU . . . . . . . . . . . . . 1.4 tt0 -58.71 -43.78 90.18 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.145 -0.972 . . . . 2.35 109.806 -179.714 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 344' ' ' LEU . . . . . 0.762 HD22 HD22 ' B' ' 344' ' ' LEU . 42.9 mt -63.28 -46.15 88.17 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.239 -0.913 . . . . 0.18 109.876 -179.749 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 345' ' ' ASN . . . . . 0.674 HD22 HD11 ' C' ' 330' ' ' LEU . 42.3 t-20 -55.61 -46.95 77.27 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.115 -0.991 . . . . 1.09 109.923 -179.481 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 346' ' ' GLU . . . . . . . . . . . . . 1.4 tp10 -60.72 -36.39 78.72 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.179 -0.951 . . . . 1.65 109.776 -179.66 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 347' ' ' ALA . . . . . 1.04 ' HB1' ' HB1' ' B' ' 347' ' ' ALA . . . -59.4 -51.1 71.37 Favored 'General case' 0 N--CA 1.493 1.692 0 O-C-N 121.222 -0.924 . . . . 0.18 109.944 -179.712 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 348' ' ' LEU . . . . . 0.597 HD22 ' N ' ' A' ' 348' ' ' LEU . 4.1 mm? -61.78 -43.86 98.01 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.237 -0.914 . . . . 0.3 109.658 -179.721 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 349' ' ' GLU . . . . . . . . . . . . . 2.2 mm-40 -59.17 -34.16 71.77 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.199 -0.938 . . . . 1.94 110.244 -179.551 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 350' ' ' LEU . . . . . 0.604 HD22 HD13 ' B' ' 350' ' ' LEU . 6.7 tt -63.12 -43.72 97.63 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.074 -1.016 . . . . 0.46 109.465 -179.773 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 351' ' ' LYS . . . . . . . . . . . . . 25.5 tttm -56.67 -42.73 79.51 Favored 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.22 -0.925 . . . . 1.4 109.861 -179.679 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 352' ' ' ASP . . . . . . . . . . . . . 36.2 m-20 -58.69 -49.92 75.78 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.186 -0.946 . . . . 1.16 109.817 179.974 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 353' ' ' ALA . . . . . . . . . . . . . . . -67.65 -10.27 50.73 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.27 -0.894 . . . . 0.63 109.534 -179.776 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 354' ' ' GLN . . . . . 0.6 ' NE2' HD11 ' B' ' 350' ' ' LEU . 2.9 tt0 -84.72 -59.07 2.47 Favored 'General case' 0 C--N 1.302 -1.473 0 O-C-N 121.25 -0.906 . . . . 1.47 109.767 -179.917 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 355' ' ' ALA . . . . . . . . . . . . . . . -70.0 -4.22 19.83 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.327 -0.858 . . . . 1.01 110.152 -179.534 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 356' ' ' GLY . . . . . . . . . . . . . . . -79.64 -10.78 85.44 Favored Glycine 0 N--CA 1.492 2.399 0 N-CA-C 109.362 -1.495 . . . . 1.3 109.362 179.866 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 357' ' ' LYS . . . . . . . . . . . . . 51.9 mttt -88.49 170.76 10.61 Favored 'General case' 0 N--CA 1.487 1.411 0 O-C-N 121.279 -1.13 . . . . 4.1 109.372 179.735 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 358' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -48.74 150.99 2.27 Favored Pre-proline 0 N--CA 1.491 1.579 0 O-C-N 121.26 -0.9 . . . . 5.75 109.254 179.961 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 359' ' ' PRO . . . . . . . . . . . . . 5.3 Cg_exo -58.95 -159.9 0.02 OUTLIER 'Trans proline' 0 C--N 1.309 -1.525 0 C-N-CA 122.05 1.833 . . . . 5.0 110.164 -179.958 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 360' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.194 0 CA-C-O 117.972 -1.46 . . . . 6.97 109.551 -179.94 . . . . . . . . 0 0 . 1 . 025 nuclear nobuild full ' B' B ' 319' ' ' LYS . . . . . . . . . . . . . 10.0 mtmt . . . . . 0 N--CA 1.489 1.516 0 N-CA-C 109.485 -0.561 . . . . 7.55 109.485 . . . . . . . . . 0 0 . 1 . 025 nuclear nobuild full ' B' B ' 320' ' ' LYS . . . . . 0.464 ' O ' ' HD3' ' B' ' 322' ' ' PRO . 6.2 mttt 57.86 45.14 18.92 Favored 'General case' 0 N--CA 1.489 1.501 0 O-C-N 121.259 -0.901 . . . . 6.44 109.233 179.907 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' B' B ' 321' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -81.79 114.24 48.75 Favored Pre-proline 0 N--CA 1.491 1.603 0 O-C-N 121.39 -0.819 . . . . 6.13 109.437 -179.952 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' B' B ' 322' ' ' PRO . . . . . 0.464 ' HD3' ' O ' ' B' ' 320' ' ' LYS . 1.8 Cg_endo -68.34 -4.62 13.19 Favored 'Trans proline' 0 C--N 1.313 -1.293 0 C-N-CA 121.938 1.759 . . . . 2.82 110.534 -179.924 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' B' B ' 323' ' ' LEU . . . . . . . . . . . . . 17.0 mt -85.05 45.64 1.19 Allowed 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.215 -0.928 . . . . 2.84 109.739 -179.834 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 324' ' ' ASP . . . . . . . . . . . . . 20.1 m-20 -79.28 139.2 37.92 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.16 -0.963 . . . . 1.53 109.548 179.998 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 325' ' ' GLY . . . . . . . . . . . . . . . -66.12 179.72 10.9 Favored Glycine 0 N--CA 1.49 2.254 0 N-CA-C 109.476 -1.449 . . . . 0.59 109.476 179.99 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 326' ' ' GLU . . . . . . . . . . . . . 3.0 mm-40 -58.1 179.5 0.07 Allowed 'General case' 0 N--CA 1.488 1.452 0 O-C-N 121.259 -1.142 . . . . 2.13 109.349 179.952 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 327' ' ' TYR . . . . . 0.59 ' CE1' ' HG2' ' D' ' 333' ' ' ARG . 47.6 m-85 -148.55 106.16 3.67 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.224 -0.923 . . . . 0.48 109.633 -179.841 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' B' B ' 328' ' ' PHE . . . . . 0.416 ' CZ ' ' HG3' ' D' ' 335' ' ' ARG . 66.7 m-85 -113.22 -164.5 0.92 Allowed 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.287 -0.883 . . . . 0.32 109.546 179.797 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' B' B ' 329' ' ' THR . . . . . . . . . . . . . 20.8 p -153.4 174.41 14.39 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.297 -0.877 . . . . 0.23 109.276 -179.956 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 330' ' ' LEU . . . . . . . . . . . . . 28.3 tp -152.75 131.53 12.41 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.062 -1.024 . . . . 0.28 109.917 -179.826 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 331' ' ' GLN . . . . . 0.43 ' NE2' ' O ' ' D' ' 328' ' ' PHE . 45.8 tp60 -88.81 107.91 19.23 Favored 'General case' 0 N--CA 1.489 1.48 0 O-C-N 121.33 -0.857 . . . . 0.91 109.135 179.507 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' B' B ' 332' ' ' ILE . . . . . . . . . . . . . 35.2 mt -103.84 107.15 21.62 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.584 0 O-C-N 121.136 -0.977 . . . . 0.24 109.618 -179.728 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 333' ' ' ARG . . . . . 0.529 ' HG2' ' CE1' ' D' ' 327' ' ' TYR . 0.0 OUTLIER -73.66 155.05 39.42 Favored 'General case' 0 N--CA 1.488 1.46 0 O-C-N 121.293 -0.879 . . . . 2.93 109.347 179.695 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild full ' B' B ' 334' ' ' GLY . . . . . . . . . . . . . . . 78.05 128.39 0.45 Allowed Glycine 0 N--CA 1.492 2.369 0 N-CA-C 109.965 -1.254 . . . . 0.4 109.965 179.702 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 335' ' ' ARG . . . . . 0.499 ' HG2' ' NH1' ' B' ' 335' ' ' ARG . 1.7 ttt-85 -80.01 -35.8 36.83 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.308 -1.113 . . . . 3.01 109.467 179.845 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' B' B ' 336' ' ' GLU . . . . . . . . . . . . . 2.3 tm-20 -56.49 -65.43 0.61 Allowed 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.333 -0.854 . . . . 2.28 109.725 -179.699 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 337' ' ' ARG . . . . . 0.582 ' HE ' HD12 ' D' ' 348' ' ' LEU . 0.0 OUTLIER -60.18 -29.25 68.57 Favored 'General case' 0 N--CA 1.488 1.463 0 O-C-N 121.283 -0.886 . . . . 2.93 109.647 -179.789 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild full ' B' B ' 338' ' ' PHE . . . . . . . . . . . . . 53.1 t80 -55.03 -59.83 4.2 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.243 -0.911 . . . . 0.37 109.542 -179.949 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 339' ' ' GLU . . . . . . . . . . . . . 62.4 mm-40 -51.6 -30.08 19.8 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.34 -0.85 . . . . 1.98 109.71 -179.963 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 340' ' ' MET . . . . . 0.44 ' HB3' ' O ' ' B' ' 337' ' ' ARG . 7.0 ttp -64.16 -50.91 66.32 Favored 'General case' 0 N--CA 1.489 1.499 0 O-C-N 121.192 -0.942 . . . . 0.32 109.592 -179.732 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' B' B ' 341' ' ' PHE . . . . . . . . . . . . . 47.0 m-85 -62.46 -46.24 89.41 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.231 -0.918 . . . . 0.18 109.939 -179.822 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 342' ' ' ARG . . . . . . . . . . . . . 5.4 ttm180 -48.98 -41.04 32.91 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.182 -0.949 . . . . 2.42 109.9 -179.437 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 343' ' ' GLU . . . . . . . . . . . . . 1.4 tt0 -58.91 -43.92 91.15 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.171 -0.956 . . . . 2.35 109.673 -179.641 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 344' ' ' LEU . . . . . 0.762 HD22 HD22 ' A' ' 344' ' ' LEU . 41.3 mt -62.95 -46.27 88.54 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.217 -0.927 . . . . 0.18 109.939 -179.8 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' B' B ' 345' ' ' ASN . . . . . . . . . . . . . 41.7 t-20 -55.42 -46.85 76.63 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.253 -0.904 . . . . 1.09 109.823 -179.527 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 346' ' ' GLU . . . . . . . . . . . . . 1.4 tp10 -60.76 -36.66 79.49 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.239 -0.913 . . . . 1.66 109.825 -179.714 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 347' ' ' ALA . . . . . 1.04 ' HB1' ' HB1' ' A' ' 347' ' ' ALA . . . -59.23 -51.46 69.88 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.177 -0.952 . . . . 0.17 109.886 -179.731 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' B' B ' 348' ' ' LEU . . . . . 0.603 HD22 ' N ' ' B' ' 348' ' ' LEU . 4.1 mm? -61.21 -44.36 97.4 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.234 -0.917 . . . . 0.29 109.723 -179.751 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' B' B ' 349' ' ' GLU . . . . . . . . . . . . . 2.3 mm-40 -58.51 -34.75 71.29 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.257 -0.902 . . . . 1.95 110.214 -179.584 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 350' ' ' LEU . . . . . 0.604 HD13 HD22 ' A' ' 350' ' ' LEU . 6.4 tt -62.53 -44.14 97.09 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.058 -1.026 . . . . 0.45 109.579 -179.888 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' B' B ' 351' ' ' LYS . . . . . . . . . . . . . 26.3 tttm -56.5 -43.24 79.51 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.312 -0.867 . . . . 1.38 109.797 -179.728 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 352' ' ' ASP . . . . . . . . . . . . . 35.0 m-20 -58.0 -50.41 73.5 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.218 -0.926 . . . . 1.16 109.712 179.972 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 353' ' ' ALA . . . . . . . . . . . . . . . -67.08 -10.96 55.55 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.087 -1.008 . . . . 0.61 109.62 -179.662 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 354' ' ' GLN . . . . . 0.559 ' NE2' HD11 ' A' ' 350' ' ' LEU . 3.0 tt0 -84.09 -59.05 2.52 Favored 'General case' 0 N--CA 1.489 1.497 0 O-C-N 121.324 -0.86 . . . . 1.45 109.781 -179.774 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' B' B ' 355' ' ' ALA . . . . . . . . . . . . . . . -70.14 -4.13 19.95 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.32 -0.863 . . . . 0.98 110.202 -179.321 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 356' ' ' GLY . . . . . . . . . . . . . . . -80.17 -9.71 86.3 Favored Glycine 0 N--CA 1.49 2.262 0 N-CA-C 109.398 -1.481 . . . . 1.29 109.398 179.848 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 357' ' ' LYS . . . . . . . . . . . . . 54.1 mttt -89.31 171.06 10.04 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.348 -1.089 . . . . 4.09 109.289 179.621 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 358' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -48.5 151.0 2.12 Favored Pre-proline 0 N--CA 1.491 1.579 0 O-C-N 121.145 -0.972 . . . . 5.72 109.288 179.958 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' B' B ' 359' ' ' PRO . . . . . . . . . . . . . 4.9 Cg_exo -59.01 -159.6 0.02 OUTLIER 'Trans proline' 0 C--N 1.311 -1.446 0 C-N-CA 122.169 1.912 . . . . 4.98 110.13 179.844 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 360' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.319 0 N-CA-C 109.475 -1.45 . . . . 6.98 109.475 179.997 . . . . . . . . 0 0 . 1 . 025 nuclear nobuild full ' C' C ' 319' ' ' LYS . . . . . . . . . . . . . 3.4 mttm . . . . . 0 N--CA 1.49 1.549 0 N-CA-C 109.297 -0.631 . . . . 6.82 109.297 . . . . . . . . . 0 0 . 1 . 025 nuclear nobuild full ' C' C ' 320' ' ' LYS . . . . . . . . . . . . . 17.1 mmtt 58.58 97.33 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.27 -0.894 . . . . 6.49 109.981 179.673 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' C' C ' 321' ' ' LYS . . . . . 0.519 ' HB2' ' HD2' ' C' ' 322' ' ' PRO . 0.0 OUTLIER -81.6 163.24 55.07 Favored Pre-proline 0 N--CA 1.489 1.508 0 N-CA-C 108.582 -0.896 . . . . 6.4 108.582 179.32 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild full ' C' C ' 322' ' ' PRO . . . . . 0.519 ' HD2' ' HB2' ' C' ' 321' ' ' LYS . 4.2 Cg_exo -56.82 -149.14 0.0 OUTLIER 'Trans proline' 0 C--N 1.308 -1.602 0 C-N-CA 121.709 1.606 . . . . 3.42 109.988 -179.869 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' C' C ' 323' ' ' LEU . . . . . 0.419 HD23 ' HA ' ' C' ' 323' ' ' LEU . 71.2 mt -77.82 138.76 39.14 Favored 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.0 -1.063 . . . . 3.95 109.131 -179.875 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' C' C ' 324' ' ' ASP . . . . . . . . . . . . . 79.7 m-20 -76.89 161.68 28.22 Favored 'General case' 0 N--CA 1.488 1.468 0 O-C-N 121.235 -0.915 . . . . 1.63 109.707 -179.477 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' C' C ' 325' ' ' GLY . . . . . . . . . . . . . . . -68.25 -177.3 12.45 Favored Glycine 0 N--CA 1.487 2.093 0 N-CA-C 109.587 -1.405 . . . . 0.73 109.587 -179.848 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' C' C ' 326' ' ' GLU . . . . . . . . . . . . . 42.1 mm-40 -58.57 -177.27 0.03 OUTLIER 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.195 -1.179 . . . . 2.17 109.653 -179.853 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' C' C ' 327' ' ' TYR . . . . . 0.601 ' CE2' ' HG2' ' A' ' 333' ' ' ARG . 47.7 m-85 -149.66 101.88 3.11 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.325 -0.859 . . . . 0.48 109.258 -179.956 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' C' C ' 328' ' ' PHE . . . . . 0.56 ' CE2' ' HG3' ' A' ' 335' ' ' ARG . 71.1 m-85 -110.15 -161.34 0.75 Allowed 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.164 -0.96 . . . . 0.33 110.075 -179.799 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' C' C ' 329' ' ' THR . . . . . 0.441 HG23 ' C ' ' C' ' 328' ' ' PHE . 33.8 p -154.95 169.76 23.31 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.482 -0.761 . . . . 0.23 109.071 179.834 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' C' C ' 330' ' ' LEU . . . . . 0.674 HD11 HD22 ' A' ' 345' ' ' ASN . 16.8 tp -149.89 127.23 11.43 Favored 'General case' 0 N--CA 1.489 1.494 0 O-C-N 121.219 -0.925 . . . . 0.28 109.851 -179.924 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' C' C ' 331' ' ' GLN . . . . . . . . . . . . . 12.5 tp60 -87.76 113.2 23.21 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.401 -0.812 . . . . 1.48 109.162 179.658 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' C' C ' 332' ' ' ILE . . . . . . . . . . . . . 32.1 mt -103.14 110.11 28.79 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.6 0 O-C-N 121.117 -0.99 . . . . 0.24 109.782 -179.789 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' C' C ' 333' ' ' ARG . . . . . 0.417 ' HG2' ' CE1' ' A' ' 327' ' ' TYR . 18.7 mtt180 -73.08 148.13 44.32 Favored 'General case' 0 N--CA 1.488 1.435 0 O-C-N 121.368 -0.833 . . . . 2.74 109.3 179.594 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' C' C ' 334' ' ' GLY . . . . . . . . . . . . . . . 80.07 128.6 0.73 Allowed Glycine 0 N--CA 1.489 2.221 0 N-CA-C 109.749 -1.34 . . . . 0.35 109.749 179.945 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' C' C ' 335' ' ' ARG . . . . . 0.445 ' NH1' ' CG ' ' C' ' 335' ' ' ARG . 0.1 OUTLIER -78.38 -30.25 47.77 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.323 -1.104 . . . . 2.53 109.478 179.919 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild full ' C' C ' 336' ' ' GLU . . . . . . . . . . . . . 24.6 mt-10 -58.26 -66.02 0.55 Allowed 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.309 -0.869 . . . . 2.62 109.751 -179.924 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' C' C ' 337' ' ' ARG . . . . . . . . . . . . . 1.2 mtp180 -59.26 -26.92 65.33 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.211 -0.931 . . . . 2.81 109.614 -179.805 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' C' C ' 338' ' ' PHE . . . . . 0.426 ' HB3' ' O ' ' C' ' 335' ' ' ARG . 74.3 t80 -56.03 -59.1 5.4 Favored 'General case' 0 N--CA 1.489 1.476 0 O-C-N 121.154 -0.966 . . . . 0.4 109.808 -179.88 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' C' C ' 339' ' ' GLU . . . . . . . . . . . . . 4.2 mt-10 -50.5 -33.89 23.1 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.208 -0.932 . . . . 2.05 110.09 -179.512 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' C' C ' 340' ' ' MET . . . . . . . . . . . . . 31.2 ttp -63.72 -51.56 64.43 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.195 -0.941 . . . . 0.32 110.101 -179.498 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' C' C ' 341' ' ' PHE . . . . . . . . . . . . . 47.8 m-85 -61.22 -46.58 89.84 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.114 -0.991 . . . . 0.18 110.012 -179.417 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' C' C ' 342' ' ' ARG . . . . . 0.49 ' NH1' ' HG3' ' C' ' 342' ' ' ARG . 0.0 OUTLIER -48.31 -42.52 31.3 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.246 -0.909 . . . . 2.91 110.252 -179.508 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild full ' C' C ' 343' ' ' GLU . . . . . . . . . . . . . 44.4 tt0 -58.5 -47.37 84.31 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.165 -0.959 . . . . 2.14 110.095 -179.459 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' C' C ' 344' ' ' LEU . . . . . 0.779 HD22 HD22 ' D' ' 344' ' ' LEU . 92.6 mt -61.14 -44.58 97.1 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.119 -0.988 . . . . 0.22 109.952 -179.58 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' C' C ' 345' ' ' ASN . . . . . 0.447 HD22 HD21 ' A' ' 330' ' ' LEU . 64.7 t-20 -56.04 -51.72 66.79 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.218 -0.927 . . . . 1.08 110.045 -179.557 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' C' C ' 346' ' ' GLU . . . . . . . . . . . . . 7.7 tp10 -61.36 -31.95 71.84 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.059 -1.025 . . . . 2.21 109.553 -179.898 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' C' C ' 347' ' ' ALA . . . . . 1.037 ' HB1' ' HB1' ' D' ' 347' ' ' ALA . . . -59.97 -54.48 45.57 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.16 -0.962 . . . . 0.18 109.96 179.954 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' C' C ' 348' ' ' LEU . . . . . 0.714 HD12 ' HE ' ' A' ' 337' ' ' ARG . 4.0 mm? -61.11 -40.68 94.68 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.177 -0.952 . . . . 0.32 109.791 -179.839 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' C' C ' 349' ' ' GLU . . . . . . . . . . . . . 11.7 mm-40 -57.74 -38.83 76.01 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.277 -0.89 . . . . 2.19 110.01 -179.469 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' C' C ' 350' ' ' LEU . . . . . 0.589 HD22 HD13 ' D' ' 350' ' ' LEU . 6.7 tt -63.18 -39.9 95.98 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.113 -0.992 . . . . 0.46 109.612 -179.839 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' C' C ' 351' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -59.16 -50.64 73.26 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.19 -0.944 . . . . 1.35 109.484 -179.843 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' C' C ' 352' ' ' ASP . . . . . . . . . . . . . 73.5 m-20 -55.69 -38.41 69.63 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.344 -0.847 . . . . 1.19 109.864 179.953 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' C' C ' 353' ' ' ALA . . . . . . . . . . . . . . . -68.74 -31.98 71.42 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.33 -0.856 . . . . 0.57 110.554 -179.328 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' C' C ' 354' ' ' GLN . . . . . . . . . . . . . 1.5 mt-30 -82.28 -16.49 49.26 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.007 -1.058 . . . . 1.47 109.991 -179.394 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' C' C ' 355' ' ' ALA . . . . . . . . . . . . . . . -74.55 -23.09 58.74 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.174 -0.954 . . . . 0.93 109.576 179.881 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' C' C ' 356' ' ' GLY . . . . . . . . . . . . . . . -79.38 -0.07 82.22 Favored Glycine 0 N--CA 1.49 2.29 0 N-CA-C 109.899 -1.28 . . . . 1.33 109.899 -179.748 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' C' C ' 357' ' ' LYS . . . . . 0.536 ' HA ' ' CE ' ' C' ' 357' ' ' LYS . 0.3 OUTLIER -84.99 138.39 32.49 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.187 -1.184 . . . . 4.01 109.399 -179.951 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild full ' C' C ' 358' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -50.58 154.06 2.46 Favored Pre-proline 0 N--CA 1.491 1.589 0 O-C-N 121.336 -0.853 . . . . 5.75 109.924 -179.614 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' C' C ' 359' ' ' PRO . . . . . . . . . . . . . 1.9 Cg_endo -62.96 -81.05 0.01 OUTLIER 'Trans proline' 0 C--N 1.309 -1.542 0 C-N-CA 122.297 1.998 . . . . 4.94 109.961 179.647 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' C' C ' 360' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.256 0 N-CA-C 109.466 -1.454 . . . . 6.5 109.466 179.927 . . . . . . . . 0 0 . 1 . 025 nuclear nobuild full ' D' D ' 319' ' ' LYS . . . . . . . . . . . . . 10.1 mtmt . . . . . 0 N--CA 1.49 1.551 0 N-CA-C 109.271 -0.64 . . . . 7.53 109.271 . . . . . . . . . 0 0 . 1 . 025 nuclear nobuild full ' D' D ' 320' ' ' LYS . . . . . 0.479 ' O ' ' HD3' ' D' ' 322' ' ' PRO . 5.7 mttt 57.98 45.1 18.6 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.192 -0.942 . . . . 6.41 109.356 -179.937 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' D' D ' 321' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -81.78 113.79 45.39 Favored Pre-proline 0 N--CA 1.491 1.618 0 O-C-N 121.474 -0.766 . . . . 6.11 109.454 -179.949 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' D' D ' 322' ' ' PRO . . . . . 0.479 ' HD3' ' O ' ' D' ' 320' ' ' LYS . 1.9 Cg_endo -68.42 -4.77 13.57 Favored 'Trans proline' 0 C--N 1.312 -1.359 0 C-N-CA 121.899 1.732 . . . . 2.82 110.463 -179.775 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' D' D ' 323' ' ' LEU . . . . . . . . . . . . . 17.3 mt -84.84 46.11 1.23 Allowed 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.077 -1.015 . . . . 2.83 109.746 179.919 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' D' D ' 324' ' ' ASP . . . . . . . . . . . . . 22.0 m-20 -79.65 140.5 37.05 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.175 -0.953 . . . . 1.54 109.312 -179.979 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' D' D ' 325' ' ' GLY . . . . . . . . . . . . . . . -67.3 -179.87 13.8 Favored Glycine 0 N--CA 1.489 2.19 0 N-CA-C 109.437 -1.465 . . . . 0.59 109.437 -179.991 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' D' D ' 326' ' ' GLU . . . . . . . . . . . . . 3.1 mm-40 -58.08 179.78 0.06 Allowed 'General case' 0 N--CA 1.489 1.478 0 O-C-N 121.214 -1.168 . . . . 2.13 109.379 179.906 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' D' D ' 327' ' ' TYR . . . . . 0.529 ' CE1' ' HG2' ' B' ' 333' ' ' ARG . 48.7 m-85 -148.99 105.76 3.57 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.201 -0.937 . . . . 0.47 109.676 -179.8 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' D' D ' 328' ' ' PHE . . . . . 0.43 ' O ' ' NE2' ' B' ' 331' ' ' GLN . 67.3 m-85 -112.8 -163.9 0.88 Allowed 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.281 -0.887 . . . . 0.3 109.613 179.782 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' D' D ' 329' ' ' THR . . . . . . . . . . . . . 21.1 p -153.97 174.17 15.01 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.178 -0.951 . . . . 0.22 109.192 179.94 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' D' D ' 330' ' ' LEU . . . . . . . . . . . . . 29.1 tp -152.29 132.07 13.22 Favored 'General case' 0 N--CA 1.489 1.494 0 O-C-N 121.166 -0.959 . . . . 0.28 109.852 -179.864 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' D' D ' 331' ' ' GLN . . . . . 0.408 ' NE2' ' O ' ' B' ' 328' ' ' PHE . 46.3 tp60 -89.31 107.98 19.37 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.355 -0.841 . . . . 0.93 109.095 179.463 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' D' D ' 332' ' ' ILE . . . . . . . . . . . . . 33.5 mt -103.67 106.98 21.21 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.518 0 O-C-N 121.195 -0.94 . . . . 0.25 109.766 -179.855 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' D' D ' 333' ' ' ARG . . . . . 0.59 ' HG2' ' CE1' ' B' ' 327' ' ' TYR . 0.0 OUTLIER -73.58 154.35 39.84 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.37 -0.831 . . . . 2.93 109.402 179.693 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild full ' D' D ' 334' ' ' GLY . . . . . . . . . . . . . . . 78.93 128.42 0.55 Allowed Glycine 0 N--CA 1.492 2.403 0 N-CA-C 109.94 -1.264 . . . . 0.41 109.94 179.607 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' D' D ' 335' ' ' ARG . . . . . 0.495 ' HG2' ' NH1' ' D' ' 335' ' ' ARG . 1.6 ttt-85 -80.24 -35.19 36.44 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.371 -1.076 . . . . 3.03 109.453 179.93 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' D' D ' 336' ' ' GLU . . . . . . . . . . . . . 2.4 tm-20 -57.19 -65.5 0.61 Allowed 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.311 -0.868 . . . . 2.26 109.685 -179.663 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' D' D ' 337' ' ' ARG . . . . . 0.55 ' HE ' HD12 ' B' ' 348' ' ' LEU . 0.0 OUTLIER -60.19 -29.11 68.49 Favored 'General case' 0 N--CA 1.489 1.486 0 O-C-N 121.392 -0.818 . . . . 2.92 109.543 -179.924 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild full ' D' D ' 338' ' ' PHE . . . . . . . . . . . . . 54.9 t80 -54.84 -60.04 3.9 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.246 -0.909 . . . . 0.37 109.554 179.883 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' D' D ' 339' ' ' GLU . . . . . . . . . . . . . 60.7 mm-40 -51.63 -29.59 18.27 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.287 -0.883 . . . . 1.99 109.838 -179.813 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' D' D ' 340' ' ' MET . . . . . 0.424 ' HB3' ' O ' ' D' ' 337' ' ' ARG . 6.6 ttp -64.6 -50.61 66.52 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.15 -0.969 . . . . 0.31 109.58 -179.818 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' D' D ' 341' ' ' PHE . . . . . . . . . . . . . 46.5 m-85 -62.8 -46.26 88.78 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.347 -0.846 . . . . 0.18 109.954 -179.735 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' D' D ' 342' ' ' ARG . . . . . . . . . . . . . 5.5 ttm180 -49.09 -41.38 35.35 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.262 -0.899 . . . . 2.41 109.922 -179.429 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' D' D ' 343' ' ' GLU . . . . . . . . . . . . . 1.4 tt0 -58.66 -44.02 90.01 Favored 'General case' 0 N--CA 1.489 1.5 0 O-C-N 121.215 -0.928 . . . . 2.35 109.543 -179.621 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' D' D ' 344' ' ' LEU . . . . . 0.779 HD22 HD22 ' C' ' 344' ' ' LEU . 40.1 mt -62.92 -46.22 88.81 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.346 -0.846 . . . . 0.19 110.025 -179.743 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' D' D ' 345' ' ' ASN . . . . . . . . . . . . . 41.6 t-20 -55.59 -46.56 77.25 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.159 -0.963 . . . . 1.09 109.837 -179.519 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' D' D ' 346' ' ' GLU . . . . . . . . . . . . . 1.4 tp10 -60.67 -36.75 79.5 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.152 -0.967 . . . . 1.69 109.774 -179.806 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' D' D ' 347' ' ' ALA . . . . . 1.037 ' HB1' ' HB1' ' C' ' 347' ' ' ALA . . . -59.05 -50.95 72.14 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.091 -1.006 . . . . 0.18 110.025 -179.737 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' D' D ' 348' ' ' LEU . . . . . 0.604 HD22 ' N ' ' D' ' 348' ' ' LEU . 4.0 mm? -61.89 -43.84 98.02 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.129 -0.982 . . . . 0.31 109.829 -179.791 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' D' D ' 349' ' ' GLU . . . . . . . . . . . . . 2.3 mm-40 -59.05 -34.47 71.97 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.318 -0.864 . . . . 1.95 110.085 -179.531 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' D' D ' 350' ' ' LEU . . . . . 0.589 HD13 HD22 ' C' ' 350' ' ' LEU . 6.2 tt -62.83 -43.8 97.84 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.135 -0.978 . . . . 0.43 109.518 -179.87 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' D' D ' 351' ' ' LYS . . . . . . . . . . . . . 27.2 tttm -56.98 -42.7 80.69 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.352 -0.842 . . . . 1.4 109.728 -179.676 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' D' D ' 352' ' ' ASP . . . . . . . . . . . . . 33.7 m-20 -58.55 -50.36 74.07 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.118 -0.989 . . . . 1.17 109.613 -179.969 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' D' D ' 353' ' ' ALA . . . . . . . . . . . . . . . -66.93 -11.01 55.03 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.28 -0.888 . . . . 0.59 109.634 -179.794 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' D' D ' 354' ' ' GLN . . . . . 0.408 ' NE2' ' CD1' ' C' ' 350' ' ' LEU . 3.1 tt0 -84.16 -58.92 2.57 Favored 'General case' 0 C--N 1.3 -1.552 0 O-C-N 121.281 -0.887 . . . . 1.44 109.775 -179.774 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' D' D ' 355' ' ' ALA . . . . . . . . . . . . . . . -70.0 -4.07 19.16 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.373 -0.83 . . . . 0.98 110.14 -179.264 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' D' D ' 356' ' ' GLY . . . . . . . . . . . . . . . -79.75 -10.78 85.38 Favored Glycine 0 N--CA 1.491 2.308 0 N-CA-C 109.369 -1.492 . . . . 1.28 109.369 179.908 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' D' D ' 357' ' ' LYS . . . . . . . . . . . . . 56.5 mttt -88.89 171.43 9.91 Favored 'General case' 0 N--CA 1.488 1.456 0 O-C-N 121.264 -1.139 . . . . 4.09 109.51 179.805 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' D' D ' 358' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -48.46 151.15 2.05 Favored Pre-proline 0 N--CA 1.49 1.53 0 O-C-N 121.099 -1.001 . . . . 5.71 109.275 179.885 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' D' D ' 359' ' ' PRO . . . . . . . . . . . . . 4.8 Cg_exo -59.43 -159.48 0.02 OUTLIER 'Trans proline' 0 C--N 1.308 -1.573 0 C-N-CA 122.185 1.923 . . . . 4.97 110.156 -179.985 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' D' D ' 360' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.218 0 CA-C-O 118.025 -1.431 . . . . 6.97 109.592 -179.99 . . . . . . . . 0 0 . 1 . 026 nuclear nobuild full ' A' A ' 319' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.49 1.557 0 N-CA-C 109.673 -0.491 . . . . 7.55 109.673 . . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 320' ' ' LYS . . . . . . . . . . . . . 8.7 ttmm 59.56 84.91 0.11 Allowed 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.132 -0.98 . . . . 6.43 109.306 -179.826 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 321' ' ' LYS . . . . . 0.509 ' N ' ' HD3' ' A' ' 322' ' ' PRO . 0.0 OUTLIER -159.08 60.8 1.7 Allowed Pre-proline 0 N--CA 1.491 1.58 0 O-C-N 121.172 -0.955 . . . . 6.13 109.747 -179.86 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild full ' A' A ' 322' ' ' PRO . . . . . 0.509 ' HD3' ' N ' ' A' ' 321' ' ' LYS . 2.6 Cg_endo -61.75 116.35 3.38 Favored 'Trans proline' 0 C--N 1.309 -1.545 0 C-N-CA 122.093 1.862 . . . . 2.83 110.188 179.729 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 323' ' ' LEU . . . . . . . . . . . . . 20.0 mt -81.45 118.01 22.35 Favored 'General case' 0 N--CA 1.489 1.501 0 O-C-N 121.234 -0.916 . . . . 2.83 109.399 179.936 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 324' ' ' ASP . . . . . 0.452 ' HB2' ' OH ' ' A' ' 327' ' ' TYR . 16.8 m-20 -79.46 179.71 7.3 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.198 -0.939 . . . . 1.53 109.574 -179.765 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 325' ' ' GLY . . . . . . . . . . . . . . . -69.18 -149.31 0.29 Allowed Glycine 0 N--CA 1.492 2.39 0 N-CA-C 109.86 -1.296 . . . . 0.61 109.86 -179.764 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 326' ' ' GLU . . . . . . . . . . . . . 32.4 mp0 -58.45 -168.41 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.336 -1.097 . . . . 2.13 109.611 -179.935 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 327' ' ' TYR . . . . . 0.584 ' CE1' ' HG2' ' C' ' 333' ' ' ARG . 41.5 m-85 -148.78 112.6 5.11 Favored 'General case' 0 N--CA 1.489 1.5 0 O-C-N 121.373 -0.829 . . . . 0.48 109.555 180.0 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 328' ' ' PHE . . . . . . . . . . . . . 98.0 m-85 -113.88 -169.43 1.51 Allowed 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.258 -0.901 . . . . 0.31 109.369 179.804 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 329' ' ' THR . . . . . . . . . . . . . 20.8 p -153.29 168.95 24.32 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.302 -0.874 . . . . 0.22 109.665 -179.761 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 330' ' ' LEU . . . . . . . . . . . . . 41.7 tp -152.19 129.11 10.98 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.29 -0.881 . . . . 0.28 109.591 -179.856 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 331' ' ' GLN . . . . . . . . . . . . . 1.4 tt0 -87.13 114.61 23.89 Favored 'General case' 0 N--CA 1.488 1.429 0 O-C-N 121.403 -0.81 . . . . 0.91 109.14 179.537 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 332' ' ' ILE . . . . . 0.653 HG21 ' HA ' ' A' ' 338' ' ' PHE . 45.8 mt -103.32 104.3 16.44 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.54 0 O-C-N 121.095 -1.003 . . . . 0.26 109.487 -179.933 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 333' ' ' ARG . . . . . 0.482 ' HG2' ' CE2' ' C' ' 327' ' ' TYR . 49.4 mtt180 -72.82 143.58 47.82 Favored 'General case' 0 N--CA 1.488 1.433 0 O-C-N 121.306 -0.871 . . . . 2.92 109.108 179.822 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 334' ' ' GLY . . . . . . . . . . . . . . . 89.2 125.72 2.7 Favored Glycine 0 N--CA 1.491 2.342 0 N-CA-C 109.423 -1.471 . . . . 0.4 109.423 -179.93 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 335' ' ' ARG . . . . . . . . . . . . . 15.1 ttt180 -76.41 -40.39 50.97 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.202 -1.175 . . . . 3.01 109.742 -179.897 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 336' ' ' GLU . . . . . . . . . . . . . 20.0 tt0 -58.09 -58.76 7.03 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.42 -0.8 . . . . 2.29 109.928 -179.746 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 337' ' ' ARG . . . . . 0.433 ' CG ' HH11 ' A' ' 337' ' ' ARG . 0.0 OUTLIER -61.18 -32.51 72.25 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.229 -0.919 . . . . 2.93 109.509 -179.833 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild full ' A' A ' 338' ' ' PHE . . . . . 0.653 ' HA ' HG21 ' A' ' 332' ' ' ILE . 53.0 t80 -55.75 -53.88 51.25 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.303 -0.873 . . . . 0.38 109.392 179.908 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 339' ' ' GLU . . . . . . . . . . . . . 43.1 mt-10 -50.8 -32.49 20.18 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.247 -0.908 . . . . 1.97 109.861 -179.644 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 340' ' ' MET . . . . . . . . . . . . . 19.6 ttp -63.1 -51.64 65.77 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.088 -1.007 . . . . 0.31 109.79 -179.551 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 341' ' ' PHE . . . . . . . . . . . . . 37.3 m-85 -62.06 -41.47 98.19 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.133 -0.98 . . . . 0.18 109.816 -179.829 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 342' ' ' ARG . . . . . . . . . . . . . 6.1 tpt180 -49.1 -43.46 41.32 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.261 -0.899 . . . . 2.42 110.105 -179.497 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 343' ' ' GLU . . . . . . . . . . . . . 1.3 tt0 -59.95 -46.02 90.75 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.202 -0.936 . . . . 2.35 109.639 -179.757 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 344' ' ' LEU . . . . . . . . . . . . . 57.6 mt -62.04 -30.28 70.87 Favored 'General case' 0 N--CA 1.488 1.467 0 O-C-N 121.315 -0.866 . . . . 0.18 109.372 -179.954 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 345' ' ' ASN . . . . . . . . . . . . . 12.4 t-20 -59.24 -58.09 10.14 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.346 -0.846 . . . . 1.09 109.965 -179.725 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 346' ' ' GLU . . . . . . . . . . . . . 15.8 tt0 -61.74 -28.15 69.23 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.212 -0.93 . . . . 1.65 109.731 -179.555 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 347' ' ' ALA . . . . . 0.704 ' HB1' ' HB1' ' B' ' 347' ' ' ALA . . . -60.9 -61.71 2.38 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.099 -1.001 . . . . 0.18 110.011 -179.607 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 348' ' ' LEU . . . . . 0.603 HD22 ' N ' ' A' ' 348' ' ' LEU . 3.8 mm? -61.52 -45.65 93.3 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.278 -0.889 . . . . 0.3 110.21 -179.396 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 349' ' ' GLU . . . . . 0.433 ' OE2' ' HD2' ' C' ' 333' ' ' ARG . 3.5 mt-10 -57.69 -32.93 67.84 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.226 -0.921 . . . . 1.94 110.072 -179.339 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 350' ' ' LEU . . . . . 0.69 HD22 HD22 ' B' ' 350' ' ' LEU . 7.8 tt -65.75 -43.99 87.24 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.032 -1.043 . . . . 0.46 109.391 -179.91 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 351' ' ' LYS . . . . . . . . . . . . . 13.3 tttt -59.07 -50.95 72.11 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.381 -0.824 . . . . 1.4 109.352 -179.937 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 352' ' ' ASP . . . . . . . . . . . . . 2.3 m-20 -56.24 -31.23 63.36 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.205 -0.934 . . . . 1.16 109.82 -179.922 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 353' ' ' ALA . . . . . . . . . . . . . . . -67.25 -33.25 74.93 Favored 'General case' 0 N--CA 1.495 1.776 0 O-C-N 121.13 -0.981 . . . . 0.63 110.072 -179.731 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 354' ' ' GLN . . . . . . . . . . . . . 20.1 mt-30 -83.11 -10.12 58.84 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.128 -0.983 . . . . 1.47 109.576 -179.696 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 355' ' ' ALA . . . . . . . . . . . . . . . -73.49 -3.3 26.8 Favored 'General case' 0 N--CA 1.493 1.717 0 O-C-N 121.312 -0.867 . . . . 1.01 110.135 -179.901 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 356' ' ' GLY . . . . . . . . . . . . . . . -79.72 -33.38 34.24 Favored Glycine 0 N--CA 1.489 2.22 0 N-CA-C 109.769 -1.332 . . . . 1.3 109.769 -179.528 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 357' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -87.1 149.94 24.34 Favored 'General case' 0 N--CA 1.489 1.494 0 O-C-N 121.315 -1.109 . . . . 4.1 109.633 -179.912 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 358' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -49.15 117.38 6.52 Favored Pre-proline 0 N--CA 1.492 1.664 0 O-C-N 121.157 -0.964 . . . . 5.75 109.453 -179.975 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 359' ' ' PRO . . . . . . . . . . . . . 4.4 Cg_exo -59.29 131.19 39.62 Favored 'Trans proline' 0 C--N 1.313 -1.303 0 C-N-CA 121.866 1.711 . . . . 5.0 110.307 -179.826 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 360' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.255 0 CA-C-O 117.973 -1.459 . . . . 6.97 109.499 -179.902 . . . . . . . . 0 0 . 1 . 026 nuclear nobuild full ' B' B ' 319' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.49 1.551 0 CA-C-O 121.195 0.521 . . . . 7.55 109.798 . . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' B' B ' 320' ' ' LYS . . . . . . . . . . . . . 8.9 ttmm 59.38 84.5 0.11 Allowed 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.17 -0.956 . . . . 6.44 109.448 -179.852 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' B' B ' 321' ' ' LYS . . . . . 0.531 ' N ' ' HD3' ' B' ' 322' ' ' PRO . 0.0 OUTLIER -158.39 59.41 1.55 Allowed Pre-proline 0 N--CA 1.492 1.649 0 O-C-N 121.153 -0.967 . . . . 6.13 109.959 -179.689 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild full ' B' B ' 322' ' ' PRO . . . . . 0.531 ' HD3' ' N ' ' B' ' 321' ' ' LYS . 2.6 Cg_endo -61.28 116.11 3.17 Favored 'Trans proline' 0 C--N 1.309 -1.508 0 C-N-CA 122.169 1.913 . . . . 2.82 110.166 179.752 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' B' B ' 323' ' ' LEU . . . . . . . . . . . . . 18.6 mt -80.91 118.62 22.56 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.261 -0.9 . . . . 2.84 109.359 179.952 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' B' B ' 324' ' ' ASP . . . . . 0.417 ' HB2' ' OH ' ' B' ' 327' ' ' TYR . 17.2 m-20 -79.64 179.36 7.55 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.203 -0.936 . . . . 1.53 109.494 179.992 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' B' B ' 325' ' ' GLY . . . . . . . . . . . . . . . -68.88 -148.97 0.24 Allowed Glycine 0 N--CA 1.491 2.312 0 N-CA-C 109.908 -1.277 . . . . 0.59 109.908 -179.768 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' B' B ' 326' ' ' GLU . . . . . . . . . . . . . 34.5 mp0 -58.77 -168.18 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.29 -1.123 . . . . 2.13 109.768 -179.724 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' B' B ' 327' ' ' TYR . . . . . 0.417 ' OH ' ' HB2' ' B' ' 324' ' ' ASP . 41.8 m-85 -149.37 112.2 4.83 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.354 -0.841 . . . . 0.48 109.898 -179.994 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' B' B ' 328' ' ' PHE . . . . . 0.451 ' CE2' ' HA ' ' D' ' 335' ' ' ARG . 97.3 m-85 -113.52 -169.51 1.51 Allowed 'General case' 0 N--CA 1.487 1.411 0 O-C-N 121.342 -0.849 . . . . 0.32 109.503 179.942 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' B' B ' 329' ' ' THR . . . . . . . . . . . . . 18.0 p -152.94 169.27 23.28 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.182 -0.948 . . . . 0.23 109.792 -179.661 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' B' B ' 330' ' ' LEU . . . . . . . . . . . . . 39.6 tp -152.4 129.31 10.99 Favored 'General case' 0 N--CA 1.489 1.478 0 O-C-N 121.365 -0.835 . . . . 0.28 109.668 179.998 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' B' B ' 331' ' ' GLN . . . . . . . . . . . . . 1.3 tt0 -87.01 115.27 24.28 Favored 'General case' 0 N--CA 1.488 1.475 0 O-C-N 121.36 -0.837 . . . . 0.91 109.115 179.504 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' B' B ' 332' ' ' ILE . . . . . 0.668 HG21 ' HA ' ' B' ' 338' ' ' PHE . 42.6 mt -103.48 103.59 15.38 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.599 0 O-C-N 120.945 -1.097 . . . . 0.24 109.7 179.964 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' B' B ' 333' ' ' ARG . . . . . . . . . . . . . 50.3 mtt180 -72.4 142.75 48.7 Favored 'General case' 0 C--N 1.302 -1.463 0 O-C-N 121.085 -1.01 . . . . 2.93 109.261 179.759 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' B' B ' 334' ' ' GLY . . . . . . . . . . . . . . . 89.79 125.6 2.86 Favored Glycine 0 N--CA 1.49 2.29 0 N-CA-C 109.583 -1.407 . . . . 0.4 109.583 -179.821 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' B' B ' 335' ' ' ARG . . . . . . . . . . . . . 16.6 ttt180 -76.45 -40.37 50.69 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.151 -1.206 . . . . 3.01 109.72 -179.928 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' B' B ' 336' ' ' GLU . . . . . . . . . . . . . 24.1 tt0 -58.23 -59.31 5.51 Favored 'General case' 0 N--CA 1.489 1.49 0 O-C-N 121.083 -1.011 . . . . 2.28 109.69 -179.577 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' B' B ' 337' ' ' ARG . . . . . 0.455 HH11 ' CG ' ' B' ' 337' ' ' ARG . 0.0 OUTLIER -60.26 -32.42 71.14 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.12 -0.987 . . . . 2.93 109.766 -179.795 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild full ' B' B ' 338' ' ' PHE . . . . . 0.668 ' HA ' HG21 ' B' ' 332' ' ' ILE . 52.4 t80 -55.93 -52.94 62.36 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.226 -0.921 . . . . 0.37 109.625 -179.895 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' B' B ' 339' ' ' GLU . . . . . . . . . . . . . 35.3 mt-10 -51.12 -33.03 24.71 Favored 'General case' 0 N--CA 1.488 1.461 0 O-C-N 121.35 -0.844 . . . . 1.98 109.848 -179.574 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' B' B ' 340' ' ' MET . . . . . . . . . . . . . 20.0 ttp -62.83 -51.36 67.32 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.115 -0.99 . . . . 0.32 109.924 -179.512 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' B' B ' 341' ' ' PHE . . . . . . . . . . . . . 35.6 m-85 -62.41 -41.72 98.9 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.128 -0.982 . . . . 0.18 109.796 -179.834 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' B' B ' 342' ' ' ARG . . . . . . . . . . . . . 5.7 tpt180 -48.88 -44.32 39.82 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.383 -0.823 . . . . 2.42 109.68 -179.806 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' B' B ' 343' ' ' GLU . . . . . . . . . . . . . 1.3 tt0 -58.44 -47.42 84.04 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.085 -1.009 . . . . 2.35 109.705 -179.85 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' B' B ' 344' ' ' LEU . . . . . . . . . . . . . 51.6 mt -61.01 -30.52 70.35 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.158 -0.964 . . . . 0.18 109.684 -179.831 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' B' B ' 345' ' ' ASN . . . . . . . . . . . . . 12.1 t-20 -58.91 -58.33 9.12 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.314 -0.866 . . . . 1.09 110.132 -179.837 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' B' B ' 346' ' ' GLU . . . . . . . . . . . . . 17.7 tt0 -61.65 -28.44 69.38 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.112 -0.993 . . . . 1.66 109.568 -179.464 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' B' B ' 347' ' ' ALA . . . . . 0.704 ' HB1' ' HB1' ' A' ' 347' ' ' ALA . . . -60.59 -61.14 2.81 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.248 -0.908 . . . . 0.17 110.199 -179.778 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' B' B ' 348' ' ' LEU . . . . . 0.599 HD22 ' N ' ' B' ' 348' ' ' LEU . 3.8 mm? -62.36 -46.05 90.44 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.307 -0.871 . . . . 0.29 110.023 -179.279 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' B' B ' 349' ' ' GLU . . . . . . . . . . . . . 3.9 mt-10 -57.09 -33.2 67.07 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.025 -1.047 . . . . 1.95 110.099 -179.48 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' B' B ' 350' ' ' LEU . . . . . 0.69 HD22 HD22 ' A' ' 350' ' ' LEU . 7.8 tt -65.41 -44.3 87.87 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.159 -0.963 . . . . 0.45 109.442 -179.923 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' B' B ' 351' ' ' LYS . . . . . . . . . . . . . 15.0 tttt -58.74 -50.65 73.12 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.233 -0.917 . . . . 1.38 109.454 -179.984 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' B' B ' 352' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 -56.35 -31.92 64.23 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.224 -0.922 . . . . 1.16 109.841 -179.85 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' B' B ' 353' ' ' ALA . . . . . . . . . . . . . . . -66.82 -33.0 74.65 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.194 -0.941 . . . . 0.61 109.896 -179.661 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' B' B ' 354' ' ' GLN . . . . . . . . . . . . . 20.3 mt-30 -82.89 -9.9 59.09 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.107 -0.995 . . . . 1.45 109.515 -179.914 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' B' B ' 355' ' ' ALA . . . . . . . . . . . . . . . -73.93 -3.22 27.65 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.11 -0.994 . . . . 0.98 110.217 -179.722 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' B' B ' 356' ' ' GLY . . . . . . . . . . . . . . . -80.37 -32.03 35.91 Favored Glycine 0 N--CA 1.491 2.336 0 N-CA-C 109.803 -1.319 . . . . 1.29 109.803 -179.742 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' B' B ' 357' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -87.74 149.37 24.25 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.104 -1.233 . . . . 4.09 109.402 179.866 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' B' B ' 358' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -49.01 116.88 5.87 Favored Pre-proline 0 N--CA 1.488 1.448 0 O-C-N 121.363 -0.836 . . . . 5.72 109.333 179.903 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' B' B ' 359' ' ' PRO . . . . . . . . . . . . . 4.3 Cg_exo -59.44 132.14 44.57 Favored 'Trans proline' 0 C--N 1.31 -1.449 0 C-N-CA 122.052 1.834 . . . . 4.98 110.321 -179.9 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' B' B ' 360' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.494 2.529 0 N-CA-C 109.408 -1.477 . . . . 6.98 109.408 -179.847 . . . . . . . . 0 0 . 1 . 026 nuclear nobuild full ' C' C ' 319' ' ' LYS . . . . . 0.477 ' O ' ' O ' ' C' ' 320' ' ' LYS . 0.0 OUTLIER . . . . . 0 N--CA 1.488 1.44 0 N-CA-C 109.49 -0.559 . . . . 6.82 109.49 . . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' C' C ' 320' ' ' LYS . . . . . 0.477 ' O ' ' O ' ' C' ' 319' ' ' LYS . 1.4 tttp 56.21 162.33 0.02 OUTLIER 'General case' 0 N--CA 1.489 1.477 0 O-C-N 121.26 -0.9 . . . . 6.49 109.378 179.996 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' C' C ' 321' ' ' LYS . . . . . . . . . . . . . 1.8 mptt -159.73 83.71 2.26 Favored Pre-proline 0 N--CA 1.489 1.503 0 O-C-N 121.275 -0.891 . . . . 6.4 109.556 179.898 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' C' C ' 322' ' ' PRO . . . . . . . . . . . . . 6.1 Cg_endo -71.39 16.11 0.32 Allowed 'Trans proline' 0 C--N 1.309 -1.541 0 C-N-CA 122.727 2.285 . . . . 3.42 111.943 -179.83 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' C' C ' 323' ' ' LEU . . . . . . . . . . . . . 15.8 mt -80.24 86.94 5.58 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 120.597 -1.314 . . . . 3.95 109.601 -179.857 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' C' C ' 324' ' ' ASP . . . . . 0.533 ' CB ' ' OH ' ' C' ' 327' ' ' TYR . 0.9 OUTLIER -86.57 148.15 25.62 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.17 -0.956 . . . . 1.63 110.165 -179.94 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild full ' C' C ' 325' ' ' GLY . . . . . . . . . . . . . . . -71.25 -158.53 3.05 Favored Glycine 0 N--CA 1.49 2.278 0 N-CA-C 109.395 -1.482 . . . . 0.73 109.395 179.415 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' C' C ' 326' ' ' GLU . . . . . 0.408 ' O ' ' CD1' ' C' ' 327' ' ' TYR . 3.5 mt-10 -59.49 -166.86 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.193 -1.181 . . . . 2.17 109.382 179.695 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' C' C ' 327' ' ' TYR . . . . . 0.533 ' OH ' ' CB ' ' C' ' 324' ' ' ASP . 33.7 m-85 -149.33 112.09 4.81 Favored 'General case' 0 N--CA 1.488 1.45 0 O-C-N 121.375 -0.828 . . . . 0.48 110.458 179.721 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' C' C ' 328' ' ' PHE . . . . . 0.448 ' O ' HG23 ' C' ' 329' ' ' THR . 68.9 m-85 -112.96 -166.36 1.07 Allowed 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.423 -0.798 . . . . 0.33 108.975 179.458 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' C' C ' 329' ' ' THR . . . . . 0.448 HG23 ' O ' ' C' ' 328' ' ' PHE . 4.4 p -154.28 166.01 34.5 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.259 -0.901 . . . . 0.23 109.492 -179.944 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' C' C ' 330' ' ' LEU . . . . . . . . . . . . . 42.0 tp -150.07 129.42 12.9 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.24 -0.912 . . . . 0.28 109.762 -179.692 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' C' C ' 331' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -87.59 116.48 25.74 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.278 -0.889 . . . . 1.48 109.095 179.683 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' C' C ' 332' ' ' ILE . . . . . 0.635 HG21 ' HA ' ' C' ' 338' ' ' PHE . 76.1 mt -104.14 110.71 31.16 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.559 0 O-C-N 121.195 -0.941 . . . . 0.24 109.828 -179.748 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' C' C ' 333' ' ' ARG . . . . . 0.584 ' HG2' ' CE1' ' A' ' 327' ' ' TYR . 58.2 mtt180 -73.89 143.01 45.98 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.238 -0.914 . . . . 2.74 109.368 179.64 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' C' C ' 334' ' ' GLY . . . . . . . . . . . . . . . 80.92 133.71 1.38 Allowed Glycine 0 N--CA 1.491 2.341 0 N-CA-C 109.884 -1.286 . . . . 0.35 109.884 179.845 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' C' C ' 335' ' ' ARG . . . . . . . . . . . . . 3.8 ttt180 -77.69 -35.35 52.27 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.271 -1.135 . . . . 2.53 109.402 179.81 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' C' C ' 336' ' ' GLU . . . . . . . . . . . . . 2.0 mp0 -56.93 -57.38 12.78 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.239 -0.913 . . . . 2.62 109.763 -179.85 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' C' C ' 337' ' ' ARG . . . . . 0.441 HH11 ' HG3' ' C' ' 337' ' ' ARG . 0.3 OUTLIER -59.44 -34.52 72.62 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.158 -0.964 . . . . 2.81 109.683 -179.746 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild full ' C' C ' 338' ' ' PHE . . . . . 0.635 ' HA ' HG21 ' C' ' 332' ' ' ILE . 61.2 t80 -54.87 -55.65 28.07 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.415 -0.803 . . . . 0.4 109.747 -179.841 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' C' C ' 339' ' ' GLU . . . . . . . . . . . . . 11.4 mm-40 -50.92 -35.85 35.4 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.319 -0.863 . . . . 2.05 110.367 -179.592 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' C' C ' 340' ' ' MET . . . . . . . . . . . . . 34.6 ttp -63.33 -48.66 77.11 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.112 -0.993 . . . . 0.32 110.054 -179.343 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' C' C ' 341' ' ' PHE . . . . . . . . . . . . . 30.9 m-85 -63.23 -46.32 87.5 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.187 -0.946 . . . . 0.18 110.251 -179.351 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' C' C ' 342' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -48.89 -39.96 27.95 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.015 -1.053 . . . . 2.91 109.799 -179.663 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' C' C ' 343' ' ' GLU . . . . . . . . . . . . . 31.3 tt0 -58.41 -52.82 63.99 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.08 -1.013 . . . . 2.14 109.507 179.913 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' C' C ' 344' ' ' LEU . . . . . . . . . . . . . 86.4 mt -62.02 -25.02 67.41 Favored 'General case' 0 N--CA 1.488 1.454 0 O-C-N 121.344 -0.848 . . . . 0.22 109.23 -179.943 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' C' C ' 345' ' ' ASN . . . . . . . . . . . . . 6.9 t-20 -60.31 -61.43 2.61 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.322 -0.861 . . . . 1.08 109.341 -179.942 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' C' C ' 346' ' ' GLU . . . . . . . . . . . . . 34.5 tt0 -61.29 -23.2 65.53 Favored 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.316 -0.865 . . . . 2.21 109.487 -179.931 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' C' C ' 347' ' ' ALA . . . . . 0.418 ' HB1' ' HB1' ' D' ' 347' ' ' ALA . . . -63.2 -62.8 1.45 Allowed 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.308 -0.87 . . . . 0.18 109.776 -179.941 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' C' C ' 348' ' ' LEU . . . . . 0.523 HD13 ' HA ' ' C' ' 348' ' ' LEU . 3.5 mm? -61.6 -40.77 95.99 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.333 -0.854 . . . . 0.32 109.712 -179.676 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' C' C ' 349' ' ' GLU . . . . . 0.441 ' HA ' ' OE1' ' C' ' 349' ' ' GLU . 7.8 mm-40 -57.28 -38.66 74.26 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 120.994 -1.066 . . . . 2.19 109.52 -179.825 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' C' C ' 350' ' ' LEU . . . . . 0.518 HD22 HD22 ' D' ' 350' ' ' LEU . 9.5 tt -63.74 -44.02 94.75 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.429 -0.794 . . . . 0.46 109.07 179.853 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' C' C ' 351' ' ' LYS . . . . . . . . . . . . . 2.6 tttt -59.46 -39.4 83.52 Favored 'General case' 0 C--N 1.301 -1.532 0 O-C-N 121.504 -0.748 . . . . 1.35 109.431 179.981 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' C' C ' 352' ' ' ASP . . . . . . . . . . . . . 24.6 m-20 -58.44 -39.9 81.1 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.316 -0.865 . . . . 1.19 109.561 -179.781 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' C' C ' 353' ' ' ALA . . . . . . . . . . . . . . . -67.27 -22.27 65.67 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.276 -0.89 . . . . 0.57 109.795 -179.657 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' C' C ' 354' ' ' GLN . . . . . . . . . . . . . 3.4 tt0 -80.85 -11.65 59.56 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.093 -1.004 . . . . 1.47 109.315 -179.977 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' C' C ' 355' ' ' ALA . . . . . . . . . . . . . . . -72.3 -3.04 21.45 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.234 -0.916 . . . . 0.93 109.454 179.464 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' C' C ' 356' ' ' GLY . . . . . . . . . . . . . . . -71.68 -81.42 0.31 Allowed Glycine 0 N--CA 1.489 2.215 0 N-CA-C 110.057 -1.217 . . . . 1.33 110.057 -179.527 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' C' C ' 357' ' ' LYS . . . . . . . . . . . . . 5.8 mttp -83.99 -173.94 5.0 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.293 -1.122 . . . . 4.01 109.503 -179.746 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' C' C ' 358' ' ' GLU . . . . . . . . . . . . . 12.5 pt-20 -48.74 146.91 4.83 Favored Pre-proline 0 N--CA 1.489 1.508 0 O-C-N 121.358 -0.839 . . . . 5.75 109.529 -179.725 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' C' C ' 359' ' ' PRO . . . . . . . . . . . . . 1.8 Cg_endo -62.5 85.05 0.11 Allowed 'Trans proline' 0 C--N 1.311 -1.4 0 C-N-CA 122.132 1.888 . . . . 4.94 110.395 -179.909 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' C' C ' 360' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.343 0 N-CA-C 109.463 -1.455 . . . . 6.5 109.463 179.86 . . . . . . . . 0 0 . 1 . 026 nuclear nobuild full ' D' D ' 319' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.49 1.534 0 CA-C-O 121.326 0.584 . . . . 7.53 109.774 . . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' D' D ' 320' ' ' LYS . . . . . . . . . . . . . 9.3 ttmm 59.89 84.92 0.11 Allowed 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.284 -0.885 . . . . 6.41 109.494 -179.928 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' D' D ' 321' ' ' LYS . . . . . 0.54 ' N ' ' HD3' ' D' ' 322' ' ' PRO . 0.0 OUTLIER -158.51 58.46 1.33 Allowed Pre-proline 0 N--CA 1.491 1.602 0 O-C-N 121.113 -0.992 . . . . 6.11 109.882 -179.742 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild full ' D' D ' 322' ' ' PRO . . . . . 0.54 ' HD3' ' N ' ' D' ' 321' ' ' LYS . 3.0 Cg_exo -60.68 115.91 3.0 Favored 'Trans proline' 0 C--N 1.309 -1.528 0 C-N-CA 122.182 1.921 . . . . 2.82 110.112 179.857 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' D' D ' 323' ' ' LEU . . . . . . . . . . . . . 16.3 mt -81.46 117.74 22.14 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.24 -0.912 . . . . 2.83 109.689 -179.748 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' D' D ' 324' ' ' ASP . . . . . 0.408 ' HB2' ' OH ' ' D' ' 327' ' ' TYR . 14.9 m-20 -78.36 179.74 6.8 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.381 -0.824 . . . . 1.54 109.69 179.977 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' D' D ' 325' ' ' GLY . . . . . . . . . . . . . . . -68.85 -149.54 0.27 Allowed Glycine 0 N--CA 1.49 2.266 0 N-CA-C 109.957 -1.257 . . . . 0.59 109.957 -179.823 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' D' D ' 326' ' ' GLU . . . . . . . . . . . . . 33.9 mp0 -58.65 -168.1 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.478 0 O-C-N 121.379 -1.071 . . . . 2.13 109.642 -179.923 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' D' D ' 327' ' ' TYR . . . . . 0.408 ' OH ' ' HB2' ' D' ' 324' ' ' ASP . 41.6 m-85 -149.62 112.21 4.76 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.321 -0.862 . . . . 0.47 109.784 -179.866 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' D' D ' 328' ' ' PHE . . . . . . . . . . . . . 98.7 m-85 -113.1 -169.41 1.48 Allowed 'General case' 0 C--N 1.302 -1.498 0 O-C-N 121.315 -0.866 . . . . 0.3 109.381 -179.969 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' D' D ' 329' ' ' THR . . . . . . . . . . . . . 16.9 p -152.66 168.71 24.73 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.222 -0.924 . . . . 0.22 109.639 -179.753 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' D' D ' 330' ' ' LEU . . . . . . . . . . . . . 41.4 tp -152.1 129.28 11.18 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.283 -0.885 . . . . 0.28 109.754 -179.982 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' D' D ' 331' ' ' GLN . . . . . . . . . . . . . 1.5 tt0 -87.55 115.31 24.89 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.112 -0.992 . . . . 0.93 109.291 179.654 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' D' D ' 332' ' ' ILE . . . . . 0.655 HG21 ' HA ' ' D' ' 338' ' ' PHE . 39.3 mt -103.2 102.92 14.33 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.562 0 O-C-N 121.165 -0.959 . . . . 0.25 109.739 -179.886 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' D' D ' 333' ' ' ARG . . . . . . . . . . . . . 49.3 mtt180 -71.84 141.88 49.61 Favored 'General case' 0 N--CA 1.487 1.403 0 O-C-N 121.372 -0.83 . . . . 2.93 109.189 179.626 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' D' D ' 334' ' ' GLY . . . . . . . . . . . . . . . 90.87 125.04 3.08 Favored Glycine 0 N--CA 1.492 2.377 0 N-CA-C 109.376 -1.49 . . . . 0.41 109.376 -179.931 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' D' D ' 335' ' ' ARG . . . . . 0.451 ' HA ' ' CE2' ' B' ' 328' ' ' PHE . 18.5 ttt180 -76.64 -40.64 48.57 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.158 -1.201 . . . . 3.03 109.734 -179.971 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' D' D ' 336' ' ' GLU . . . . . . . . . . . . . 24.1 tt0 -57.86 -58.58 7.76 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.269 -0.895 . . . . 2.26 109.785 -179.771 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' D' D ' 337' ' ' ARG . . . . . 0.46 ' NH1' ' CG ' ' D' ' 337' ' ' ARG . 0.0 OUTLIER -61.45 -32.33 72.31 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.072 -1.017 . . . . 2.92 109.581 -179.669 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild full ' D' D ' 338' ' ' PHE . . . . . 0.655 ' HA ' HG21 ' D' ' 332' ' ' ILE . 52.7 t80 -55.6 -53.24 58.91 Favored 'General case' 0 N--CA 1.489 1.492 0 O-C-N 121.304 -0.872 . . . . 0.37 109.527 179.926 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' D' D ' 339' ' ' GLU . . . . . . . . . . . . . 28.7 mt-10 -50.91 -32.3 20.22 Favored 'General case' 0 N--CA 1.494 1.762 0 O-C-N 121.308 -0.87 . . . . 1.99 110.109 -179.806 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' D' D ' 340' ' ' MET . . . . . . . . . . . . . 20.7 ttp -63.7 -51.28 65.75 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.069 -1.019 . . . . 0.31 109.642 -179.626 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' D' D ' 341' ' ' PHE . . . . . . . . . . . . . 34.9 m-85 -62.48 -41.59 98.89 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.11 -0.994 . . . . 0.18 109.937 -179.656 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' D' D ' 342' ' ' ARG . . . . . . . . . . . . . 6.4 tpt180 -49.27 -43.51 43.09 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.162 -0.961 . . . . 2.41 109.819 -179.793 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' D' D ' 343' ' ' GLU . . . . . . . . . . . . . 1.3 tt0 -59.26 -47.3 85.87 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.293 -0.879 . . . . 2.35 109.679 -179.766 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' D' D ' 344' ' ' LEU . . . . . . . . . . . . . 48.3 mt -61.42 -30.22 70.43 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.241 -0.912 . . . . 0.19 109.354 -179.89 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' D' D ' 345' ' ' ASN . . . . . . . . . . . . . 11.8 t-20 -58.67 -59.18 5.81 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.186 -0.946 . . . . 1.09 109.981 -179.979 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' D' D ' 346' ' ' GLU . . . . . . . . . . . . . 19.1 tt0 -60.87 -27.81 68.39 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.228 -0.92 . . . . 1.69 109.927 -179.542 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' D' D ' 347' ' ' ALA . . . . . 0.418 ' HB1' ' HB1' ' C' ' 347' ' ' ALA . . . -61.09 -61.49 2.53 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.082 -1.011 . . . . 0.18 110.111 -179.705 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' D' D ' 348' ' ' LEU . . . . . 0.629 HD22 ' N ' ' D' ' 348' ' ' LEU . 3.8 mm? -62.1 -45.89 91.49 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.368 -0.832 . . . . 0.31 110.239 -179.441 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' D' D ' 349' ' ' GLU . . . . . . . . . . . . . 3.8 mt-10 -57.6 -33.19 67.94 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.186 -0.946 . . . . 1.95 109.784 -179.299 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' D' D ' 350' ' ' LEU . . . . . 0.518 HD22 HD22 ' C' ' 350' ' ' LEU . 7.7 tt -65.01 -43.88 91.03 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.302 -0.874 . . . . 0.43 109.531 -179.98 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' D' D ' 351' ' ' LYS . . . . . . . . . . . . . 16.7 tttt -59.5 -50.16 74.98 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.502 -0.749 . . . . 1.4 109.543 -179.783 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' D' D ' 352' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 -56.62 -32.37 65.24 Favored 'General case' 0 N--CA 1.488 1.458 0 O-C-N 121.293 -0.879 . . . . 1.17 109.767 -179.799 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' D' D ' 353' ' ' ALA . . . . . . . . . . . . . . . -66.51 -32.31 73.58 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.296 -0.878 . . . . 0.59 109.929 -179.732 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' D' D ' 354' ' ' GLN . . . . . . . . . . . . . 19.9 mt-30 -83.54 -9.68 58.79 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.1 -1.0 . . . . 1.44 109.687 -179.702 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' D' D ' 355' ' ' ALA . . . . . . . . . . . . . . . -74.07 -3.19 27.93 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.253 -0.905 . . . . 0.98 110.321 -179.783 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' D' D ' 356' ' ' GLY . . . . . . . . . . . . . . . -80.66 -31.33 36.85 Favored Glycine 0 N--CA 1.492 2.402 0 N-CA-C 109.934 -1.266 . . . . 1.28 109.934 -179.44 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' D' D ' 357' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -88.15 149.3 23.98 Favored 'General case' 0 C--N 1.302 -1.458 0 O-C-N 121.186 -1.185 . . . . 4.09 109.498 -179.963 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' D' D ' 358' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -49.28 116.02 5.33 Favored Pre-proline 0 N--CA 1.489 1.502 0 O-C-N 121.292 -0.88 . . . . 5.71 109.392 -179.917 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' D' D ' 359' ' ' PRO . . . . . . . . . . . . . 4.5 Cg_exo -59.06 131.8 43.58 Favored 'Trans proline' 0 C--N 1.315 -1.202 0 C-N-CA 121.998 1.798 . . . . 4.97 110.395 -179.614 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' D' D ' 360' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.328 0 CA-C-O 117.968 -1.462 . . . . 6.97 109.592 179.99 . . . . . . . . 0 0 . 1 . 027 nuclear nobuild full ' A' A ' 319' ' ' LYS . . . . . . . . . . . . . 13.6 mttt . . . . . 0 N--CA 1.49 1.557 0 N-CA-C 109.606 -0.516 . . . . 7.55 109.606 . . . . . . . . . 0 0 . 1 . 027 nuclear nobuild full ' A' A ' 320' ' ' LYS . . . . . 0.487 ' O ' ' HD3' ' A' ' 322' ' ' PRO . 11.4 mttt 59.85 -129.73 1.04 Allowed 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.085 -1.009 . . . . 6.43 109.145 179.988 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 321' ' ' LYS . . . . . . . . . . . . . 32.1 mttt -80.62 113.59 41.06 Favored Pre-proline 0 N--CA 1.491 1.616 0 O-C-N 120.886 -1.134 . . . . 6.13 109.34 179.932 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 322' ' ' PRO . . . . . 0.487 ' HD3' ' O ' ' A' ' 320' ' ' LYS . 1.0 OUTLIER -66.45 127.74 17.9 Favored 'Trans proline' 0 C--N 1.315 -1.193 0 C-N-CA 122.004 1.803 . . . . 2.83 109.848 -179.57 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild full ' A' A ' 323' ' ' LEU . . . . . . . . . . . . . 95.5 mt -80.43 90.69 5.65 Favored 'General case' 0 C--N 1.303 -1.456 0 O-C-N 121.136 -0.978 . . . . 2.83 109.583 -179.816 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 324' ' ' ASP . . . . . . . . . . . . . 37.3 m-20 -82.16 102.41 11.07 Favored 'General case' 0 N--CA 1.489 1.484 0 O-C-N 121.228 -0.92 . . . . 1.53 109.369 179.759 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 325' ' ' GLY . . . . . 0.583 ' O ' ' CD2' ' A' ' 327' ' ' TYR . . . -68.97 -167.29 4.89 Favored Glycine 0 N--CA 1.489 2.21 0 N-CA-C 109.246 -1.542 . . . . 0.61 109.246 179.859 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 326' ' ' GLU . . . . . . . . . . . . . 5.7 mm-40 -59.42 159.44 8.07 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.217 -1.166 . . . . 2.13 109.242 179.785 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 327' ' ' TYR . . . . . 0.59 ' CE1' ' HG3' ' C' ' 333' ' ' ARG . 41.0 m-85 -148.76 108.07 3.94 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.25 -0.906 . . . . 0.48 109.849 -179.909 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 328' ' ' PHE . . . . . 0.477 ' CE2' ' HA ' ' C' ' 335' ' ' ARG . 46.7 m-85 -113.35 -166.45 1.09 Allowed 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.214 -0.929 . . . . 0.31 109.297 179.691 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 329' ' ' THR . . . . . . . . . . . . . 20.2 p -152.75 171.29 18.46 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.131 -0.98 . . . . 0.22 109.238 179.729 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 330' ' ' LEU . . . . . 0.773 HD11 HD22 ' C' ' 345' ' ' ASN . 35.0 tp -151.47 130.29 12.43 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.109 -0.995 . . . . 0.28 109.815 -179.799 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 331' ' ' GLN . . . . . . . . . . . . . 13.4 tp60 -88.22 109.12 19.67 Favored 'General case' 0 N--CA 1.488 1.471 0 O-C-N 121.446 -0.784 . . . . 0.91 108.938 179.463 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 332' ' ' ILE . . . . . . . . . . . . . 30.6 mt -103.21 106.68 20.55 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.6 0 O-C-N 120.965 -1.084 . . . . 0.26 109.641 -179.814 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 333' ' ' ARG . . . . . 0.463 ' HG2' ' CE1' ' C' ' 327' ' ' TYR . 61.8 mtt180 -72.81 148.67 44.29 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.205 -0.935 . . . . 2.92 109.585 179.873 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 334' ' ' GLY . . . . . . . . . . . . . . . 83.27 129.52 1.5 Allowed Glycine 0 N--CA 1.492 2.377 0 N-CA-C 109.648 -1.381 . . . . 0.4 109.648 179.734 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 335' ' ' ARG . . . . . . . . . . . . . 15.2 ttt180 -79.76 -32.8 41.03 Favored 'General case' 0 N--CA 1.489 1.476 0 O-C-N 121.27 -1.135 . . . . 3.01 109.486 179.774 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 336' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -56.87 -62.87 1.44 Allowed 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.359 -0.838 . . . . 2.29 109.415 -179.812 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 337' ' ' ARG . . . . . . . . . . . . . 1.4 mmt180 -60.92 -29.89 69.87 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.323 -0.861 . . . . 2.93 109.638 179.974 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 338' ' ' PHE . . . . . . . . . . . . . 72.0 t80 -54.72 -57.75 10.27 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.344 -0.848 . . . . 0.38 109.759 -179.881 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 339' ' ' GLU . . . . . . . . . . . . . 50.7 mt-10 -52.11 -36.18 50.26 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.087 -1.008 . . . . 1.97 109.958 -179.869 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 340' ' ' MET . . . . . . . . . . . . . 41.5 ttp -63.44 -46.39 86.54 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.137 -0.977 . . . . 0.31 109.888 -179.647 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 341' ' ' PHE . . . . . . . . . . . . . 39.9 m-85 -62.79 -46.25 88.86 Favored 'General case' 0 N--CA 1.494 1.74 0 O-C-N 121.106 -0.997 . . . . 0.18 110.076 -179.734 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 342' ' ' ARG . . . . . . . . . . . . . 22.3 ttt180 -49.38 -44.12 44.66 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.219 -0.926 . . . . 2.42 110.296 -179.414 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 343' ' ' GLU . . . . . . . . . . . . . 1.8 tp10 -57.33 -45.34 84.38 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.115 -0.991 . . . . 2.35 110.005 -179.735 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 344' ' ' LEU . . . . . 0.573 HD22 ' CD2' ' B' ' 344' ' ' LEU . 69.6 mt -62.59 -41.5 99.0 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.17 -0.956 . . . . 0.18 110.034 -179.558 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 345' ' ' ASN . . . . . 0.558 ' HB2' HD21 ' C' ' 330' ' ' LEU . 62.9 t-20 -56.95 -49.78 74.64 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.244 -0.91 . . . . 1.09 109.665 -179.737 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 346' ' ' GLU . . . . . . . . . . . . . 4.5 tp10 -62.72 -34.41 77.11 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.167 -0.958 . . . . 1.65 110.14 -179.788 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 347' ' ' ALA . . . . . 1.001 ' HB1' ' HB1' ' B' ' 347' ' ' ALA . . . -59.26 -55.44 34.83 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.083 -1.01 . . . . 0.18 109.956 -179.602 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 348' ' ' LEU . . . . . 0.564 HD22 ' N ' ' A' ' 348' ' ' LEU . 3.9 mm? -61.19 -44.62 97.01 Favored 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.345 -0.847 . . . . 0.3 109.871 -179.552 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 349' ' ' GLU . . . . . . . . . . . . . 2.5 mt-10 -57.4 -33.46 67.87 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.359 -0.838 . . . . 1.94 109.93 -179.364 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 350' ' ' LEU . . . . . 0.687 ' O ' HD23 ' A' ' 350' ' ' LEU . 4.8 tt -63.29 -46.27 87.51 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.175 -0.953 . . . . 0.46 109.299 -179.604 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 351' ' ' LYS . . . . . . . . . . . . . 42.8 tttt -59.58 -37.61 78.97 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.42 -0.8 . . . . 1.4 109.312 179.946 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 352' ' ' ASP . . . . . . . . . . . . . 3.5 m-20 -57.43 -43.6 84.0 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.34 -0.85 . . . . 1.16 109.698 179.837 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 353' ' ' ALA . . . . . . . . . . . . . . . -67.65 -18.69 65.04 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.183 -0.948 . . . . 0.63 109.936 -179.357 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 354' ' ' GLN . . . . . . . . . . . . . 5.7 tt0 -82.6 -11.91 58.07 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.086 -1.009 . . . . 1.47 109.445 -179.887 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 355' ' ' ALA . . . . . . . . . . . . . . . -73.06 -2.01 19.58 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.339 -0.85 . . . . 1.01 109.594 179.758 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 356' ' ' GLY . . . . . . . . . . . . . . . -77.84 -5.49 86.61 Favored Glycine 0 N--CA 1.489 2.169 0 N-CA-C 109.733 -1.347 . . . . 1.3 109.733 -179.743 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 357' ' ' LYS . . . . . . . . . . . . . 23.9 mttt -87.59 143.87 26.97 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.184 -1.186 . . . . 4.1 109.125 179.647 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 358' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -48.65 164.66 0.27 Allowed Pre-proline 0 N--CA 1.49 1.559 0 O-C-N 121.236 -0.915 . . . . 5.75 109.417 -179.895 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 359' ' ' PRO . . . . . . . . . . . . . 1.9 Cg_endo -62.53 134.44 47.86 Favored 'Trans proline' 0 C--N 1.309 -1.535 0 C-N-CA 122.285 1.99 . . . . 5.0 110.226 179.916 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 360' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.488 2.159 0 CA-C-O 117.999 -1.445 . . . . 6.97 109.602 179.782 . . . . . . . . 0 0 . 1 . 027 nuclear nobuild full ' B' B ' 319' ' ' LYS . . . . . . . . . . . . . 13.2 mttt . . . . . 0 N--CA 1.49 1.541 0 N-CA-C 109.423 -0.584 . . . . 7.55 109.423 . . . . . . . . . 0 0 . 1 . 027 nuclear nobuild full ' B' B ' 320' ' ' LYS . . . . . 0.498 ' O ' ' HD3' ' B' ' 322' ' ' PRO . 10.4 mttt 60.28 -130.01 0.95 Allowed 'General case' 0 N--CA 1.489 1.478 0 O-C-N 121.152 -0.968 . . . . 6.44 108.981 -179.57 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' B' B ' 321' ' ' LYS . . . . . . . . . . . . . 27.4 mttt -80.18 113.75 41.24 Favored Pre-proline 0 N--CA 1.488 1.472 0 O-C-N 120.935 -1.103 . . . . 6.13 109.498 -179.931 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' B' B ' 322' ' ' PRO . . . . . 0.498 ' HD3' ' O ' ' B' ' 320' ' ' LYS . 1.2 Cg_endo -66.52 127.26 16.92 Favored 'Trans proline' 0 C--N 1.315 -1.23 0 C-N-CA 122.1 1.866 . . . . 2.82 110.016 -179.845 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' B' B ' 323' ' ' LEU . . . . . . . . . . . . . 92.7 mt -80.33 90.63 5.58 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.159 -0.963 . . . . 2.84 109.528 -179.817 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' B' B ' 324' ' ' ASP . . . . . . . . . . . . . 39.9 m-20 -82.31 103.18 11.71 Favored 'General case' 0 N--CA 1.488 1.459 0 O-C-N 121.228 -0.92 . . . . 1.53 109.294 179.603 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' B' B ' 325' ' ' GLY . . . . . 0.591 ' O ' ' CD2' ' B' ' 327' ' ' TYR . . . -69.31 -166.99 5.13 Favored Glycine 0 N--CA 1.491 2.328 0 N-CA-C 109.295 -1.522 . . . . 0.59 109.295 179.976 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' B' B ' 326' ' ' GLU . . . . . . . . . . . . . 5.4 mm-40 -59.13 160.04 6.72 Favored 'General case' 0 C--N 1.304 -1.401 0 O-C-N 121.062 -1.258 . . . . 2.13 109.209 179.833 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' B' B ' 327' ' ' TYR . . . . . 0.591 ' CD2' ' O ' ' B' ' 325' ' ' GLY . 40.0 m-85 -149.36 107.22 3.69 Favored 'General case' 0 C--N 1.303 -1.421 0 O-C-N 121.183 -0.948 . . . . 0.48 109.824 -179.983 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' B' B ' 328' ' ' PHE . . . . . . . . . . . . . 45.3 m-85 -113.03 -166.13 1.05 Allowed 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.213 -0.929 . . . . 0.32 109.12 179.8 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' B' B ' 329' ' ' THR . . . . . . . . . . . . . 22.4 p -153.33 170.63 20.17 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.321 -0.862 . . . . 0.23 109.197 -179.934 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' B' B ' 330' ' ' LEU . . . . . 0.587 HD11 HD22 ' D' ' 345' ' ' ASN . 33.4 tp -150.64 130.64 13.42 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.22 -0.925 . . . . 0.28 110.023 -179.804 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' B' B ' 331' ' ' GLN . . . . . . . . . . . . . 12.6 tp60 -88.49 108.87 19.62 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.335 -0.853 . . . . 0.91 108.934 179.415 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' B' B ' 332' ' ' ILE . . . . . . . . . . . . . 30.4 mt -103.08 106.75 20.65 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.546 0 O-C-N 121.171 -0.955 . . . . 0.24 109.651 -179.621 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' B' B ' 333' ' ' ARG . . . . . 0.41 ' HG2' ' CE1' ' D' ' 327' ' ' TYR . 62.2 mtt180 -72.89 148.81 44.03 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.361 -0.837 . . . . 2.93 109.632 179.911 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' B' B ' 334' ' ' GLY . . . . . . . . . . . . . . . 83.16 129.9 1.52 Allowed Glycine 0 N--CA 1.49 2.281 0 N-CA-C 109.569 -1.412 . . . . 0.4 109.569 179.585 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' B' B ' 335' ' ' ARG . . . . . . . . . . . . . 16.7 ttt180 -79.88 -32.81 40.37 Favored 'General case' 0 N--CA 1.489 1.5 0 O-C-N 121.351 -1.087 . . . . 3.01 109.425 179.929 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' B' B ' 336' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -57.22 -62.42 1.78 Allowed 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.063 -1.023 . . . . 2.28 109.677 -179.853 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' B' B ' 337' ' ' ARG . . . . . . . . . . . . . 1.1 mmt180 -61.11 -30.61 70.46 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.223 -0.923 . . . . 2.93 109.625 -179.907 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' B' B ' 338' ' ' PHE . . . . . . . . . . . . . 69.0 t80 -54.4 -56.8 15.0 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.315 -0.865 . . . . 0.37 109.731 -179.82 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' B' B ' 339' ' ' GLU . . . . . . . . . . . . . 51.7 mt-10 -52.86 -35.59 57.79 Favored 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.24 -0.912 . . . . 1.98 109.824 -179.692 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' B' B ' 340' ' ' MET . . . . . . . . . . . . . 42.1 ttp -63.87 -46.46 84.82 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.211 -0.931 . . . . 0.32 109.874 -179.678 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' B' B ' 341' ' ' PHE . . . . . . . . . . . . . 39.6 m-85 -62.73 -46.12 89.58 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.212 -0.93 . . . . 0.18 110.055 -179.57 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' B' B ' 342' ' ' ARG . . . . . . . . . . . . . 23.0 ttt180 -48.98 -43.93 40.56 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.302 -0.874 . . . . 2.42 110.318 -179.584 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' B' B ' 343' ' ' GLU . . . . . . . . . . . . . 1.9 tp10 -58.14 -45.0 88.12 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.224 -0.922 . . . . 2.35 109.934 -179.309 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' B' B ' 344' ' ' LEU . . . . . 0.573 ' CD2' HD22 ' A' ' 344' ' ' LEU . 70.6 mt -62.68 -42.26 99.53 Favored 'General case' 0 N--CA 1.488 1.459 0 O-C-N 121.18 -0.95 . . . . 0.18 109.808 -179.693 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' B' B ' 345' ' ' ASN . . . . . 0.603 HD22 HD11 ' D' ' 330' ' ' LEU . 63.2 t-20 -55.9 -49.97 71.96 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.197 -0.939 . . . . 1.09 109.786 -179.804 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' B' B ' 346' ' ' GLU . . . . . . . . . . . . . 4.3 tp10 -62.98 -34.65 78.0 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.261 -0.899 . . . . 1.66 109.909 -179.584 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' B' B ' 347' ' ' ALA . . . . . 1.001 ' HB1' ' HB1' ' A' ' 347' ' ' ALA . . . -58.99 -55.79 30.57 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.072 -1.018 . . . . 0.17 110.047 -179.587 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' B' B ' 348' ' ' LEU . . . . . 0.58 HD22 ' N ' ' B' ' 348' ' ' LEU . 3.9 mm? -60.86 -45.05 96.06 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.213 -0.93 . . . . 0.29 109.804 -179.709 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' B' B ' 349' ' ' GLU . . . . . . . . . . . . . 2.6 mt-10 -57.21 -32.84 66.91 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.442 -0.786 . . . . 1.95 110.06 -179.509 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' B' B ' 350' ' ' LEU . . . . . 0.681 ' O ' HD23 ' B' ' 350' ' ' LEU . 4.8 tt -63.82 -46.7 83.91 Favored 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.091 -1.006 . . . . 0.45 109.399 -179.685 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' B' B ' 351' ' ' LYS . . . . . . . . . . . . . 42.6 tttt -59.19 -37.15 76.69 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.299 -0.876 . . . . 1.38 109.294 179.716 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' B' B ' 352' ' ' ASP . . . . . . . . . . . . . 2.3 m-20 -57.84 -43.46 85.86 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.336 -0.853 . . . . 1.16 109.873 -179.979 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' B' B ' 353' ' ' ALA . . . . . . . . . . . . . . . -67.42 -19.4 65.37 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.313 -0.867 . . . . 0.61 109.834 -179.722 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' B' B ' 354' ' ' GLN . . . . . . . . . . . . . 5.7 tt0 -82.09 -12.39 58.25 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.037 -1.039 . . . . 1.45 109.534 -179.713 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' B' B ' 355' ' ' ALA . . . . . . . . . . . . . . . -72.45 -1.8 17.08 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.308 -0.87 . . . . 0.98 109.683 179.733 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' B' B ' 356' ' ' GLY . . . . . . . . . . . . . . . -78.07 -5.92 87.27 Favored Glycine 0 N--CA 1.491 2.355 0 N-CA-C 109.905 -1.278 . . . . 1.29 109.905 -179.528 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' B' B ' 357' ' ' LYS . . . . . . . . . . . . . 23.2 mttt -87.14 143.17 27.42 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.161 -1.199 . . . . 4.09 109.317 179.614 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' B' B ' 358' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -48.13 164.78 0.25 Allowed Pre-proline 0 N--CA 1.491 1.605 0 O-C-N 121.203 -0.936 . . . . 5.72 109.69 -179.83 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' B' B ' 359' ' ' PRO . . . . . . . . . . . . . 1.8 Cg_endo -62.54 134.8 49.64 Favored 'Trans proline' 0 C--N 1.309 -1.511 0 C-N-CA 121.969 1.779 . . . . 4.98 110.039 179.847 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' B' B ' 360' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.355 0 N-CA-C 109.409 -1.476 . . . . 6.98 109.409 -179.95 . . . . . . . . 0 0 . 1 . 027 nuclear nobuild full ' C' C ' 319' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.49 1.541 0 N-CA-C 109.475 -0.565 . . . . 6.82 109.475 . . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' C' C ' 320' ' ' LYS . . . . . 0.482 ' O ' ' HG2' ' C' ' 321' ' ' LYS . 2.1 tttm 57.59 85.28 0.09 Allowed 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.249 -0.907 . . . . 6.49 109.347 179.914 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' C' C ' 321' ' ' LYS . . . . . 0.482 ' HG2' ' O ' ' C' ' 320' ' ' LYS . 1.1 mttt -155.13 108.45 2.27 Favored Pre-proline 0 N--CA 1.488 1.463 0 O-C-N 121.364 -0.835 . . . . 6.4 108.949 179.991 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' C' C ' 322' ' ' PRO . . . . . . . . . . . . . 3.1 Cg_exo -60.46 -166.19 0.04 OUTLIER 'Trans proline' 0 C--N 1.311 -1.446 0 C-N-CA 121.894 1.729 . . . . 3.42 110.19 -179.557 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' C' C ' 323' ' ' LEU . . . . . 0.417 HD23 ' HA ' ' C' ' 323' ' ' LEU . 85.1 mt -80.93 110.37 16.4 Favored 'General case' 0 C--N 1.303 -1.431 0 O-C-N 121.267 -0.896 . . . . 3.95 109.534 -179.897 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' C' C ' 324' ' ' ASP . . . . . . . . . . . . . 73.9 m-20 -79.35 111.42 15.58 Favored 'General case' 0 N--CA 1.487 1.398 0 O-C-N 121.114 -0.991 . . . . 1.63 108.673 179.389 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' C' C ' 325' ' ' GLY . . . . . 0.528 ' O ' ' CD2' ' C' ' 327' ' ' TYR . . . -67.04 179.91 12.93 Favored Glycine 0 N--CA 1.491 2.334 0 N-CA-C 109.102 -1.599 . . . . 0.73 109.102 -179.679 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' C' C ' 326' ' ' GLU . . . . . . . . . . . . . 1.8 mt-10 -56.25 174.73 0.12 Allowed 'General case' 0 N--CA 1.488 1.444 0 O-C-N 121.246 -1.149 . . . . 2.17 109.066 179.789 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' C' C ' 327' ' ' TYR . . . . . 0.528 ' CD2' ' O ' ' C' ' 325' ' ' GLY . 39.9 m-85 -150.81 108.37 3.65 Favored 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.139 -0.976 . . . . 0.48 109.86 -179.99 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' C' C ' 328' ' ' PHE . . . . . . . . . . . . . 98.4 m-85 -113.79 -166.97 1.14 Allowed 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.149 -0.97 . . . . 0.33 109.453 179.731 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' C' C ' 329' ' ' THR . . . . . 0.422 ' HA ' ' O ' ' A' ' 330' ' ' LEU . 6.7 p -152.03 172.41 16.34 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.107 -0.996 . . . . 0.23 109.595 -179.929 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' C' C ' 330' ' ' LEU . . . . . 0.558 HD21 ' HB2' ' A' ' 345' ' ' ASN . 31.1 tp -151.69 130.14 12.15 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.137 -0.977 . . . . 0.28 109.757 -179.609 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' C' C ' 331' ' ' GLN . . . . . . . . . . . . . 2.4 tp60 -86.85 109.85 19.58 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.208 -0.933 . . . . 1.48 109.355 179.8 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' C' C ' 332' ' ' ILE . . . . . 0.749 HG21 ' HA ' ' C' ' 338' ' ' PHE . 70.1 mt -103.16 106.04 19.37 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.518 0 O-C-N 121.185 -0.947 . . . . 0.24 109.945 -179.616 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' C' C ' 333' ' ' ARG . . . . . 0.59 ' HG3' ' CE1' ' A' ' 327' ' ' TYR . 0.0 OUTLIER -72.27 151.61 42.69 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.381 -0.825 . . . . 2.74 109.174 179.588 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild full ' C' C ' 334' ' ' GLY . . . . . . . . . . . . . . . 80.19 129.92 0.84 Allowed Glycine 0 N--CA 1.49 2.237 0 N-CA-C 109.434 -1.466 . . . . 0.35 109.434 -179.91 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' C' C ' 335' ' ' ARG . . . . . 0.477 ' HA ' ' CE2' ' A' ' 328' ' ' PHE . 10.1 ttp180 -79.18 -35.8 41.28 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.246 -1.15 . . . . 2.53 109.876 -179.678 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' C' C ' 336' ' ' GLU . . . . . . . . . . . . . 89.4 mt-10 -58.6 -63.01 1.44 Allowed 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.201 -0.937 . . . . 2.62 109.921 -179.697 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' C' C ' 337' ' ' ARG . . . . . 0.46 ' NH1' ' CG ' ' C' ' 337' ' ' ARG . 0.3 OUTLIER -59.16 -31.06 68.63 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.126 -0.983 . . . . 2.81 109.278 179.966 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild full ' C' C ' 338' ' ' PHE . . . . . 0.749 ' HA ' HG21 ' C' ' 332' ' ' ILE . 66.8 t80 -52.95 -58.58 6.48 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.272 -0.892 . . . . 0.4 109.071 179.57 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' C' C ' 339' ' ' GLU . . . . . . . . . . . . . 2.7 mm-40 -51.55 -31.29 23.84 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.341 -0.849 . . . . 2.05 109.741 179.713 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' C' C ' 340' ' ' MET . . . . . . . . . . . . . 29.5 ttp -63.74 -53.14 55.66 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.153 -0.967 . . . . 0.32 109.681 -179.811 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' C' C ' 341' ' ' PHE . . . . . 0.442 ' HB2' HD13 ' C' ' 332' ' ' ILE . 46.0 m-85 -60.58 -38.1 83.51 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.345 -0.847 . . . . 0.18 109.413 -179.989 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' C' C ' 342' ' ' ARG . . . . . . . . . . . . . 11.7 ttp180 -51.71 -53.14 42.54 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.449 -0.782 . . . . 2.91 110.283 -179.683 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' C' C ' 343' ' ' GLU . . . . . . . . . . . . . 15.9 tp10 -55.73 -42.16 74.93 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.199 -0.938 . . . . 2.14 110.26 -179.135 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' C' C ' 344' ' ' LEU . . . . . 0.452 ' O ' HD23 ' C' ' 348' ' ' LEU . 57.7 mt -61.83 -40.85 96.74 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.117 -0.99 . . . . 0.22 109.503 -179.706 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' C' C ' 345' ' ' ASN . . . . . 0.773 HD22 HD11 ' A' ' 330' ' ' LEU . 46.8 t-20 -57.6 -51.08 70.97 Favored 'General case' 0 C--N 1.303 -1.451 0 O-C-N 121.441 -0.787 . . . . 1.08 109.331 179.803 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' C' C ' 346' ' ' GLU . . . . . . . . . . . . . 3.6 tm-20 -61.75 -32.4 72.65 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.376 -0.828 . . . . 2.21 109.751 -179.993 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' C' C ' 347' ' ' ALA . . . . . 0.732 ' HB1' ' HB1' ' D' ' 347' ' ' ALA . . . -62.79 -52.85 61.56 Favored 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.249 -0.907 . . . . 0.18 109.821 -179.846 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' C' C ' 348' ' ' LEU . . . . . 0.547 HD22 ' N ' ' C' ' 348' ' ' LEU . 4.2 mm? -61.13 -48.89 79.54 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.284 -0.885 . . . . 0.32 109.644 -179.544 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' C' C ' 349' ' ' GLU . . . . . . . . . . . . . 61.1 mt-10 -58.71 -31.21 68.06 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.293 -0.88 . . . . 2.19 109.754 -179.797 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' C' C ' 350' ' ' LEU . . . . . 0.911 ' CD2' HD13 ' D' ' 350' ' ' LEU . 10.2 tt -63.37 -40.72 98.02 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.218 -0.926 . . . . 0.46 109.109 179.838 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' C' C ' 351' ' ' LYS . . . . . . . . . . . . . 36.1 tttm -61.4 -43.22 99.25 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.362 -0.836 . . . . 1.35 109.483 179.869 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' C' C ' 352' ' ' ASP . . . . . . . . . . . . . 4.4 m-20 -56.23 -49.04 75.27 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.246 -0.909 . . . . 1.19 109.551 -179.957 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' C' C ' 353' ' ' ALA . . . . . . . . . . . . . . . -68.25 -17.57 64.33 Favored 'General case' 0 N--CA 1.488 1.471 0 O-C-N 121.312 -0.868 . . . . 0.57 109.363 -179.886 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' C' C ' 354' ' ' GLN . . . . . 0.637 ' NE2' HD11 ' D' ' 350' ' ' LEU . 0.0 OUTLIER -83.77 -14.74 50.77 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.331 -0.856 . . . . 1.47 109.082 179.853 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild full ' C' C ' 355' ' ' ALA . . . . . . . . . . . . . . . -73.46 -4.51 34.14 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.409 -0.807 . . . . 0.93 110.037 -179.925 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' C' C ' 356' ' ' GLY . . . . . . . . . . . . . . . -77.29 -3.61 82.43 Favored Glycine 0 N--CA 1.49 2.293 0 N-CA-C 109.744 -1.342 . . . . 1.33 109.744 -179.62 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' C' C ' 357' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -86.91 134.19 33.54 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.266 -1.138 . . . . 4.01 109.322 179.881 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' C' C ' 358' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -47.81 137.55 10.11 Favored Pre-proline 0 C--N 1.303 -1.416 0 O-C-N 121.254 -0.904 . . . . 5.75 109.553 -179.841 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' C' C ' 359' ' ' PRO . . . . . . . . . . . . . 1.4 Cg_endo -65.33 98.93 0.34 Allowed 'Trans proline' 0 C--N 1.312 -1.369 0 C-N-CA 122.15 1.9 . . . . 4.94 109.888 179.548 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' C' C ' 360' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.312 0 N-CA-C 109.313 -1.515 . . . . 6.5 109.313 -179.942 . . . . . . . . 0 0 . 1 . 027 nuclear nobuild full ' D' D ' 319' ' ' LYS . . . . . . . . . . . . . 13.8 mttt . . . . . 0 N--CA 1.488 1.46 0 N-CA-C 109.419 -0.586 . . . . 7.53 109.419 . . . . . . . . . 0 0 . 1 . 027 nuclear nobuild full ' D' D ' 320' ' ' LYS . . . . . 0.495 ' O ' ' HD3' ' D' ' 322' ' ' PRO . 10.2 mttt 60.28 -128.72 1.0 Allowed 'General case' 0 N--CA 1.491 1.598 0 O-C-N 120.988 -1.07 . . . . 6.41 109.284 179.783 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' D' D ' 321' ' ' LYS . . . . . . . . . . . . . 22.3 mttt -81.22 113.77 43.88 Favored Pre-proline 0 N--CA 1.492 1.626 0 O-C-N 120.843 -1.161 . . . . 6.11 109.462 179.987 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' D' D ' 322' ' ' PRO . . . . . 0.495 ' HD3' ' O ' ' D' ' 320' ' ' LYS . 0.9 OUTLIER -66.64 128.27 18.74 Favored 'Trans proline' 0 C--N 1.311 -1.405 0 C-N-CA 121.931 1.754 . . . . 2.82 109.985 179.98 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild full ' D' D ' 323' ' ' LEU . . . . . . . . . . . . . 90.7 mt -81.12 91.15 6.09 Favored 'General case' 0 C--N 1.303 -1.454 0 O-C-N 121.223 -0.923 . . . . 2.83 109.472 -179.892 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' D' D ' 324' ' ' ASP . . . . . . . . . . . . . 44.8 m-20 -82.62 103.46 12.16 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.203 -0.936 . . . . 1.54 109.037 179.701 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' D' D ' 325' ' ' GLY . . . . . 0.573 ' O ' ' CD2' ' D' ' 327' ' ' TYR . . . -69.24 -166.22 4.67 Favored Glycine 0 N--CA 1.489 2.18 0 N-CA-C 109.242 -1.543 . . . . 0.59 109.242 -179.947 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' D' D ' 326' ' ' GLU . . . . . . . . . . . . . 5.6 mm-40 -59.83 160.22 7.91 Favored 'General case' 0 N--CA 1.489 1.476 0 O-C-N 121.171 -1.193 . . . . 2.13 109.039 179.664 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' D' D ' 327' ' ' TYR . . . . . 0.573 ' CD2' ' O ' ' D' ' 325' ' ' GLY . 41.2 m-85 -149.54 107.25 3.67 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.106 -0.996 . . . . 0.47 109.75 -179.899 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' D' D ' 328' ' ' PHE . . . . . . . . . . . . . 45.9 m-85 -112.99 -166.06 1.05 Allowed 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.336 -0.852 . . . . 0.3 109.458 179.708 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' D' D ' 329' ' ' THR . . . . . . . . . . . . . 30.8 p -153.07 170.46 20.41 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.167 -0.958 . . . . 0.22 109.348 179.879 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' D' D ' 330' ' ' LEU . . . . . 0.603 HD11 HD22 ' B' ' 345' ' ' ASN . 32.4 tp -150.46 130.41 13.4 Favored 'General case' 0 C--N 1.304 -1.41 0 O-C-N 121.125 -0.984 . . . . 0.28 109.911 -179.973 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' D' D ' 331' ' ' GLN . . . . . . . . . . . . . 11.0 tp60 -88.41 108.56 19.43 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.427 -0.795 . . . . 0.93 108.961 179.526 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' D' D ' 332' ' ' ILE . . . . . . . . . . . . . 25.3 mt -103.0 106.41 20.01 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.617 0 O-C-N 121.045 -1.034 . . . . 0.25 109.831 -179.632 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' D' D ' 333' ' ' ARG . . . . . . . . . . . . . 60.6 mtt180 -72.46 148.35 45.21 Favored 'General case' 0 N--CA 1.488 1.452 0 O-C-N 121.403 -0.811 . . . . 2.93 109.574 179.956 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' D' D ' 334' ' ' GLY . . . . . . . . . . . . . . . 83.47 130.43 1.71 Allowed Glycine 0 N--CA 1.492 2.37 0 N-CA-C 109.834 -1.306 . . . . 0.41 109.834 179.676 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' D' D ' 335' ' ' ARG . . . . . . . . . . . . . 19.5 ttt180 -79.82 -32.81 40.67 Favored 'General case' 0 N--CA 1.489 1.478 0 O-C-N 121.293 -1.122 . . . . 3.03 109.499 179.851 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' D' D ' 336' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -57.44 -63.49 1.21 Allowed 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.272 -0.892 . . . . 2.26 109.636 -179.91 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' D' D ' 337' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -60.45 -29.88 69.3 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.112 -0.992 . . . . 2.92 109.694 -179.983 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' D' D ' 338' ' ' PHE . . . . . . . . . . . . . 69.2 t80 -55.23 -56.7 16.95 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.224 -0.922 . . . . 0.37 109.648 -179.722 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' D' D ' 339' ' ' GLU . . . . . . . . . . . . . 52.9 mt-10 -52.53 -35.62 53.81 Favored 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.278 -0.889 . . . . 1.99 109.948 -179.824 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' D' D ' 340' ' ' MET . . . . . . . . . . . . . 42.4 ttp -63.94 -45.98 86.74 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.25 -0.906 . . . . 0.31 109.916 -179.615 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' D' D ' 341' ' ' PHE . . . . . . . . . . . . . 40.1 m-85 -63.44 -45.53 90.47 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.306 -0.871 . . . . 0.18 110.005 -179.464 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' D' D ' 342' ' ' ARG . . . . . . . . . . . . . 22.1 ttt180 -49.4 -43.5 44.47 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.172 -0.955 . . . . 2.41 110.145 -179.401 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' D' D ' 343' ' ' GLU . . . . . . . . . . . . . 2.1 tp10 -57.98 -45.44 86.75 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.138 -0.976 . . . . 2.35 109.96 -179.263 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' D' D ' 344' ' ' LEU . . . . . . . . . . . . . 70.9 mt -62.5 -42.28 99.4 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.257 -0.902 . . . . 0.19 109.956 -179.661 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' D' D ' 345' ' ' ASN . . . . . 0.587 HD22 HD11 ' B' ' 330' ' ' LEU . 63.5 t-20 -56.27 -49.56 73.87 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.145 -0.972 . . . . 1.09 109.471 -179.723 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' D' D ' 346' ' ' GLU . . . . . . . . . . . . . 4.1 tp10 -62.64 -34.96 78.13 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.269 -0.894 . . . . 1.69 110.116 -179.932 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' D' D ' 347' ' ' ALA . . . . . 0.732 ' HB1' ' HB1' ' C' ' 347' ' ' ALA . . . -59.44 -56.04 27.09 Favored 'General case' 0 N--CA 1.493 1.692 0 O-C-N 120.984 -1.072 . . . . 0.18 110.104 -179.611 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' D' D ' 348' ' ' LEU . . . . . 0.583 HD22 ' N ' ' D' ' 348' ' ' LEU . 3.9 mm? -60.67 -44.84 95.99 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.156 -0.965 . . . . 0.31 109.789 -179.761 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' D' D ' 349' ' ' GLU . . . . . . . . . . . . . 2.5 mt-10 -57.71 -32.62 67.58 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.421 -0.8 . . . . 1.95 109.97 -179.45 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' D' D ' 350' ' ' LEU . . . . . 0.911 HD13 ' CD2' ' C' ' 350' ' ' LEU . 4.9 tt -63.8 -46.75 83.74 Favored 'General case' 0 N--CA 1.489 1.479 0 O-C-N 120.927 -1.108 . . . . 0.43 109.365 -179.79 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' D' D ' 351' ' ' LYS . . . . . . . . . . . . . 39.0 tttt -59.29 -36.7 76.07 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.443 -0.786 . . . . 1.4 109.413 -179.935 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' D' D ' 352' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -58.31 -43.08 87.99 Favored 'General case' 0 N--CA 1.489 1.475 0 O-C-N 121.34 -0.85 . . . . 1.17 109.634 -179.961 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' D' D ' 353' ' ' ALA . . . . . . . . . . . . . . . -67.59 -19.06 65.2 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.201 -0.937 . . . . 0.59 110.091 -179.413 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' D' D ' 354' ' ' GLN . . . . . . . . . . . . . 5.9 tt0 -82.41 -11.59 58.45 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.285 -0.885 . . . . 1.44 109.554 -179.744 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' D' D ' 355' ' ' ALA . . . . . . . . . . . . . . . -73.18 -1.34 17.24 Favored 'General case' 0 N--CA 1.489 1.492 0 O-C-N 121.271 -0.893 . . . . 0.98 109.703 179.742 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' D' D ' 356' ' ' GLY . . . . . . . . . . . . . . . -77.9 -5.83 86.92 Favored Glycine 0 N--CA 1.491 2.337 0 N-CA-C 110.055 -1.218 . . . . 1.28 110.055 -179.646 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' D' D ' 357' ' ' LYS . . . . . . . . . . . . . 26.7 mttt -87.36 143.21 27.36 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.112 -1.228 . . . . 4.09 109.251 179.716 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' D' D ' 358' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -48.13 165.83 0.23 Allowed Pre-proline 0 N--CA 1.491 1.614 0 O-C-N 121.259 -0.9 . . . . 5.71 109.326 -179.943 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' D' D ' 359' ' ' PRO . . . . . . . . . . . . . 1.9 Cg_endo -62.19 134.42 48.88 Favored 'Trans proline' 0 C--N 1.308 -1.577 0 C-N-CA 122.291 1.994 . . . . 4.97 110.049 179.879 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' D' D ' 360' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.321 0 CA-C-O 118.054 -1.414 . . . . 6.97 109.649 179.99 . . . . . . . . 0 0 . 1 . 028 nuclear nobuild full ' A' A ' 319' ' ' LYS . . . . . 0.425 ' O ' ' O ' ' A' ' 320' ' ' LYS . 3.1 mmtt . . . . . 0 N--CA 1.491 1.582 0 N-CA-C 109.38 -0.6 . . . . 7.55 109.38 . . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 320' ' ' LYS . . . . . 0.425 ' O ' ' O ' ' A' ' 319' ' ' LYS . 1.1 tptt 62.31 131.75 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.142 -0.974 . . . . 6.43 109.868 179.701 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 321' ' ' LYS . . . . . . . . . . . . . 8.4 mttt -157.43 141.9 11.86 Favored Pre-proline 0 N--CA 1.487 1.407 0 O-C-N 121.243 -0.911 . . . . 6.13 109.575 -179.889 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 322' ' ' PRO . . . . . . . . . . . . . 1.6 Cg_endo -64.24 -80.83 0.01 OUTLIER 'Trans proline' 0 C--N 1.309 -1.513 0 C-N-CA 121.944 1.763 . . . . 2.83 109.656 179.727 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 323' ' ' LEU . . . . . . . . . . . . . 22.2 mt -79.66 114.09 18.31 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.292 -0.88 . . . . 2.83 109.119 179.782 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 324' ' ' ASP . . . . . . . . . . . . . 41.4 m-20 -79.64 147.8 31.88 Favored 'General case' 0 N--CA 1.489 1.477 0 O-C-N 121.195 -0.94 . . . . 1.53 109.407 -179.774 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 325' ' ' GLY . . . . . . . . . . . . . . . -67.66 167.34 41.42 Favored Glycine 0 N--CA 1.49 2.256 0 N-CA-C 109.269 -1.533 . . . . 0.61 109.269 -179.937 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 326' ' ' GLU . . . . . . . . . . . . . 32.2 mm-40 -57.08 174.26 0.18 Allowed 'General case' 0 N--CA 1.488 1.447 0 O-C-N 121.04 -1.27 . . . . 2.13 109.594 -179.776 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 327' ' ' TYR . . . . . 0.424 ' CE1' ' HG2' ' C' ' 333' ' ' ARG . 39.4 m-85 -148.24 110.99 4.77 Favored 'General case' 0 C--N 1.303 -1.416 0 O-C-N 121.246 -0.909 . . . . 0.48 109.759 179.998 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 328' ' ' PHE . . . . . . . . . . . . . 29.5 m-85 -113.9 -171.78 1.96 Allowed 'General case' 0 C--N 1.301 -1.533 0 O-C-N 121.428 -0.795 . . . . 0.31 109.395 179.753 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 329' ' ' THR . . . . . . . . . . . . . 3.3 p -149.16 167.0 27.14 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.307 -0.871 . . . . 0.22 109.059 179.898 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 330' ' ' LEU . . . . . 0.413 ' O ' ' HA ' ' C' ' 329' ' ' THR . 63.3 tp -149.82 129.29 13.01 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.313 -0.867 . . . . 0.28 109.762 -179.576 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 331' ' ' GLN . . . . . . . . . . . . . 1.1 tp60 -87.32 113.2 22.83 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.394 -0.816 . . . . 0.91 109.418 179.701 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 332' ' ' ILE . . . . . 0.665 HG21 ' HA ' ' A' ' 338' ' ' PHE . 69.7 mt -102.19 107.63 22.16 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.527 0 O-C-N 121.112 -0.993 . . . . 0.26 109.611 -179.959 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 333' ' ' ARG . . . . . 0.462 ' HG2' ' CE1' ' C' ' 327' ' ' TYR . 76.1 mtt180 -72.51 143.75 48.25 Favored 'General case' 0 C--N 1.303 -1.445 0 O-C-N 121.492 -0.755 . . . . 2.92 109.456 179.925 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 334' ' ' GLY . . . . . . . . . . . . . . . 85.43 128.26 1.98 Allowed Glycine 0 N--CA 1.49 2.252 0 N-CA-C 109.596 -1.402 . . . . 0.4 109.596 179.949 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 335' ' ' ARG . . . . . . . . . . . . . 9.2 ttp180 -77.06 -33.36 57.22 Favored 'General case' 0 C--N 1.303 -1.433 0 O-C-N 121.388 -1.066 . . . . 3.01 109.197 179.903 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 336' ' ' GLU . . . . . . . . . . . . . 15.1 mt-10 -59.19 -63.89 1.14 Allowed 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.326 -0.859 . . . . 2.29 109.936 -179.781 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 337' ' ' ARG . . . . . 0.46 ' NH1' ' CG ' ' A' ' 337' ' ' ARG . 0.0 OUTLIER -59.25 -29.83 67.83 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 120.985 -1.072 . . . . 2.93 109.496 -179.791 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild full ' A' A ' 338' ' ' PHE . . . . . 0.665 ' HA ' HG21 ' A' ' 332' ' ' ILE . 66.5 t80 -55.3 -54.14 47.22 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.199 -0.938 . . . . 0.38 109.544 179.867 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 339' ' ' GLU . . . . . . . . . . . . . 44.6 mt-10 -53.89 -35.37 61.51 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.26 -0.9 . . . . 1.97 109.91 179.979 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 340' ' ' MET . . . . . . . . . . . . . 6.7 ttp -63.46 -52.74 60.12 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.17 -0.956 . . . . 0.31 110.442 -179.075 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 341' ' ' PHE . . . . . . . . . . . . . 51.7 m-85 -60.74 -42.38 97.22 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.05 -1.031 . . . . 0.18 109.816 -179.353 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 342' ' ' ARG . . . . . . . . . . . . . 60.6 ttt180 -50.86 -43.34 59.31 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.357 -0.84 . . . . 2.42 109.884 -179.73 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 343' ' ' GLU . . . . . . . . . . . . . 3.9 tt0 -59.67 -45.99 90.4 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.178 -0.951 . . . . 2.35 109.954 -179.553 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 344' ' ' LEU . . . . . 0.456 HD22 ' CD2' ' B' ' 344' ' ' LEU . 42.8 mt -61.3 -38.69 87.72 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.248 -0.907 . . . . 0.18 109.889 -179.625 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 345' ' ' ASN . . . . . . . . . . . . . 64.2 t-20 -57.77 -49.64 75.9 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.202 -0.936 . . . . 1.09 110.002 -179.773 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 346' ' ' GLU . . . . . . . . . . . . . 45.8 tt0 -60.78 -33.1 72.47 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.103 -0.998 . . . . 1.65 109.837 -179.666 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 347' ' ' ALA . . . . . 0.973 ' HB1' ' HB1' ' B' ' 347' ' ' ALA . . . -59.7 -55.4 34.81 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.058 -1.026 . . . . 0.18 110.013 -179.618 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 348' ' ' LEU . . . . . 0.629 HD22 ' N ' ' A' ' 348' ' ' LEU . 3.9 mm? -62.7 -40.22 96.46 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.167 -0.958 . . . . 0.3 109.909 -179.455 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 349' ' ' GLU . . . . . 0.449 ' OE2' ' HD3' ' C' ' 333' ' ' ARG . 7.3 mm-40 -57.65 -39.48 77.11 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.218 -0.926 . . . . 1.94 109.792 -179.431 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 350' ' ' LEU . . . . . 0.705 HD13 HD22 ' B' ' 350' ' ' LEU . 7.6 tt -61.86 -44.59 96.52 Favored 'General case' 0 N--CA 1.488 1.463 0 O-C-N 121.321 -0.862 . . . . 0.46 109.334 -179.972 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 351' ' ' LYS . . . . . . . . . . . . . 42.0 tttt -58.85 -43.5 90.81 Favored 'General case' 0 N--CA 1.488 1.468 0 O-C-N 121.326 -0.859 . . . . 1.4 109.235 179.98 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 352' ' ' ASP . . . . . . . . . . . . . 7.3 m-20 -56.65 -55.37 34.93 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.346 -0.846 . . . . 1.16 109.676 -179.976 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 353' ' ' ALA . . . . . . . . . . . . . . . -69.02 -11.45 60.8 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.23 -0.919 . . . . 0.63 109.386 179.937 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 354' ' ' GLN . . . . . 0.409 ' HB2' ' O ' ' A' ' 350' ' ' LEU . 2.9 tt0 -84.51 -14.62 48.51 Favored 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.181 -0.95 . . . . 1.47 109.488 -179.699 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 355' ' ' ALA . . . . . . . . . . . . . . . -73.08 -9.68 58.99 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.265 -0.897 . . . . 1.01 109.528 179.905 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 356' ' ' GLY . . . . . . . . . . . . . . . -79.94 -3.54 89.38 Favored Glycine 0 N--CA 1.491 2.357 0 N-CA-C 109.684 -1.366 . . . . 1.3 109.684 -179.932 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 357' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -87.09 101.11 13.16 Favored 'General case' 0 N--CA 1.489 1.492 0 O-C-N 121.241 -1.153 . . . . 4.1 109.541 179.971 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 358' ' ' GLU . . . . . 0.457 ' HB2' ' HD2' ' A' ' 359' ' ' PRO . 26.4 pt-20 -51.05 157.6 1.41 Allowed Pre-proline 0 N--CA 1.491 1.595 0 O-C-N 121.114 -0.991 . . . . 5.75 109.313 179.933 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 359' ' ' PRO . . . . . 0.457 ' HD2' ' HB2' ' A' ' 358' ' ' GLU . 2.4 Cg_endo -60.95 86.32 0.08 OUTLIER 'Trans proline' 0 C--N 1.307 -1.608 0 C-N-CA 121.972 1.781 . . . . 5.0 110.225 179.736 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 360' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.493 2.462 0 CA-C-O 117.981 -1.455 . . . . 6.97 109.719 -179.921 . . . . . . . . 0 0 . 1 . 028 nuclear nobuild full ' B' B ' 319' ' ' LYS . . . . . 0.452 ' O ' ' O ' ' B' ' 320' ' ' LYS . 3.2 mmtt . . . . . 0 N--CA 1.488 1.434 0 N-CA-C 109.195 -0.668 . . . . 7.55 109.195 . . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' B' B ' 320' ' ' LYS . . . . . 0.452 ' O ' ' O ' ' B' ' 319' ' ' LYS . 1.5 tptt 61.62 132.94 0.01 OUTLIER 'General case' 0 C--N 1.302 -1.496 0 O-C-N 121.294 -0.879 . . . . 6.44 109.737 179.977 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' B' B ' 321' ' ' LYS . . . . . . . . . . . . . 8.4 mttt -158.2 140.67 10.43 Favored Pre-proline 0 N--CA 1.489 1.505 0 O-C-N 121.322 -0.861 . . . . 6.13 109.63 -179.884 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' B' B ' 322' ' ' PRO . . . . . . . . . . . . . 1.5 Cg_endo -63.2 -81.03 0.01 OUTLIER 'Trans proline' 0 C--N 1.31 -1.49 0 C-N-CA 122.301 2.001 . . . . 2.82 109.54 179.471 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' B' B ' 323' ' ' LEU . . . . . . . . . . . . . 22.1 mt -79.68 114.16 18.39 Favored 'General case' 0 N--CA 1.489 1.484 0 O-C-N 121.161 -0.962 . . . . 2.84 109.28 179.814 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' B' B ' 324' ' ' ASP . . . . . . . . . . . . . 40.0 m-20 -79.66 145.34 33.06 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.294 -0.879 . . . . 1.53 109.657 179.938 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' B' B ' 325' ' ' GLY . . . . . . . . . . . . . . . -65.26 167.35 32.05 Favored Glycine 0 N--CA 1.491 2.344 0 N-CA-C 109.602 -1.399 . . . . 0.59 109.602 179.901 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' B' B ' 326' ' ' GLU . . . . . . . . . . . . . 30.9 mm-40 -57.16 174.07 0.2 Allowed 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.103 -1.233 . . . . 2.13 109.522 -179.895 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' B' B ' 327' ' ' TYR . . . . . . . . . . . . . 38.0 m-85 -148.62 110.51 4.55 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.324 -0.86 . . . . 0.48 109.764 -179.695 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' B' B ' 328' ' ' PHE . . . . . 0.442 ' CZ ' ' HB2' ' D' ' 335' ' ' ARG . 30.7 m-85 -114.3 -172.9 2.19 Favored 'General case' 0 N--CA 1.489 1.491 0 O-C-N 121.53 -0.731 . . . . 0.32 109.626 179.862 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' B' B ' 329' ' ' THR . . . . . 0.418 ' HA ' ' O ' ' D' ' 330' ' ' LEU . 3.2 p -148.36 167.19 25.89 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.096 -1.002 . . . . 0.23 109.143 -179.905 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' B' B ' 330' ' ' LEU . . . . . . . . . . . . . 62.0 tp -150.17 129.6 12.97 Favored 'General case' 0 C--N 1.303 -1.438 0 O-C-N 121.238 -0.914 . . . . 0.28 109.617 -179.501 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' B' B ' 331' ' ' GLN . . . . . . . . . . . . . 1.1 tp60 -87.47 114.17 23.84 Favored 'General case' 0 C--N 1.304 -1.412 0 O-C-N 121.3 -0.875 . . . . 0.91 109.007 179.608 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' B' B ' 332' ' ' ILE . . . . . 0.643 HG21 ' HA ' ' B' ' 338' ' ' PHE . 70.1 mt -102.87 106.75 20.59 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.465 0 O-C-N 121.227 -0.921 . . . . 0.24 109.256 -179.749 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' B' B ' 333' ' ' ARG . . . . . . . . . . . . . 74.9 mtt180 -71.78 144.42 49.2 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.157 -0.964 . . . . 2.93 109.458 -179.871 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' B' B ' 334' ' ' GLY . . . . . . . . . . . . . . . 84.75 128.39 1.79 Allowed Glycine 0 N--CA 1.489 2.229 0 N-CA-C 109.741 -1.344 . . . . 0.4 109.741 179.886 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' B' B ' 335' ' ' ARG . . . . . . . . . . . . . 8.5 ttp180 -77.42 -32.96 55.02 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.321 -1.106 . . . . 3.01 109.449 179.866 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' B' B ' 336' ' ' GLU . . . . . . . . . . . . . 14.1 mt-10 -59.77 -62.8 1.61 Allowed 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.242 -0.911 . . . . 2.28 109.843 -179.69 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' B' B ' 337' ' ' ARG . . . . . 0.476 HH11 ' CG ' ' B' ' 337' ' ' ARG . 0.0 OUTLIER -59.96 -30.04 68.83 Favored 'General case' 0 N--CA 1.488 1.472 0 O-C-N 121.166 -0.959 . . . . 2.93 109.354 -179.794 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild full ' B' B ' 338' ' ' PHE . . . . . 0.643 ' HA ' HG21 ' B' ' 332' ' ' ILE . 66.8 t80 -55.39 -53.75 52.31 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.146 -0.971 . . . . 0.37 109.629 179.9 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' B' B ' 339' ' ' GLU . . . . . . . . . . . . . 49.3 mt-10 -53.84 -35.83 61.91 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.134 -0.979 . . . . 1.98 109.976 179.827 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' B' B ' 340' ' ' MET . . . . . . . . . . . . . 6.2 ttp -63.12 -52.21 63.48 Favored 'General case' 0 N--CA 1.495 1.785 0 O-C-N 121.196 -0.94 . . . . 0.32 110.649 -179.141 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' B' B ' 341' ' ' PHE . . . . . . . . . . . . . 49.5 m-85 -60.93 -43.49 98.57 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.13 -0.981 . . . . 0.18 109.59 -179.494 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' B' B ' 342' ' ' ARG . . . . . . . . . . . . . 61.7 ttt180 -49.99 -43.38 50.45 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.433 -0.792 . . . . 2.42 109.993 -179.841 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' B' B ' 343' ' ' GLU . . . . . . . . . . . . . 3.7 tt0 -59.88 -45.86 91.16 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.232 -0.918 . . . . 2.35 110.14 -179.536 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' B' B ' 344' ' ' LEU . . . . . 0.456 ' CD2' HD22 ' A' ' 344' ' ' LEU . 43.5 mt -61.84 -37.95 86.36 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.189 -0.945 . . . . 0.18 110.024 -179.621 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' B' B ' 345' ' ' ASN . . . . . 0.543 HD22 HD11 ' D' ' 330' ' ' LEU . 64.8 t-20 -58.23 -49.05 78.45 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.291 -0.88 . . . . 1.09 109.879 -179.708 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' B' B ' 346' ' ' GLU . . . . . . . . . . . . . 46.8 tt0 -60.98 -32.95 72.5 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.209 -0.932 . . . . 1.66 109.819 -179.669 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' B' B ' 347' ' ' ALA . . . . . 0.973 ' HB1' ' HB1' ' A' ' 347' ' ' ALA . . . -60.03 -56.18 24.87 Favored 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.101 -1.0 . . . . 0.17 110.009 -179.598 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' B' B ' 348' ' ' LEU . . . . . 0.642 HD22 ' N ' ' B' ' 348' ' ' LEU . 3.9 mm? -62.25 -40.36 95.94 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.284 -0.885 . . . . 0.29 109.866 -179.567 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' B' B ' 349' ' ' GLU . . . . . . . . . . . . . 7.2 mm-40 -57.43 -39.17 75.65 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 121.211 -0.93 . . . . 1.95 109.913 -179.648 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' B' B ' 350' ' ' LEU . . . . . 0.705 HD22 HD13 ' A' ' 350' ' ' LEU . 7.7 tt -62.35 -45.29 93.84 Favored 'General case' 0 N--CA 1.488 1.456 0 O-C-N 121.201 -0.937 . . . . 0.45 109.242 -179.786 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' B' B ' 351' ' ' LYS . . . . . . . . . . . . . 39.2 tttt -58.16 -43.94 87.69 Favored 'General case' 0 C--N 1.302 -1.457 0 O-C-N 121.297 -0.877 . . . . 1.38 109.286 179.975 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' B' B ' 352' ' ' ASP . . . . . . . . . . . . . 7.4 m-20 -56.13 -55.72 29.56 Favored 'General case' 0 N--CA 1.488 1.439 0 O-C-N 121.279 -0.888 . . . . 1.16 109.526 -179.953 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' B' B ' 353' ' ' ALA . . . . . . . . . . . . . . . -68.38 -12.35 60.98 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.153 -0.967 . . . . 0.61 109.777 179.977 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' B' B ' 354' ' ' GLN . . . . . 0.437 ' NE2' ' CD1' ' A' ' 350' ' ' LEU . 3.2 tt0 -84.08 -13.58 52.68 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.326 -0.859 . . . . 1.45 109.683 -179.772 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' B' B ' 355' ' ' ALA . . . . . . . . . . . . . . . -73.41 -10.27 59.56 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.181 -0.949 . . . . 0.98 109.67 179.783 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' B' B ' 356' ' ' GLY . . . . . . . . . . . . . . . -80.15 -3.31 89.59 Favored Glycine 0 N--CA 1.49 2.275 0 N-CA-C 109.498 -1.441 . . . . 1.29 109.498 -179.995 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' B' B ' 357' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -87.0 100.47 12.64 Favored 'General case' 0 N--CA 1.487 1.425 0 O-C-N 121.322 -1.105 . . . . 4.09 109.399 179.828 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' B' B ' 358' ' ' GLU . . . . . 0.453 ' HB2' ' HD2' ' B' ' 359' ' ' PRO . 27.1 pt-20 -50.84 157.57 1.33 Allowed Pre-proline 0 C--N 1.302 -1.475 0 O-C-N 121.177 -0.952 . . . . 5.72 109.347 179.872 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' B' B ' 359' ' ' PRO . . . . . 0.453 ' HD2' ' HB2' ' B' ' 358' ' ' GLU . 3.3 Cg_exo -60.55 85.04 0.08 OUTLIER 'Trans proline' 0 C--N 1.309 -1.546 0 C-N-CA 122.202 1.934 . . . . 4.98 110.171 179.82 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' B' B ' 360' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.487 2.055 0 CA-C-O 117.934 -1.481 . . . . 6.98 109.622 -179.946 . . . . . . . . 0 0 . 1 . 028 nuclear nobuild full ' C' C ' 319' ' ' LYS . . . . . 0.44 ' O ' ' O ' ' C' ' 320' ' ' LYS . 0.0 OUTLIER . . . . . 0 N--CA 1.489 1.487 0 N-CA-C 109.391 -0.596 . . . . 6.82 109.391 . . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' C' C ' 320' ' ' LYS . . . . . 0.44 ' O ' ' O ' ' C' ' 319' ' ' LYS . 0.6 OUTLIER 61.93 126.16 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.267 -0.895 . . . . 6.49 109.125 -179.825 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild full ' C' C ' 321' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -157.24 154.31 25.59 Favored Pre-proline 0 N--CA 1.489 1.507 0 O-C-N 121.205 -0.934 . . . . 6.4 109.702 -179.713 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' C' C ' 322' ' ' PRO . . . . . . . . . . . . . 1.6 Cg_endo -63.17 -81.77 0.01 OUTLIER 'Trans proline' 0 C--N 1.311 -1.438 0 C-N-CA 122.346 2.031 . . . . 3.42 110.388 179.834 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' C' C ' 323' ' ' LEU . . . . . 0.448 ' HA ' HD23 ' C' ' 323' ' ' LEU . 21.2 mt -82.69 104.14 12.72 Favored 'General case' 0 N--CA 1.495 1.779 0 O-C-N 121.234 -0.916 . . . . 3.95 109.698 -179.964 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' C' C ' 324' ' ' ASP . . . . . . . . . . . . . 4.8 m-20 -79.82 139.22 37.29 Favored 'General case' 0 C--N 1.303 -1.449 0 O-C-N 121.275 -0.891 . . . . 1.63 109.575 179.855 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' C' C ' 325' ' ' GLY . . . . . 0.466 ' O ' ' CD2' ' C' ' 327' ' ' TYR . . . -67.8 171.06 35.25 Favored Glycine 0 N--CA 1.491 2.335 0 N-CA-C 109.502 -1.439 . . . . 0.73 109.502 -179.897 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' C' C ' 326' ' ' GLU . . . . . 0.51 ' HB3' ' CE2' ' C' ' 328' ' ' PHE . 13.5 mm-40 -58.11 166.78 1.46 Allowed 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.124 -1.221 . . . . 2.17 109.398 -179.905 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' C' C ' 327' ' ' TYR . . . . . 0.466 ' CD2' ' O ' ' C' ' 325' ' ' GLY . 38.4 m-85 -147.22 99.09 3.11 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.184 -0.948 . . . . 0.48 109.475 179.965 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' C' C ' 328' ' ' PHE . . . . . 0.51 ' CE2' ' HB3' ' C' ' 326' ' ' GLU . 95.0 m-85 -106.85 -167.03 1.23 Allowed 'General case' 0 N--CA 1.487 1.406 0 O-C-N 121.485 -0.759 . . . . 0.33 109.055 179.914 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' C' C ' 329' ' ' THR . . . . . 0.413 ' HA ' ' O ' ' A' ' 330' ' ' LEU . 41.5 p -150.98 169.0 22.86 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.31 -0.869 . . . . 0.23 109.353 179.967 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' C' C ' 330' ' ' LEU . . . . . 0.401 HD12 ' HA ' ' C' ' 330' ' ' LEU . 29.0 tp -148.72 127.52 12.58 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.214 -0.929 . . . . 0.28 109.622 -179.853 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' C' C ' 331' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -87.62 111.64 21.47 Favored 'General case' 0 N--CA 1.489 1.479 0 O-C-N 121.308 -0.87 . . . . 1.48 109.367 179.806 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' C' C ' 332' ' ' ILE . . . . . 0.439 HD12 ' CD1' ' C' ' 338' ' ' PHE . 7.3 mt -103.9 108.04 23.67 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.448 0 O-C-N 121.183 -0.948 . . . . 0.24 109.436 179.748 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' C' C ' 333' ' ' ARG . . . . . 0.468 ' NH1' ' HG2' ' C' ' 333' ' ' ARG . 0.0 OUTLIER -73.47 158.39 35.02 Favored 'General case' 0 C--N 1.303 -1.424 0 O-C-N 121.293 -0.879 . . . . 2.74 108.871 179.516 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild full ' C' C ' 334' ' ' GLY . . . . . . . . . . . . . . . 74.04 125.94 0.13 Allowed Glycine 0 N--CA 1.491 2.303 0 N-CA-C 109.452 -1.459 . . . . 0.35 109.452 -179.929 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' C' C ' 335' ' ' ARG . . . . . 0.521 ' HG3' ' NH1' ' C' ' 335' ' ' ARG . 0.0 OUTLIER -74.75 -33.32 62.31 Favored 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.117 -1.226 . . . . 2.53 109.775 -179.861 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild full ' C' C ' 336' ' ' GLU . . . . . . . . . . . . . 1.3 mt-10 -57.49 -59.84 4.55 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.115 -0.991 . . . . 2.62 109.678 -179.88 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' C' C ' 337' ' ' ARG . . . . . . . . . . . . . 1.7 mpt_? -61.16 -32.97 72.69 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.252 -0.905 . . . . 2.81 109.982 -179.688 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' C' C ' 338' ' ' PHE . . . . . 0.439 ' CD1' HD12 ' C' ' 332' ' ' ILE . 63.7 t80 -55.49 -61.62 2.22 Favored 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.041 -1.037 . . . . 0.4 109.615 -179.797 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' C' C ' 339' ' ' GLU . . . . . . . . . . . . . 1.1 mm-40 -49.38 -36.64 22.39 Favored 'General case' 0 C--N 1.3 -1.547 0 O-C-N 121.407 -0.808 . . . . 2.05 110.358 -179.114 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' C' C ' 340' ' ' MET . . . . . . . . . . . . . 37.9 ttp -63.9 -48.5 76.37 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.036 -1.04 . . . . 0.32 110.051 -179.212 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' C' C ' 341' ' ' PHE . . . . . . . . . . . . . 38.8 m-85 -61.37 -45.92 92.35 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 120.951 -1.093 . . . . 0.18 109.539 -179.763 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' C' C ' 342' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -47.63 -38.42 14.67 Favored 'General case' 0 N--CA 1.489 1.491 0 O-C-N 121.252 -0.905 . . . . 2.91 109.959 -179.804 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' C' C ' 343' ' ' GLU . . . . . . . . . . . . . 29.0 tp10 -59.04 -50.96 72.09 Favored 'General case' 0 N--CA 1.488 1.47 0 O-C-N 121.182 -0.949 . . . . 2.14 109.598 -179.906 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' C' C ' 344' ' ' LEU . . . . . . . . . . . . . 70.8 mt -62.37 -31.55 72.22 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.364 -0.835 . . . . 0.22 109.56 179.931 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' C' C ' 345' ' ' ASN . . . . . . . . . . . . . 18.7 t-20 -57.07 -58.36 8.52 Favored 'General case' 0 N--CA 1.487 1.412 0 O-C-N 121.254 -0.904 . . . . 1.08 109.564 179.928 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' C' C ' 346' ' ' GLU . . . . . . . . . . . . . 8.4 tm-20 -61.44 -27.87 68.87 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.46 -0.775 . . . . 2.21 110.028 -179.731 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' C' C ' 347' ' ' ALA . . . . . 0.652 ' HB1' ' HB1' ' D' ' 347' ' ' ALA . . . -62.93 -61.79 2.16 Favored 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.024 -1.048 . . . . 0.18 110.16 -179.651 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' C' C ' 348' ' ' LEU . . . . . 0.567 HD22 ' N ' ' C' ' 348' ' ' LEU . 4.2 mm? -60.59 -42.87 97.62 Favored 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.209 -0.932 . . . . 0.32 109.707 -179.72 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' C' C ' 349' ' ' GLU . . . . . . . . . . . . . 3.7 mm-40 -58.49 -35.98 73.06 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.11 -0.994 . . . . 2.19 109.834 -179.729 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' C' C ' 350' ' ' LEU . . . . . 0.626 ' CD2' HD13 ' D' ' 350' ' ' LEU . 4.1 tt -65.16 -39.59 93.18 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.048 -1.033 . . . . 0.46 109.043 179.766 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' C' C ' 351' ' ' LYS . . . . . . . . . . . . . 4.1 tttm -59.25 -40.82 87.19 Favored 'General case' 0 N--CA 1.488 1.452 0 O-C-N 121.394 -0.816 . . . . 1.35 109.108 179.914 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' C' C ' 352' ' ' ASP . . . . . . . . . . . . . 41.8 m-20 -57.73 -48.91 78.25 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.41 -0.806 . . . . 1.19 109.519 -179.996 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' C' C ' 353' ' ' ALA . . . . . . . . . . . . . . . -67.61 -16.01 63.95 Favored 'General case' 0 N--CA 1.487 1.42 0 O-C-N 121.42 -0.8 . . . . 0.57 109.537 -179.873 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' C' C ' 354' ' ' GLN . . . . . 0.409 ' O ' ' HG2' ' C' ' 354' ' ' GLN . 6.5 tt0 -84.78 -13.72 50.32 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 120.945 -1.097 . . . . 1.47 109.664 179.938 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' C' C ' 355' ' ' ALA . . . . . . . . . . . . . . . -73.33 -11.21 60.41 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.284 -0.885 . . . . 0.93 109.672 -179.871 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' C' C ' 356' ' ' GLY . . . . . . . . . . . . . . . -77.95 0.73 71.35 Favored Glycine 0 N--CA 1.491 2.32 0 N-CA-C 109.561 -1.415 . . . . 1.33 109.561 -179.882 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' C' C ' 357' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -87.21 116.66 25.44 Favored 'General case' 0 N--CA 1.488 1.452 0 O-C-N 121.418 -1.048 . . . . 4.01 109.34 -179.899 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' C' C ' 358' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -49.91 164.95 0.33 Allowed Pre-proline 0 C--N 1.302 -1.482 0 O-C-N 121.345 -0.847 . . . . 5.75 109.319 -179.996 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' C' C ' 359' ' ' PRO . . . . . . . . . . . . . 2.2 Cg_endo -62.08 -165.58 0.05 OUTLIER 'Trans proline' 0 C--N 1.307 -1.655 0 C-N-CA 122.098 1.865 . . . . 4.94 109.959 179.808 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' C' C ' 360' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.24 0 CA-C-O 117.961 -1.466 . . . . 6.5 109.717 -179.905 . . . . . . . . 0 0 . 1 . 028 nuclear nobuild full ' D' D ' 319' ' ' LYS . . . . . 0.428 ' O ' ' O ' ' D' ' 320' ' ' LYS . 2.9 mmtt . . . . . 0 N--CA 1.488 1.445 0 CA-C-O 121.275 0.559 . . . . 7.53 109.533 . . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' D' D ' 320' ' ' LYS . . . . . 0.428 ' O ' ' O ' ' D' ' 319' ' ' LYS . 1.8 tptt 62.67 132.44 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.194 -0.942 . . . . 6.41 109.465 179.956 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' D' D ' 321' ' ' LYS . . . . . . . . . . . . . 11.2 mttt -157.88 141.5 11.22 Favored Pre-proline 0 N--CA 1.492 1.637 0 O-C-N 121.319 -0.863 . . . . 6.11 109.585 179.96 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' D' D ' 322' ' ' PRO . . . . . . . . . . . . . 1.8 Cg_endo -63.82 -80.34 0.01 OUTLIER 'Trans proline' 0 C--N 1.313 -1.296 0 C-N-CA 122.254 1.969 . . . . 2.82 109.5 179.698 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' D' D ' 323' ' ' LEU . . . . . . . . . . . . . 24.1 mt -80.06 115.02 19.39 Favored 'General case' 0 N--CA 1.489 1.494 0 O-C-N 121.263 -0.898 . . . . 2.83 109.001 179.797 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' D' D ' 324' ' ' ASP . . . . . . . . . . . . . 36.4 m-20 -80.05 146.77 31.78 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.167 -0.958 . . . . 1.54 109.418 179.97 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' D' D ' 325' ' ' GLY . . . . . . . . . . . . . . . -66.61 167.91 36.5 Favored Glycine 0 N--CA 1.489 2.212 0 N-CA-C 109.441 -1.464 . . . . 0.59 109.441 179.89 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' D' D ' 326' ' ' GLU . . . . . . . . . . . . . 32.9 mm-40 -57.2 173.92 0.21 Allowed 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.21 -1.171 . . . . 2.13 109.464 -179.813 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' D' D ' 327' ' ' TYR . . . . . . . . . . . . . 39.1 m-85 -148.45 110.67 4.63 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.187 -0.945 . . . . 0.47 109.574 179.916 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' D' D ' 328' ' ' PHE . . . . . 0.404 ' CD1' ' N ' ' D' ' 328' ' ' PHE . 32.9 m-85 -114.06 -171.66 1.95 Allowed 'General case' 0 N--CA 1.488 1.437 0 O-C-N 121.297 -0.877 . . . . 0.3 109.402 179.925 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' D' D ' 329' ' ' THR . . . . . . . . . . . . . 3.2 p -149.73 165.95 30.87 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.457 -0.777 . . . . 0.22 109.058 179.944 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' D' D ' 330' ' ' LEU . . . . . 0.543 HD11 HD22 ' B' ' 345' ' ' ASN . 63.0 tp -149.46 130.17 14.11 Favored 'General case' 0 C--N 1.303 -1.414 0 O-C-N 121.14 -0.975 . . . . 0.28 109.783 -179.534 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' D' D ' 331' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -87.27 113.12 22.72 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.396 -0.815 . . . . 0.93 109.302 179.838 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' D' D ' 332' ' ' ILE . . . . . 0.665 HG21 ' HA ' ' D' ' 338' ' ' PHE . 64.5 mt -101.89 106.09 19.11 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.41 0 O-C-N 121.15 -0.969 . . . . 0.25 109.467 -179.877 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' D' D ' 333' ' ' ARG . . . . . . . . . . . . . 72.6 mtt180 -71.74 142.54 49.77 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.476 -0.765 . . . . 2.93 109.552 179.952 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' D' D ' 334' ' ' GLY . . . . . . . . . . . . . . . 86.76 127.71 2.3 Favored Glycine 0 N--CA 1.489 2.209 0 N-CA-C 109.56 -1.416 . . . . 0.41 109.56 179.732 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' D' D ' 335' ' ' ARG . . . . . 0.442 ' HB2' ' CZ ' ' B' ' 328' ' ' PHE . 7.8 ttp180 -76.96 -33.66 57.65 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.129 -1.218 . . . . 3.03 109.31 -179.938 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' D' D ' 336' ' ' GLU . . . . . . . . . . . . . 12.3 mt-10 -58.6 -63.06 1.42 Allowed 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.414 -0.804 . . . . 2.26 110.093 -179.854 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' D' D ' 337' ' ' ARG . . . . . 0.456 ' NH1' ' CG ' ' D' ' 337' ' ' ARG . 0.0 OUTLIER -60.42 -29.25 68.87 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.085 -1.009 . . . . 2.92 109.307 -179.868 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild full ' D' D ' 338' ' ' PHE . . . . . 0.665 ' HA ' HG21 ' D' ' 332' ' ' ILE . 66.6 t80 -55.83 -53.98 50.13 Favored 'General case' 0 N--CA 1.489 1.492 0 O-C-N 121.247 -0.908 . . . . 0.37 109.288 179.98 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' D' D ' 339' ' ' GLU . . . . . . . . . . . . . 53.4 mt-10 -53.94 -34.97 61.18 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.199 -0.938 . . . . 1.99 110.081 179.94 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' D' D ' 340' ' ' MET . . . . . . . . . . . . . 5.3 ttp -63.68 -52.75 59.26 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.258 -0.901 . . . . 0.31 110.263 -179.112 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' D' D ' 341' ' ' PHE . . . . . . . . . . . . . 50.5 m-85 -60.35 -42.86 96.6 Favored 'General case' 0 N--CA 1.496 1.827 0 O-C-N 121.087 -1.008 . . . . 0.18 109.807 -179.656 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' D' D ' 342' ' ' ARG . . . . . . . . . . . . . 62.2 ttt180 -50.66 -43.27 57.32 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.369 -0.832 . . . . 2.41 110.123 -179.844 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' D' D ' 343' ' ' GLU . . . . . . . . . . . . . 3.3 tt0 -59.68 -46.66 88.39 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.272 -0.893 . . . . 2.35 109.851 -179.712 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' D' D ' 344' ' ' LEU . . . . . . . . . . . . . 43.4 mt -61.07 -39.24 89.12 Favored 'General case' 0 N--CA 1.489 1.525 0 O-C-N 121.207 -0.933 . . . . 0.19 110.004 -179.465 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' D' D ' 345' ' ' ASN . . . . . . . . . . . . . 61.8 t-20 -56.99 -48.95 77.22 Favored 'General case' 0 N--CA 1.488 1.438 0 O-C-N 121.177 -0.952 . . . . 1.09 109.943 -179.768 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' D' D ' 346' ' ' GLU . . . . . . . . . . . . . 46.4 tt0 -61.15 -32.69 72.4 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 120.918 -1.114 . . . . 1.69 110.037 -179.52 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' D' D ' 347' ' ' ALA . . . . . 0.652 ' HB1' ' HB1' ' C' ' 347' ' ' ALA . . . -60.12 -56.5 20.86 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.073 -1.017 . . . . 0.18 110.104 -179.752 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' D' D ' 348' ' ' LEU . . . . . 0.642 HD22 ' N ' ' D' ' 348' ' ' LEU . 3.9 mm? -62.43 -40.35 96.28 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.141 -0.974 . . . . 0.31 109.881 -179.509 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' D' D ' 349' ' ' GLU . . . . . . . . . . . . . 10.3 mm-40 -57.3 -39.74 76.39 Favored 'General case' 0 N--CA 1.495 1.777 0 O-C-N 121.304 -0.872 . . . . 1.95 109.858 -179.568 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' D' D ' 350' ' ' LEU . . . . . 0.626 HD13 ' CD2' ' C' ' 350' ' ' LEU . 7.9 tt -61.89 -45.71 92.56 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.285 -0.885 . . . . 0.43 109.317 179.936 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' D' D ' 351' ' ' LYS . . . . . . . . . . . . . 34.4 tttt -58.05 -42.95 86.5 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.418 -0.802 . . . . 1.4 109.453 179.851 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' D' D ' 352' ' ' ASP . . . . . . . . . . . . . 8.0 m-20 -57.01 -54.88 41.69 Favored 'General case' 0 N--CA 1.488 1.448 0 O-C-N 121.262 -0.899 . . . . 1.17 109.473 -179.993 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' D' D ' 353' ' ' ALA . . . . . . . . . . . . . . . -69.2 -12.36 61.61 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.326 -0.859 . . . . 0.59 109.705 179.923 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' D' D ' 354' ' ' GLN . . . . . . . . . . . . . 3.2 tt0 -83.85 -13.42 53.7 Favored 'General case' 0 N--CA 1.488 1.472 0 O-C-N 121.161 -0.962 . . . . 1.44 109.802 -179.918 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' D' D ' 355' ' ' ALA . . . . . . . . . . . . . . . -73.8 -10.05 59.28 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.125 -0.984 . . . . 0.98 109.62 179.842 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' D' D ' 356' ' ' GLY . . . . . . . . . . . . . . . -80.49 -3.36 90.04 Favored Glycine 0 N--CA 1.49 2.234 0 N-CA-C 109.428 -1.469 . . . . 1.28 109.428 -179.778 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' D' D ' 357' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -87.0 100.14 12.4 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.368 -1.077 . . . . 4.09 109.37 179.984 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' D' D ' 358' ' ' GLU . . . . . 0.452 ' HB2' ' HD2' ' D' ' 359' ' ' PRO . 27.3 pt-20 -50.5 157.32 1.28 Allowed Pre-proline 0 N--CA 1.49 1.566 0 O-C-N 121.162 -0.961 . . . . 5.71 109.465 -179.997 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' D' D ' 359' ' ' PRO . . . . . 0.452 ' HD2' ' HB2' ' D' ' 358' ' ' GLU . 3.1 Cg_exo -60.74 85.52 0.08 OUTLIER 'Trans proline' 0 C--N 1.31 -1.498 0 C-N-CA 122.122 1.882 . . . . 4.97 110.102 179.802 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' D' D ' 360' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.488 2.155 0 N-CA-C 109.249 -1.541 . . . . 6.97 109.249 179.959 . . . . . . . . 0 0 . 1 . 029 nuclear nobuild full ' A' A ' 319' ' ' LYS . . . . . . . . . . . . . 7.9 tttt . . . . . 0 N--CA 1.492 1.647 0 N-CA-C 109.446 -0.576 . . . . 7.55 109.446 . . . . . . . . . 0 0 . 1 . 029 nuclear nobuild full ' A' A ' 320' ' ' LYS . . . . . . . . . . . . . 11.1 mttt 58.51 -159.69 0.28 Allowed 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.205 -0.934 . . . . 6.43 109.599 -179.916 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 321' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -158.63 110.77 1.64 Allowed Pre-proline 0 N--CA 1.49 1.566 0 O-C-N 121.293 -0.88 . . . . 6.13 109.391 -179.891 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 322' ' ' PRO . . . . . . . . . . . . . 6.1 Cg_exo -57.85 179.38 0.15 Allowed 'Trans proline' 0 C--N 1.311 -1.43 0 C-N-CA 121.778 1.652 . . . . 2.83 109.991 179.68 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 323' ' ' LEU . . . . . . . . . . . . . 21.0 mt -80.17 118.96 22.32 Favored 'General case' 0 N--CA 1.489 1.488 0 O-C-N 121.209 -0.932 . . . . 2.83 109.624 -179.78 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 324' ' ' ASP . . . . . . . . . . . . . 31.2 m-20 -78.8 -168.36 1.4 Allowed 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.272 -0.892 . . . . 1.53 109.081 179.814 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 325' ' ' GLY . . . . . . . . . . . . . . . -68.73 175.68 30.15 Favored Glycine 0 N--CA 1.49 2.245 0 N-CA-C 109.494 -1.442 . . . . 0.61 109.494 -179.931 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 326' ' ' GLU . . . . . . . . . . . . . 2.4 mt-10 -56.89 -174.54 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.216 -1.167 . . . . 2.13 109.151 179.93 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 327' ' ' TYR . . . . . 0.554 ' CE1' ' HG2' ' C' ' 333' ' ' ARG . 46.3 m-85 -150.29 108.56 3.77 Favored 'General case' 0 N--CA 1.488 1.463 0 O-C-N 121.152 -0.967 . . . . 0.48 109.788 -179.888 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 328' ' ' PHE . . . . . 0.469 ' CZ ' ' HG3' ' C' ' 335' ' ' ARG . 86.6 m-85 -108.45 -161.86 0.79 Allowed 'General case' 0 N--CA 1.488 1.47 0 O-C-N 121.308 -0.87 . . . . 0.31 109.377 179.936 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 329' ' ' THR . . . . . 0.442 HG23 ' O ' ' A' ' 328' ' ' PHE . 24.2 p -155.27 167.69 29.53 Favored 'General case' 0 N--CA 1.488 1.469 0 O-C-N 121.272 -0.892 . . . . 0.22 109.193 179.913 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 330' ' ' LEU . . . . . 0.426 ' O ' ' HA ' ' C' ' 329' ' ' THR . 24.4 tp -150.06 125.4 10.15 Favored 'General case' 0 N--CA 1.489 1.486 0 O-C-N 121.212 -0.93 . . . . 0.28 109.594 -179.924 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 331' ' ' GLN . . . . . . . . . . . . . 1.3 tt0 -87.01 115.69 24.56 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.316 -0.865 . . . . 0.91 109.209 179.857 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 332' ' ' ILE . . . . . 0.719 HG21 ' HA ' ' A' ' 338' ' ' PHE . 68.6 mt -103.61 113.98 41.96 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.511 0 O-C-N 121.217 -0.927 . . . . 0.26 109.588 -179.871 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 333' ' ' ARG . . . . . 0.416 ' HG2' ' CE1' ' C' ' 327' ' ' TYR . 31.6 mtt180 -72.74 151.84 41.94 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.313 -0.867 . . . . 2.92 109.404 179.9 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 334' ' ' GLY . . . . . . . . . . . . . . . 73.92 131.47 0.21 Allowed Glycine 0 N--CA 1.492 2.374 0 N-CA-C 109.589 -1.404 . . . . 0.4 109.589 -179.967 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 335' ' ' ARG . . . . . 0.429 ' HA ' ' CE1' ' C' ' 328' ' ' PHE . 0.1 OUTLIER -77.59 -35.29 53.06 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.283 -1.128 . . . . 3.01 109.463 -179.994 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild full ' A' A ' 336' ' ' GLU . . . . . . . . . . . . . 45.3 mt-10 -57.59 -61.5 2.46 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.259 -0.901 . . . . 2.29 109.723 -179.843 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 337' ' ' ARG . . . . . 0.917 ' CZ ' HD12 ' C' ' 348' ' ' LEU . 1.9 mtp180 -60.07 -31.35 69.91 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.273 -0.892 . . . . 2.93 109.571 -179.877 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 338' ' ' PHE . . . . . 0.719 ' HA ' HG21 ' A' ' 332' ' ' ILE . 44.5 t80 -54.89 -61.1 2.53 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.297 -0.877 . . . . 0.38 109.284 179.835 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 339' ' ' GLU . . . . . . . . . . . . . 93.4 mt-10 -51.43 -27.8 11.23 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.273 -0.892 . . . . 1.97 109.586 -179.941 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 340' ' ' MET . . . . . 0.411 ' HB3' ' O ' ' A' ' 337' ' ' ARG . 26.9 ttp -64.74 -54.26 34.29 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.241 -0.912 . . . . 0.31 109.716 -179.903 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 341' ' ' PHE . . . . . 0.432 ' HB2' HD13 ' A' ' 332' ' ' ILE . 47.5 m-85 -61.79 -41.77 98.15 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.24 -0.912 . . . . 0.18 109.656 -179.746 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 342' ' ' ARG . . . . . . . . . . . . . 4.4 ttt180 -49.2 -42.2 39.44 Favored 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.3 -0.875 . . . . 2.42 109.524 179.988 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 343' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -59.2 -46.66 87.85 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.175 -0.953 . . . . 2.35 109.735 -179.835 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 344' ' ' LEU . . . . . . . . . . . . . 36.6 mt -61.85 -31.82 72.11 Favored 'General case' 0 N--CA 1.489 1.486 0 O-C-N 121.144 -0.972 . . . . 0.18 109.559 -179.91 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 345' ' ' ASN . . . . . . . . . . . . . 26.5 t-20 -57.95 -57.31 13.37 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.231 -0.918 . . . . 1.09 109.683 -179.867 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 346' ' ' GLU . . . . . . . . . . . . . 20.3 tt0 -60.66 -28.32 68.5 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.306 -0.871 . . . . 1.65 109.912 -179.571 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 347' ' ' ALA . . . . . 0.726 ' HB1' ' HB1' ' B' ' 347' ' ' ALA . . . -60.47 -58.95 6.32 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.225 -0.922 . . . . 0.18 109.933 -179.805 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 348' ' ' LEU . . . . . 0.621 HD22 ' N ' ' A' ' 348' ' ' LEU . 4.0 mm? -62.23 -46.83 87.12 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.196 -0.94 . . . . 0.3 110.007 -179.482 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 349' ' ' GLU . . . . . . . . . . . . . 2.3 mt-10 -58.21 -29.05 65.37 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.22 -0.925 . . . . 1.94 109.965 -179.459 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 350' ' ' LEU . . . . . 0.787 ' CD1' HD22 ' B' ' 350' ' ' LEU . 3.4 tt -64.17 -50.93 66.2 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.118 -0.989 . . . . 0.46 109.22 179.957 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 351' ' ' LYS . . . . . . . . . . . . . 24.7 tttt -60.03 -38.54 83.03 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.372 -0.83 . . . . 1.4 109.375 179.965 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 352' ' ' ASP . . . . . 0.43 ' OD1' ' NH2' ' C' ' 337' ' ' ARG . 16.9 m-20 -56.95 -44.78 82.91 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.206 -0.934 . . . . 1.16 109.756 179.997 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 353' ' ' ALA . . . . . . . . . . . . . . . -67.01 -20.1 65.81 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.29 -0.881 . . . . 0.63 109.798 -179.624 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 354' ' ' GLN . . . . . . . . . . . . . 1.5 mt-30 -84.02 -12.97 54.39 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.06 -1.025 . . . . 1.47 109.561 -179.999 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 355' ' ' ALA . . . . . . . . . . . . . . . -72.6 -7.65 51.28 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.213 -0.929 . . . . 1.01 109.591 179.951 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 356' ' ' GLY . . . . . . . . . . . . . . . -79.94 3.93 68.26 Favored Glycine 0 N--CA 1.49 2.266 0 N-CA-C 109.767 -1.333 . . . . 1.3 109.767 -179.86 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 357' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -86.94 105.58 17.2 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.12 -1.223 . . . . 4.1 109.536 -179.869 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 358' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -49.16 160.9 0.48 Allowed Pre-proline 0 N--CA 1.49 1.55 0 O-C-N 121.196 -0.94 . . . . 5.75 109.264 179.819 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 359' ' ' PRO . . . . . . . . . . . . . 3.7 Cg_exo -60.64 165.53 11.42 Favored 'Trans proline' 0 C--N 1.308 -1.581 0 C-N-CA 122.122 1.882 . . . . 5.0 109.963 179.782 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 360' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.264 0 CA-C-O 118.049 -1.417 . . . . 6.97 109.576 -179.908 . . . . . . . . 0 0 . 1 . 029 nuclear nobuild full ' B' B ' 319' ' ' LYS . . . . . . . . . . . . . 8.6 tttt . . . . . 0 N--CA 1.49 1.529 0 N-CA-C 109.455 -0.572 . . . . 7.55 109.455 . . . . . . . . . 0 0 . 1 . 029 nuclear nobuild full ' B' B ' 320' ' ' LYS . . . . . . . . . . . . . 11.2 mttt 58.49 -159.85 0.27 Allowed 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.185 -0.947 . . . . 6.44 109.469 179.982 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' B' B ' 321' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -158.38 111.1 1.69 Allowed Pre-proline 0 N--CA 1.489 1.488 0 O-C-N 121.201 -0.937 . . . . 6.13 109.537 -179.948 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' B' B ' 322' ' ' PRO . . . . . . . . . . . . . 6.2 Cg_exo -58.12 178.99 0.18 Allowed 'Trans proline' 0 C--N 1.31 -1.473 0 C-N-CA 121.849 1.699 . . . . 2.82 109.893 179.791 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' B' B ' 323' ' ' LEU . . . . . . . . . . . . . 21.1 mt -79.76 118.74 21.83 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.124 -0.985 . . . . 2.84 109.736 -179.802 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' B' B ' 324' ' ' ASP . . . . . . . . . . . . . 31.0 m-20 -78.61 -169.27 1.65 Allowed 'General case' 0 N--CA 1.488 1.474 0 O-C-N 121.272 -0.892 . . . . 1.53 109.172 179.782 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' B' B ' 325' ' ' GLY . . . . . . . . . . . . . . . -67.75 175.19 27.24 Favored Glycine 0 N--CA 1.489 2.206 0 N-CA-C 109.631 -1.388 . . . . 0.59 109.631 179.956 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' B' B ' 326' ' ' GLU . . . . . . . . . . . . . 2.4 mt-10 -56.63 -174.66 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.188 -1.184 . . . . 2.13 109.158 179.941 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' B' B ' 327' ' ' TYR . . . . . 0.442 ' CE1' ' HG2' ' D' ' 333' ' ' ARG . 46.9 m-85 -150.24 108.55 3.77 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.163 -0.96 . . . . 0.48 109.815 -179.902 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' B' B ' 328' ' ' PHE . . . . . 0.438 ' O ' HG23 ' B' ' 329' ' ' THR . 86.5 m-85 -108.45 -162.18 0.81 Allowed 'General case' 0 N--CA 1.489 1.48 0 O-C-N 121.267 -0.895 . . . . 0.32 109.404 179.817 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' B' B ' 329' ' ' THR . . . . . 0.438 HG23 ' O ' ' B' ' 328' ' ' PHE . 24.2 p -155.11 167.52 30.09 Favored 'General case' 0 N--CA 1.489 1.491 0 O-C-N 121.27 -0.893 . . . . 0.23 109.283 179.795 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' B' B ' 330' ' ' LEU . . . . . 0.467 ' O ' ' HA ' ' D' ' 329' ' ' THR . 24.3 tp -149.79 125.74 10.55 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.171 -0.955 . . . . 0.28 109.531 -179.846 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' B' B ' 331' ' ' GLN . . . . . . . . . . . . . 1.3 tt0 -87.28 115.6 24.79 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.256 -0.902 . . . . 0.91 109.289 179.832 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' B' B ' 332' ' ' ILE . . . . . 0.746 HG21 ' HA ' ' B' ' 338' ' ' PHE . 68.4 mt -103.47 114.47 43.17 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.521 0 O-C-N 121.136 -0.978 . . . . 0.24 109.644 -179.971 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' B' B ' 333' ' ' ARG . . . . . 0.472 ' HG2' ' CE1' ' D' ' 327' ' ' TYR . 32.6 mtt180 -73.15 151.86 41.38 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.253 -0.904 . . . . 2.93 109.429 179.887 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' B' B ' 334' ' ' GLY . . . . . . . . . . . . . . . 73.88 131.2 0.2 Allowed Glycine 0 N--CA 1.491 2.327 0 N-CA-C 109.523 -1.431 . . . . 0.4 109.523 179.959 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' B' B ' 335' ' ' ARG . . . . . 0.423 ' HA ' ' CE1' ' D' ' 328' ' ' PHE . 0.1 OUTLIER -77.36 -35.34 54.62 Favored 'General case' 0 N--CA 1.488 1.47 0 O-C-N 121.294 -1.121 . . . . 3.01 109.477 -179.979 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild full ' B' B ' 336' ' ' GLU . . . . . . . . . . . . . 46.3 mt-10 -57.22 -61.79 2.22 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.295 -0.878 . . . . 2.28 109.656 -179.926 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' B' B ' 337' ' ' ARG . . . . . 0.487 ' NH2' HD12 ' D' ' 348' ' ' LEU . 1.9 mtp180 -60.14 -30.99 69.67 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.249 -0.907 . . . . 2.93 109.611 -179.698 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' B' B ' 338' ' ' PHE . . . . . 0.746 ' HA ' HG21 ' B' ' 332' ' ' ILE . 44.8 t80 -55.21 -60.94 2.7 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.235 -0.916 . . . . 0.37 109.293 179.872 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' B' B ' 339' ' ' GLU . . . . . . . . . . . . . 93.4 mt-10 -51.4 -27.81 11.06 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.271 -0.893 . . . . 1.98 109.483 179.952 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' B' B ' 340' ' ' MET . . . . . 0.409 ' HB3' ' O ' ' B' ' 337' ' ' ARG . 27.4 ttp -64.75 -54.21 34.91 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.351 -0.843 . . . . 0.32 109.698 -179.852 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' B' B ' 341' ' ' PHE . . . . . 0.427 ' HB2' HD13 ' B' ' 332' ' ' ILE . 46.9 m-85 -61.79 -42.07 98.53 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.317 -0.865 . . . . 0.18 109.656 -179.69 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' B' B ' 342' ' ' ARG . . . . . . . . . . . . . 4.3 ttt180 -49.01 -42.12 36.91 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.219 -0.926 . . . . 2.42 109.552 -179.95 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' B' B ' 343' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -59.24 -46.63 87.96 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.278 -0.889 . . . . 2.35 109.681 -179.797 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' B' B ' 344' ' ' LEU . . . . . . . . . . . . . 36.2 mt -61.87 -31.93 72.24 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.178 -0.951 . . . . 0.18 109.559 -179.928 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' B' B ' 345' ' ' ASN . . . . . . . . . . . . . 27.1 t-20 -57.69 -57.67 11.7 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.326 -0.858 . . . . 1.09 109.759 -179.909 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' B' B ' 346' ' ' GLU . . . . . . . . . . . . . 20.4 tt0 -60.36 -28.29 68.07 Favored 'General case' 0 N--CA 1.489 1.525 0 O-C-N 121.385 -0.822 . . . . 1.66 109.916 -179.589 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' B' B ' 347' ' ' ALA . . . . . 0.726 ' HB1' ' HB1' ' A' ' 347' ' ' ALA . . . -60.7 -58.71 7.31 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.12 -0.988 . . . . 0.17 109.894 -179.732 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' B' B ' 348' ' ' LEU . . . . . 0.626 HD22 ' N ' ' B' ' 348' ' ' LEU . 4.0 mm? -62.1 -47.2 85.67 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.23 -0.918 . . . . 0.29 109.955 -179.563 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' B' B ' 349' ' ' GLU . . . . . . . . . . . . . 2.3 mt-10 -57.95 -29.05 64.87 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.233 -0.917 . . . . 1.95 109.967 -179.458 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' B' B ' 350' ' ' LEU . . . . . 0.787 HD22 ' CD1' ' A' ' 350' ' ' LEU . 3.5 tt -64.17 -51.11 65.38 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.15 -0.969 . . . . 0.45 109.207 179.871 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' B' B ' 351' ' ' LYS . . . . . . . . . . . . . 24.1 tttt -59.81 -38.43 81.95 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.403 -0.811 . . . . 1.38 109.41 -179.938 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' B' B ' 352' ' ' ASP . . . . . . . . . . . . . 18.1 m-20 -57.07 -44.88 83.51 Favored 'General case' 0 N--CA 1.491 1.625 0 O-C-N 121.334 -0.854 . . . . 1.16 109.773 -179.971 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' B' B ' 353' ' ' ALA . . . . . . . . . . . . . . . -66.88 -19.9 65.82 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.208 -0.933 . . . . 0.61 109.742 -179.572 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' B' B ' 354' ' ' GLN . . . . . . . . . . . . . 1.6 mt-30 -84.23 -13.11 53.53 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.215 -0.928 . . . . 1.45 109.527 -179.973 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' B' B ' 355' ' ' ALA . . . . . . . . . . . . . . . -72.76 -7.27 49.8 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.247 -0.908 . . . . 0.98 109.63 179.967 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' B' B ' 356' ' ' GLY . . . . . . . . . . . . . . . -80.14 3.86 69.61 Favored Glycine 0 N--CA 1.491 2.333 0 N-CA-C 109.795 -1.322 . . . . 1.29 109.795 -179.92 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' B' B ' 357' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -87.07 105.63 17.3 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.213 -1.169 . . . . 4.09 109.526 -179.869 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' B' B ' 358' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -49.33 161.03 0.49 Allowed Pre-proline 0 N--CA 1.489 1.489 0 O-C-N 121.203 -0.936 . . . . 5.72 109.273 179.863 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' B' B ' 359' ' ' PRO . . . . . . . . . . . . . 4.1 Cg_exo -60.53 166.16 10.17 Favored 'Trans proline' 0 C--N 1.31 -1.49 0 C-N-CA 122.101 1.868 . . . . 4.98 110.046 179.854 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' B' B ' 360' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.232 0 CA-C-O 118.005 -1.442 . . . . 6.98 109.607 -179.993 . . . . . . . . 0 0 . 1 . 029 nuclear nobuild full ' C' C ' 319' ' ' LYS . . . . . . . . . . . . . 63.0 mttt . . . . . 0 N--CA 1.49 1.566 0 N-CA-C 109.412 -0.588 . . . . 6.82 109.412 . . . . . . . . . 0 0 . 1 . 029 nuclear nobuild full ' C' C ' 320' ' ' LYS . . . . . 0.434 ' HB3' ' HD3' ' C' ' 322' ' ' PRO . 0.0 OUTLIER 57.35 -172.16 0.09 Allowed 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.161 -0.962 . . . . 6.49 108.996 -179.74 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild full ' C' C ' 321' ' ' LYS . . . . . 0.484 ' N ' ' HD3' ' C' ' 322' ' ' PRO . 0.0 OUTLIER -158.62 62.3 2.2 Favored Pre-proline 0 N--CA 1.49 1.533 0 O-C-N 121.018 -1.051 . . . . 6.4 110.043 -179.9 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild full ' C' C ' 322' ' ' PRO . . . . . 0.484 ' HD3' ' N ' ' C' ' 321' ' ' LYS . 1.7 Cg_endo -62.73 -82.08 0.01 OUTLIER 'Trans proline' 0 C--N 1.309 -1.511 0 C-N-CA 122.051 1.834 . . . . 3.42 110.029 179.745 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' C' C ' 323' ' ' LEU . . . . . 0.452 ' HA ' HD23 ' C' ' 323' ' ' LEU . 44.7 mt -83.99 98.12 9.64 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.095 -1.003 . . . . 3.95 109.485 179.762 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' C' C ' 324' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -82.09 149.63 27.92 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.185 -0.947 . . . . 1.63 109.677 -179.847 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' C' C ' 325' ' ' GLY . . . . . 0.534 ' O ' ' CE2' ' C' ' 327' ' ' TYR . . . -69.26 169.97 42.59 Favored Glycine 0 N--CA 1.49 2.285 0 N-CA-C 109.416 -1.474 . . . . 0.73 109.416 179.718 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' C' C ' 326' ' ' GLU . . . . . . . . . . . . . 80.2 mm-40 -56.49 178.31 0.05 Allowed 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.171 -1.193 . . . . 2.17 109.146 179.901 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' C' C ' 327' ' ' TYR . . . . . 0.534 ' CE2' ' O ' ' C' ' 325' ' ' GLY . 55.5 m-85 -149.57 107.14 3.65 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.058 -1.026 . . . . 0.48 109.816 -179.744 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' C' C ' 328' ' ' PHE . . . . . 0.441 ' O ' HG23 ' C' ' 329' ' ' THR . 80.8 m-85 -107.16 -162.86 0.87 Allowed 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.126 -0.984 . . . . 0.33 109.36 179.663 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' C' C ' 329' ' ' THR . . . . . 0.441 HG23 ' O ' ' C' ' 328' ' ' PHE . 34.0 p -155.23 163.31 40.35 Favored 'General case' 0 N--CA 1.489 1.497 0 O-C-N 121.272 -0.892 . . . . 0.23 109.259 179.915 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' C' C ' 330' ' ' LEU . . . . . . . . . . . . . 48.5 tp -149.55 128.56 12.67 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.235 -0.916 . . . . 0.28 109.555 -179.767 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' C' C ' 331' ' ' GLN . . . . . . . . . . . . . 1.1 tt0 -86.29 117.72 25.28 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.231 -0.918 . . . . 1.48 109.251 179.881 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' C' C ' 332' ' ' ILE . . . . . 0.708 HG21 ' HA ' ' C' ' 338' ' ' PHE . 40.6 mt -103.38 112.36 36.57 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.557 0 O-C-N 121.244 -0.91 . . . . 0.24 109.714 -179.805 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' C' C ' 333' ' ' ARG . . . . . 0.554 ' HG2' ' CE1' ' A' ' 327' ' ' TYR . 0.1 OUTLIER -74.25 136.34 42.69 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.303 -0.873 . . . . 2.74 109.546 179.847 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild full ' C' C ' 334' ' ' GLY . . . . . . . . . . . . . . . 87.52 132.81 3.79 Favored Glycine 0 N--CA 1.492 2.388 0 N-CA-C 109.741 -1.344 . . . . 0.35 109.741 179.692 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' C' C ' 335' ' ' ARG . . . . . 0.469 ' HG3' ' CZ ' ' A' ' 328' ' ' PHE . 1.8 tmm_? -80.43 -38.06 30.84 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.292 -1.122 . . . . 2.53 109.724 -179.971 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' C' C ' 336' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -56.44 -58.22 8.95 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.13 -0.981 . . . . 2.62 109.67 -179.831 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' C' C ' 337' ' ' ARG . . . . . 0.43 ' NH2' ' OD1' ' A' ' 352' ' ' ASP . 0.4 OUTLIER -60.63 -30.14 69.68 Favored 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.28 -0.887 . . . . 2.81 109.657 -179.803 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild full ' C' C ' 338' ' ' PHE . . . . . 0.708 ' HA ' HG21 ' C' ' 332' ' ' ILE . 61.1 t80 -56.01 -55.91 27.06 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.152 -0.968 . . . . 0.4 109.87 -179.841 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' C' C ' 339' ' ' GLU . . . . . . . . . . . . . 5.1 mt-10 -50.16 -34.14 21.39 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.11 -0.994 . . . . 2.05 109.887 -179.735 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' C' C ' 340' ' ' MET . . . . . . . . . . . . . 3.5 ttt -62.98 -50.2 71.7 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.118 -0.989 . . . . 0.32 109.889 -179.702 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' C' C ' 341' ' ' PHE . . . . . . . . . . . . . 37.1 m-85 -62.14 -49.62 75.15 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.087 -1.008 . . . . 0.18 110.113 -179.664 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' C' C ' 342' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -47.86 -38.71 16.79 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.222 -0.924 . . . . 2.91 110.011 -179.655 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' C' C ' 343' ' ' GLU . . . . . . . . . . . . . 2.5 tt0 -58.27 -49.47 77.03 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.143 -0.973 . . . . 2.14 109.579 -179.823 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' C' C ' 344' ' ' LEU . . . . . 0.56 HD22 ' CD2' ' D' ' 344' ' ' LEU . 81.3 mt -63.52 -33.52 75.76 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.257 -0.902 . . . . 0.22 109.836 -179.971 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' C' C ' 345' ' ' ASN . . . . . 0.418 ' C ' ' OD1' ' C' ' 345' ' ' ASN . 16.6 t-20 -57.5 -58.76 6.86 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.192 -0.942 . . . . 1.08 109.732 -179.791 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' C' C ' 346' ' ' GLU . . . . . . . . . . . . . 1.3 tt0 -60.46 -26.61 66.89 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.192 -0.943 . . . . 2.21 109.57 -179.603 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' C' C ' 347' ' ' ALA . . . . . 0.81 ' HB1' ' HB1' ' D' ' 347' ' ' ALA . . . -62.9 -56.69 15.0 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.185 -0.947 . . . . 0.18 109.738 179.923 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' C' C ' 348' ' ' LEU . . . . . 0.917 HD12 ' CZ ' ' A' ' 337' ' ' ARG . 4.2 mm? -61.73 -47.97 82.82 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.245 -0.909 . . . . 0.32 110.061 -179.672 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' C' C ' 349' ' ' GLU . . . . . . . . . . . . . 47.9 mm-40 -57.78 -34.6 69.75 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.25 -0.906 . . . . 2.19 110.269 -179.229 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' C' C ' 350' ' ' LEU . . . . . 0.795 HD22 ' CD1' ' D' ' 350' ' ' LEU . 5.4 tt -63.98 -45.88 87.07 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.11 -0.994 . . . . 0.46 109.221 -179.887 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' C' C ' 351' ' ' LYS . . . . . . . . . . . . . 12.7 tttp -60.15 -46.45 89.62 Favored 'General case' 0 N--CA 1.488 1.426 0 O-C-N 121.455 -0.778 . . . . 1.35 109.381 179.892 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' C' C ' 352' ' ' ASP . . . . . . . . . . . . . 76.6 m-20 -57.7 -37.93 74.34 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.351 -0.843 . . . . 1.19 109.565 -179.967 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' C' C ' 353' ' ' ALA . . . . . . . . . . . . . . . -67.67 -24.68 65.45 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.287 -0.883 . . . . 0.57 109.767 -179.809 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' C' C ' 354' ' ' GLN . . . . . . . . . . . . . 15.1 mt-30 -80.43 -5.55 56.7 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.198 -0.939 . . . . 1.47 109.512 179.89 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' C' C ' 355' ' ' ALA . . . . . . . . . . . . . . . -71.06 -3.39 19.49 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.174 -0.954 . . . . 0.93 109.794 179.992 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' C' C ' 356' ' ' GLY . . . . . . . . . . . . . . . -74.44 -45.0 25.49 Favored Glycine 0 N--CA 1.49 2.271 0 N-CA-C 109.643 -1.383 . . . . 1.33 109.643 -179.821 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' C' C ' 357' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -86.95 119.96 27.71 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.25 -1.147 . . . . 4.01 109.397 -179.98 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' C' C ' 358' ' ' GLU . . . . . 0.581 ' N ' ' HD2' ' C' ' 359' ' ' PRO . 7.8 tt0 -48.87 -52.22 48.14 Favored Pre-proline 0 N--CA 1.488 1.435 0 O-C-N 121.169 -0.957 . . . . 5.75 109.688 -179.953 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' C' C ' 359' ' ' PRO . . . . . 0.581 ' HD2' ' N ' ' C' ' 358' ' ' GLU . 1.9 Cg_endo -62.81 170.03 7.86 Favored 'Trans proline' 0 C--N 1.313 -1.296 0 C-N-CA 121.72 1.613 . . . . 4.94 110.036 179.709 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' C' C ' 360' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.243 0 CA-C-O 117.916 -1.491 . . . . 6.5 109.621 179.983 . . . . . . . . 0 0 . 1 . 029 nuclear nobuild full ' D' D ' 319' ' ' LYS . . . . . . . . . . . . . 8.2 tttt . . . . . 0 N--CA 1.491 1.6 0 N-CA-C 109.487 -0.56 . . . . 7.53 109.487 . . . . . . . . . 0 0 . 1 . 029 nuclear nobuild full ' D' D ' 320' ' ' LYS . . . . . . . . . . . . . 11.1 mttt 58.3 -159.21 0.28 Allowed 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.281 -0.887 . . . . 6.41 109.398 -179.963 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' D' D ' 321' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -158.94 110.88 1.58 Allowed Pre-proline 0 N--CA 1.49 1.55 0 O-C-N 121.335 -0.853 . . . . 6.11 109.536 -179.878 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' D' D ' 322' ' ' PRO . . . . . . . . . . . . . 6.2 Cg_exo -57.85 179.8 0.14 Allowed 'Trans proline' 0 C--N 1.312 -1.361 0 C-N-CA 121.828 1.686 . . . . 2.82 110.049 179.759 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' D' D ' 323' ' ' LEU . . . . . . . . . . . . . 20.2 mt -80.3 118.77 22.25 Favored 'General case' 0 N--CA 1.489 1.499 0 O-C-N 121.125 -0.984 . . . . 2.83 109.722 -179.811 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' D' D ' 324' ' ' ASP . . . . . . . . . . . . . 29.0 m-20 -78.46 -168.79 1.46 Allowed 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.298 -0.876 . . . . 1.54 109.274 179.738 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' D' D ' 325' ' ' GLY . . . . . . . . . . . . . . . -68.25 175.1 29.35 Favored Glycine 0 N--CA 1.49 2.245 0 N-CA-C 109.471 -1.452 . . . . 0.59 109.471 179.969 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' D' D ' 326' ' ' GLU . . . . . . . . . . . . . 2.4 mt-10 -56.68 -174.79 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.181 -1.188 . . . . 2.13 109.287 179.954 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' D' D ' 327' ' ' TYR . . . . . 0.472 ' CE1' ' HG2' ' B' ' 333' ' ' ARG . 47.2 m-85 -150.12 108.42 3.77 Favored 'General case' 0 N--CA 1.489 1.485 0 O-C-N 121.162 -0.961 . . . . 0.47 109.818 -179.803 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' D' D ' 328' ' ' PHE . . . . . 0.457 ' O ' HG23 ' D' ' 329' ' ' THR . 87.4 m-85 -108.25 -161.96 0.8 Allowed 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.302 -0.874 . . . . 0.3 109.433 179.771 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' D' D ' 329' ' ' THR . . . . . 0.467 ' HA ' ' O ' ' B' ' 330' ' ' LEU . 23.6 p -155.24 167.64 29.71 Favored 'General case' 0 N--CA 1.489 1.49 0 O-C-N 121.253 -0.905 . . . . 0.22 109.244 179.864 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' D' D ' 330' ' ' LEU . . . . . 0.436 ' O ' ' HA ' ' B' ' 329' ' ' THR . 24.0 tp -149.98 125.51 10.27 Favored 'General case' 0 N--CA 1.489 1.478 0 O-C-N 121.195 -0.941 . . . . 0.28 109.605 -179.951 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' D' D ' 331' ' ' GLN . . . . . . . . . . . . . 1.3 tt0 -87.03 115.6 24.52 Favored 'General case' 0 N--CA 1.488 1.471 0 O-C-N 121.245 -0.909 . . . . 0.93 109.23 179.837 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' D' D ' 332' ' ' ILE . . . . . 0.731 HG21 ' HA ' ' D' ' 338' ' ' PHE . 69.9 mt -103.55 114.24 42.59 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.507 0 O-C-N 121.177 -0.952 . . . . 0.25 109.537 -179.898 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' D' D ' 333' ' ' ARG . . . . . 0.442 ' HG2' ' CE1' ' B' ' 327' ' ' TYR . 32.9 mtt180 -72.83 151.98 41.76 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.321 -0.862 . . . . 2.93 109.391 179.835 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' D' D ' 334' ' ' GLY . . . . . . . . . . . . . . . 73.64 131.38 0.19 Allowed Glycine 0 N--CA 1.491 2.33 0 N-CA-C 109.546 -1.422 . . . . 0.41 109.546 179.902 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' D' D ' 335' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -77.45 -35.36 53.99 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.269 -1.136 . . . . 3.03 109.453 -179.986 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' D' D ' 336' ' ' GLU . . . . . . . . . . . . . 47.8 mt-10 -57.33 -61.6 2.36 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.251 -0.906 . . . . 2.26 109.647 -179.909 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' D' D ' 337' ' ' ARG . . . . . 0.495 ' NH2' HD12 ' B' ' 348' ' ' LEU . 1.9 mtp180 -60.18 -31.03 69.73 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.304 -0.873 . . . . 2.92 109.64 -179.755 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' D' D ' 338' ' ' PHE . . . . . 0.731 ' HA ' HG21 ' D' ' 332' ' ' ILE . 45.2 t80 -55.18 -60.72 3.0 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.301 -0.874 . . . . 0.37 109.279 179.909 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' D' D ' 339' ' ' GLU . . . . . . . . . . . . . 92.9 mt-10 -51.62 -27.86 12.58 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.401 -0.812 . . . . 1.99 109.565 179.988 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' D' D ' 340' ' ' MET . . . . . 0.4 ' HB3' ' O ' ' D' ' 337' ' ' ARG . 28.0 ttp -64.73 -54.2 35.26 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.204 -0.935 . . . . 0.31 109.748 -179.953 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' D' D ' 341' ' ' PHE . . . . . 0.434 ' HB2' HD13 ' D' ' 332' ' ' ILE . 47.3 m-85 -61.78 -41.92 98.34 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.222 -0.924 . . . . 0.18 109.713 -179.728 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' D' D ' 342' ' ' ARG . . . . . . . . . . . . . 4.5 ttt180 -49.25 -41.77 38.61 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.264 -0.898 . . . . 2.41 109.563 -179.972 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' D' D ' 343' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -59.59 -46.64 88.34 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.361 -0.837 . . . . 2.35 109.63 -179.839 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' D' D ' 344' ' ' LEU . . . . . 0.56 ' CD2' HD22 ' C' ' 344' ' ' LEU . 36.7 mt -61.99 -31.63 72.01 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.132 -0.98 . . . . 0.19 109.515 -179.939 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' D' D ' 345' ' ' ASN . . . . . . . . . . . . . 26.7 t-20 -58.07 -57.15 14.09 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.174 -0.954 . . . . 1.09 109.736 -179.868 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' D' D ' 346' ' ' GLU . . . . . . . . . . . . . 19.3 tt0 -60.75 -28.28 68.58 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.358 -0.839 . . . . 1.69 109.916 -179.542 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' D' D ' 347' ' ' ALA . . . . . 0.81 ' HB1' ' HB1' ' C' ' 347' ' ' ALA . . . -60.89 -58.56 7.91 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.189 -0.944 . . . . 0.18 109.83 -179.71 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' D' D ' 348' ' ' LEU . . . . . 0.637 HD22 ' N ' ' D' ' 348' ' ' LEU . 4.0 mm? -62.22 -47.01 86.3 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.19 -0.944 . . . . 0.31 109.98 -179.514 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' D' D ' 349' ' ' GLU . . . . . . . . . . . . . 2.4 mt-10 -58.25 -29.03 65.44 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.168 -0.957 . . . . 1.95 110.04 -179.493 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' D' D ' 350' ' ' LEU . . . . . 0.795 ' CD1' HD22 ' C' ' 350' ' ' LEU . 3.5 tt -63.98 -50.87 66.86 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.141 -0.974 . . . . 0.43 109.235 179.818 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' D' D ' 351' ' ' LYS . . . . . . . . . . . . . 24.2 tttt -59.94 -38.53 82.67 Favored 'General case' 0 N--CA 1.489 1.487 0 O-C-N 121.44 -0.787 . . . . 1.4 109.47 179.915 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' D' D ' 352' ' ' ASP . . . . . . . . . . . . . 19.9 m-20 -57.19 -44.34 83.5 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.202 -0.936 . . . . 1.17 109.797 -179.94 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' D' D ' 353' ' ' ALA . . . . . . . . . . . . . . . -67.26 -20.2 65.62 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.232 -0.917 . . . . 0.59 109.743 -179.652 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' D' D ' 354' ' ' GLN . . . . . . . . . . . . . 1.5 mt-30 -84.08 -12.97 54.22 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.115 -0.991 . . . . 1.44 109.554 -179.925 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' D' D ' 355' ' ' ALA . . . . . . . . . . . . . . . -72.99 -7.26 50.37 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.232 -0.917 . . . . 0.98 109.61 179.925 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' D' D ' 356' ' ' GLY . . . . . . . . . . . . . . . -80.23 3.78 70.38 Favored Glycine 0 N--CA 1.491 2.349 0 N-CA-C 109.712 -1.355 . . . . 1.28 109.712 -179.888 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' D' D ' 357' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -87.0 105.71 17.33 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.244 -1.15 . . . . 4.09 109.597 -179.884 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' D' D ' 358' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -49.2 161.12 0.47 Allowed Pre-proline 0 N--CA 1.49 1.555 0 O-C-N 121.265 -0.897 . . . . 5.71 109.273 179.949 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' D' D ' 359' ' ' PRO . . . . . . . . . . . . . 3.4 Cg_exo -60.61 166.19 10.26 Favored 'Trans proline' 0 C--N 1.31 -1.476 0 C-N-CA 122.15 1.9 . . . . 4.97 109.959 179.771 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' D' D ' 360' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.294 0 CA-C-O 118.045 -1.42 . . . . 6.97 109.557 179.956 . . . . . . . . 0 0 . 1 . 030 nuclear nobuild full ' A' A ' 319' ' ' LYS . . . . . 0.414 ' O ' ' O ' ' A' ' 320' ' ' LYS . 26.7 mttp . . . . . 0 N--CA 1.49 1.528 0 N-CA-C 109.443 -0.576 . . . . 7.55 109.443 . . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 320' ' ' LYS . . . . . 0.414 ' O ' ' O ' ' A' ' 319' ' ' LYS . 0.4 OUTLIER 62.63 121.85 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.241 -0.912 . . . . 6.43 109.583 179.891 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild full ' A' A ' 321' ' ' LYS . . . . . 0.462 ' CG ' ' O ' ' A' ' 321' ' ' LYS . 0.0 OUTLIER -156.68 88.84 2.7 Favored Pre-proline 0 N--CA 1.49 1.535 0 N-CA-C 108.877 -0.786 . . . . 6.13 108.877 179.812 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild full ' A' A ' 322' ' ' PRO . . . . . . . . . . . . . 3.5 Cg_exo -59.11 133.33 52.42 Favored 'Trans proline' 0 C--N 1.311 -1.412 0 C-N-CA 122.126 1.884 . . . . 2.83 110.202 -179.448 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 323' ' ' LEU . . . . . . . . . . . . . 17.9 mt -80.51 124.94 29.36 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.326 -0.859 . . . . 2.83 109.264 -179.859 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 324' ' ' ASP . . . . . . . . . . . . . 3.8 m-20 -80.19 104.46 10.76 Favored 'General case' 0 N--CA 1.488 1.446 0 C-N-CA 119.813 -0.755 . . . . 1.53 109.308 -179.931 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 325' ' ' GLY . . . . . 0.573 ' O ' ' CD2' ' A' ' 327' ' ' TYR . . . -68.84 -164.55 3.5 Favored Glycine 0 N--CA 1.49 2.239 0 N-CA-C 109.494 -1.443 . . . . 0.61 109.494 -179.837 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 326' ' ' GLU . . . . . . . . . . . . . 8.6 mt-10 -59.73 165.21 3.18 Favored 'General case' 0 C--N 1.303 -1.446 0 O-C-N 121.316 -1.108 . . . . 2.13 109.457 -179.744 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 327' ' ' TYR . . . . . 0.573 ' CD2' ' O ' ' A' ' 325' ' ' GLY . 44.9 m-85 -149.08 107.96 3.87 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.082 -1.011 . . . . 0.48 109.885 -179.529 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 328' ' ' PHE . . . . . . . . . . . . . 18.4 m-85 -112.88 -166.72 1.1 Allowed 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.341 -0.849 . . . . 0.31 109.389 179.912 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 329' ' ' THR . . . . . . . . . . . . . 13.6 p -153.88 169.53 23.19 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.431 -0.793 . . . . 0.22 109.012 179.98 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 330' ' ' LEU . . . . . . . . . . . . . 18.2 tp -151.51 134.23 15.61 Favored 'General case' 0 C--N 1.302 -1.457 0 O-C-N 121.176 -0.952 . . . . 0.28 109.561 179.758 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 331' ' ' GLN . . . . . . . . . . . . . 2.1 tp60 -86.66 114.19 23.16 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.204 -0.935 . . . . 0.91 109.413 179.835 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 332' ' ' ILE . . . . . 0.907 HG21 ' HA ' ' A' ' 338' ' ' PHE . 64.0 mt -103.17 101.65 12.5 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.392 0 O-C-N 121.323 -0.861 . . . . 0.26 109.331 179.835 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 333' ' ' ARG . . . . . . . . . . . . . 57.3 mtt180 -71.86 152.72 42.4 Favored 'General case' 0 N--CA 1.487 1.409 0 O-C-N 121.403 -0.81 . . . . 2.92 109.829 -179.516 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 334' ' ' GLY . . . . . . . . . . . . . . . 76.27 131.36 0.39 Allowed Glycine 0 N--CA 1.489 2.224 0 N-CA-C 109.813 -1.315 . . . . 0.4 109.813 179.974 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 335' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -74.61 -34.85 62.91 Favored 'General case' 0 N--CA 1.488 1.449 0 O-C-N 121.181 -1.188 . . . . 3.01 109.743 -179.867 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 336' ' ' GLU . . . . . . . . . . . . . 15.1 mt-10 -58.82 -58.35 9.0 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.195 -0.941 . . . . 2.29 109.777 -179.864 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 337' ' ' ARG . . . . . 0.428 ' CZ ' HD12 ' C' ' 348' ' ' LEU . 5.8 mmt180 -60.73 -36.2 78.26 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.082 -1.011 . . . . 2.93 109.754 -179.783 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 338' ' ' PHE . . . . . 0.907 ' HA ' HG21 ' A' ' 332' ' ' ILE . 59.7 t80 -53.89 -60.89 2.74 Favored 'General case' 0 C--N 1.302 -1.486 0 O-C-N 120.95 -1.094 . . . . 0.38 109.419 179.978 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 339' ' ' GLU . . . . . . . . . . . . . 73.8 mt-10 -49.44 -36.31 22.05 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.384 -0.823 . . . . 1.97 110.64 -179.432 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 340' ' ' MET . . . . . . . . . . . . . 48.2 ttp -63.28 -49.65 73.21 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 120.979 -1.076 . . . . 0.31 110.145 -179.417 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 341' ' ' PHE . . . . . . . . . . . . . 52.7 m-85 -62.52 -46.17 89.62 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.308 -0.87 . . . . 0.18 109.636 -179.546 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 342' ' ' ARG . . . . . . . . . . . . . 12.6 ttp180 -47.43 -43.89 24.27 Favored 'General case' 0 N--CA 1.493 1.711 0 O-C-N 121.401 -0.812 . . . . 2.42 109.928 -179.579 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 343' ' ' GLU . . . . . . . . . . . . . 29.1 tt0 -58.6 -48.51 80.71 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.372 -0.83 . . . . 2.35 109.869 -179.517 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 344' ' ' LEU . . . . . 0.439 ' O ' ' HB3' ' A' ' 347' ' ' ALA . 55.3 mt -60.97 -30.79 70.47 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.196 -0.94 . . . . 0.18 109.566 -179.671 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 345' ' ' ASN . . . . . . . . . . . . . 11.3 t-20 -57.8 -59.59 5.0 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.252 -0.905 . . . . 1.09 109.635 -179.943 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 346' ' ' GLU . . . . . . . . . . . . . 79.4 tt0 -60.01 -24.78 64.76 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.148 -0.97 . . . . 1.65 109.652 -179.767 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 347' ' ' ALA . . . . . 0.6 ' HB1' ' HB1' ' B' ' 347' ' ' ALA . . . -61.84 -61.61 2.38 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.376 -0.827 . . . . 0.18 109.75 179.809 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 348' ' ' LEU . . . . . 0.621 HD22 ' N ' ' A' ' 348' ' ' LEU . 3.8 mm? -61.39 -46.67 89.19 Favored 'General case' 0 N--CA 1.495 1.812 0 O-C-N 121.31 -0.869 . . . . 0.3 109.868 -179.604 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 349' ' ' GLU . . . . . . . . . . . . . 25.8 mm-40 -56.44 -34.0 66.4 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.235 -0.916 . . . . 1.94 109.736 -179.456 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 350' ' ' LEU . . . . . 0.649 HD11 ' NE2' ' B' ' 354' ' ' GLN . 5.8 tt -62.5 -47.03 85.76 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.197 -0.939 . . . . 0.46 109.02 -179.936 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 351' ' ' LYS . . . . . . . . . . . . . 6.3 tttt -57.44 -43.36 83.83 Favored 'General case' 0 C--N 1.302 -1.489 0 O-C-N 121.329 -0.857 . . . . 1.4 109.385 179.621 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 352' ' ' ASP . . . . . . . . . . . . . 23.1 m-20 -55.87 -40.1 72.46 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.275 -0.891 . . . . 1.16 109.397 179.857 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 353' ' ' ALA . . . . . . . . . . . . . . . -69.01 -26.65 65.11 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.37 -0.831 . . . . 0.63 109.736 -179.901 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 354' ' ' GLN . . . . . 0.538 ' NE2' HD11 ' B' ' 350' ' ' LEU . 5.1 tt0 -80.57 -4.62 54.74 Favored 'General case' 0 N--CA 1.495 1.782 0 O-C-N 121.116 -0.99 . . . . 1.47 109.877 -179.893 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 355' ' ' ALA . . . . . . . . . . . . . . . -69.77 -89.42 0.02 OUTLIER 'General case' 0 N--CA 1.494 1.753 0 O-C-N 121.304 -0.873 . . . . 1.01 109.214 179.875 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 356' ' ' GLY . . . . . . . . . . . . . . . -67.47 103.72 1.01 Allowed Glycine 0 N--CA 1.488 2.121 0 N-CA-C 109.418 -1.473 . . . . 1.3 109.418 179.74 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 357' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -85.99 122.08 29.53 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.277 -1.131 . . . . 4.1 109.536 -179.967 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 358' ' ' GLU . . . . . . . . . . . . . 6.5 mm-40 -49.15 118.03 7.23 Favored Pre-proline 0 N--CA 1.494 1.772 0 O-C-N 121.438 -0.789 . . . . 5.75 109.577 -179.83 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 359' ' ' PRO . . . . . . . . . . . . . 2.8 Cg_endo -61.85 145.28 97.16 Favored 'Trans proline' 0 C--N 1.313 -1.318 0 C-N-CA 121.98 1.787 . . . . 5.0 109.982 179.935 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 360' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.252 0 N-CA-C 109.532 -1.427 . . . . 6.97 109.532 179.815 . . . . . . . . 0 0 . 1 . 030 nuclear nobuild full ' B' B ' 319' ' ' LYS . . . . . . . . . . . . . 25.4 mttp . . . . . 0 N--CA 1.495 1.809 0 N-CA-C 109.149 -0.685 . . . . 7.55 109.149 . . . . . . . . . 0 0 . 1 . 030 nuclear nobuild full ' B' B ' 320' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER 63.74 119.22 0.02 OUTLIER 'General case' 0 C--N 1.3 -1.551 0 O-C-N 121.24 -0.912 . . . . 6.44 109.734 179.783 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' B' B ' 321' ' ' LYS . . . . . 0.496 ' CD ' ' O ' ' B' ' 321' ' ' LYS . 0.0 OUTLIER -156.44 87.73 2.87 Favored Pre-proline 0 N--CA 1.489 1.5 0 O-C-N 121.355 -0.841 . . . . 6.13 108.992 179.884 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild full ' B' B ' 322' ' ' PRO . . . . . . . . . . . . . 4.2 Cg_exo -58.83 134.22 58.96 Favored 'Trans proline' 0 C--N 1.31 -1.461 0 C-N-CA 122.151 1.901 . . . . 2.82 110.335 -179.705 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' B' B ' 323' ' ' LEU . . . . . . . . . . . . . 17.2 mt -81.33 124.59 29.49 Favored 'General case' 0 C--N 1.301 -1.526 0 O-C-N 121.349 -0.844 . . . . 2.84 109.332 -179.687 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' B' B ' 324' ' ' ASP . . . . . . . . . . . . . 2.9 m-20 -79.67 104.48 10.29 Favored 'General case' 0 N--CA 1.487 1.385 0 O-C-N 121.374 -0.829 . . . . 1.53 109.444 179.981 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' B' B ' 325' ' ' GLY . . . . . 0.567 ' O ' ' CD2' ' B' ' 327' ' ' TYR . . . -67.88 -165.24 2.97 Favored Glycine 0 N--CA 1.489 2.176 0 N-CA-C 109.404 -1.478 . . . . 0.59 109.404 179.942 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' B' B ' 326' ' ' GLU . . . . . . . . . . . . . 6.2 mt-10 -59.23 165.84 2.46 Favored 'General case' 0 N--CA 1.489 1.48 0 O-C-N 121.218 -1.166 . . . . 2.13 109.282 179.795 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' B' B ' 327' ' ' TYR . . . . . 0.567 ' CD2' ' O ' ' B' ' 325' ' ' GLY . 41.3 m-85 -149.37 108.94 3.99 Favored 'General case' 0 C--N 1.303 -1.429 0 O-C-N 121.324 -0.86 . . . . 0.48 109.684 -179.843 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' B' B ' 328' ' ' PHE . . . . . . . . . . . . . 18.9 m-85 -113.0 -166.96 1.13 Allowed 'General case' 0 C--N 1.302 -1.476 0 O-C-N 121.273 -0.892 . . . . 0.32 109.366 179.964 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' B' B ' 329' ' ' THR . . . . . . . . . . . . . 16.5 p -153.9 169.2 24.01 Favored 'General case' 0 N--CA 1.488 1.463 0 O-C-N 121.351 -0.843 . . . . 0.23 108.994 179.611 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' B' B ' 330' ' ' LEU . . . . . 0.4 ' O ' ' HA ' ' D' ' 329' ' ' THR . 18.1 tp -151.53 134.42 15.73 Favored 'General case' 0 N--CA 1.491 1.625 0 O-C-N 121.334 -0.854 . . . . 0.28 109.673 179.796 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' B' B ' 331' ' ' GLN . . . . . . . . . . . . . 2.1 tp60 -86.94 114.58 23.69 Favored 'General case' 0 C--N 1.302 -1.47 0 O-C-N 121.416 -0.803 . . . . 0.91 109.66 179.672 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' B' B ' 332' ' ' ILE . . . . . 0.877 HG21 ' HA ' ' B' ' 338' ' ' PHE . 58.0 mt -103.03 101.93 12.89 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.458 0 O-C-N 121.245 -0.909 . . . . 0.24 109.181 179.751 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' B' B ' 333' ' ' ARG . . . . . . . . . . . . . 54.7 mtt180 -72.1 152.14 42.56 Favored 'General case' 0 N--CA 1.488 1.456 0 O-C-N 121.259 -0.901 . . . . 2.93 109.613 -179.71 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' B' B ' 334' ' ' GLY . . . . . . . . . . . . . . . 77.51 130.42 0.49 Allowed Glycine 0 N--CA 1.491 2.33 0 N-CA-C 109.795 -1.322 . . . . 0.4 109.795 179.735 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' B' B ' 335' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -74.22 -34.56 63.73 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.165 -1.197 . . . . 3.01 109.759 179.9 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' B' B ' 336' ' ' GLU . . . . . . . . . . . . . 11.4 mt-10 -59.22 -58.28 9.34 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.199 -0.938 . . . . 2.28 109.688 -179.697 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' B' B ' 337' ' ' ARG . . . . . . . . . . . . . 5.1 mmt180 -60.81 -36.13 78.28 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.441 -0.787 . . . . 2.93 109.655 -179.674 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' B' B ' 338' ' ' PHE . . . . . 0.877 ' HA ' HG21 ' B' ' 332' ' ' ILE . 62.7 t80 -54.23 -60.07 3.83 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.233 -0.917 . . . . 0.37 109.435 179.884 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' B' B ' 339' ' ' GLU . . . . . . . . . . . . . 80.8 mt-10 -49.9 -36.56 27.91 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.262 -0.899 . . . . 1.98 110.379 -179.64 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' B' B ' 340' ' ' MET . . . . . . . . . . . . . 47.9 ttp -63.38 -50.32 70.35 Favored 'General case' 0 N--CA 1.494 1.76 0 O-C-N 121.088 -1.008 . . . . 0.32 110.278 -179.387 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' B' B ' 341' ' ' PHE . . . . . . . . . . . . . 54.5 m-85 -62.24 -45.72 92.05 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.128 -0.983 . . . . 0.18 109.998 -179.707 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' B' B ' 342' ' ' ARG . . . . . . . . . . . . . 13.0 ttp180 -47.59 -43.75 25.81 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.329 -0.857 . . . . 2.42 109.849 -179.931 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' B' B ' 343' ' ' GLU . . . . . . . . . . . . . 30.6 tt0 -58.84 -48.91 79.67 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.417 -0.802 . . . . 2.35 109.68 -179.578 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' B' B ' 344' ' ' LEU . . . . . 0.408 ' O ' ' HB3' ' B' ' 347' ' ' ALA . 52.9 mt -60.97 -29.96 69.97 Favored 'General case' 0 N--CA 1.489 1.486 0 O-C-N 121.021 -1.049 . . . . 0.18 109.576 -179.538 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' B' B ' 345' ' ' ASN . . . . . . . . . . . . . 11.2 t-20 -58.13 -59.99 4.44 Favored 'General case' 0 N--CA 1.489 1.493 0 O-C-N 121.248 -0.908 . . . . 1.09 109.702 179.875 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' B' B ' 346' ' ' GLU . . . . . . . . . . . . . 86.1 tt0 -60.16 -24.14 64.5 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.253 -0.904 . . . . 1.66 109.382 -179.724 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' B' B ' 347' ' ' ALA . . . . . 0.6 ' HB1' ' HB1' ' A' ' 347' ' ' ALA . . . -62.18 -61.8 2.21 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.147 -0.97 . . . . 0.17 109.967 -179.829 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' B' B ' 348' ' ' LEU . . . . . 0.62 HD22 ' N ' ' B' ' 348' ' ' LEU . 3.8 mm? -61.26 -45.77 93.14 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.325 -0.86 . . . . 0.29 109.824 -179.722 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' B' B ' 349' ' ' GLU . . . . . . . . . . . . . 27.6 mm-40 -56.68 -33.49 66.47 Favored 'General case' 0 N--CA 1.494 1.762 0 O-C-N 121.399 -0.813 . . . . 1.95 109.832 -179.399 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' B' B ' 350' ' ' LEU . . . . . 0.591 ' O ' HD23 ' B' ' 350' ' ' LEU . 5.7 tt -63.53 -46.75 84.59 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.381 -0.824 . . . . 0.45 108.847 -179.943 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' B' B ' 351' ' ' LYS . . . . . . . . . . . . . 5.7 tttt -57.62 -44.04 85.25 Favored 'General case' 0 C--N 1.302 -1.481 0 O-C-N 121.449 -0.782 . . . . 1.38 109.022 179.584 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' B' B ' 352' ' ' ASP . . . . . . . . . . . . . 25.2 m-20 -55.3 -39.55 70.05 Favored 'General case' 0 N--CA 1.488 1.456 0 O-C-N 121.389 -0.82 . . . . 1.16 109.502 179.82 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' B' B ' 353' ' ' ALA . . . . . . . . . . . . . . . -69.53 -26.45 64.53 Favored 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.454 -0.779 . . . . 0.61 109.889 -179.898 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' B' B ' 354' ' ' GLN . . . . . 0.649 ' NE2' HD11 ' A' ' 350' ' ' LEU . 4.6 tt0 -81.25 -3.94 53.96 Favored 'General case' 0 C--N 1.302 -1.479 0 O-C-N 120.954 -1.091 . . . . 1.45 109.798 -179.91 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' B' B ' 355' ' ' ALA . . . . . . . . . . . . . . . -68.95 -89.53 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.158 -0.963 . . . . 0.98 109.533 179.965 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' B' B ' 356' ' ' GLY . . . . . . . . . . . . . . . -68.26 105.15 1.35 Allowed Glycine 0 N--CA 1.488 2.101 0 N-CA-C 109.394 -1.482 . . . . 1.29 109.394 179.997 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' B' B ' 357' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -86.5 122.93 31.12 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.19 -1.182 . . . . 4.09 109.682 -179.896 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' B' B ' 358' ' ' GLU . . . . . . . . . . . . . 6.0 mm-40 -49.52 117.94 7.61 Favored Pre-proline 0 N--CA 1.491 1.607 0 O-C-N 121.336 -0.852 . . . . 5.72 109.676 179.955 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' B' B ' 359' ' ' PRO . . . . . . . . . . . . . 2.6 Cg_endo -61.66 149.18 90.96 Favored 'Trans proline' 0 C--N 1.314 -1.277 0 C-N-CA 122.063 1.842 . . . . 4.98 109.979 179.824 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' B' B ' 360' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.493 2.461 0 CA-C-O 117.945 -1.475 . . . . 6.98 109.586 -179.986 . . . . . . . . 0 0 . 1 . 030 nuclear nobuild full ' C' C ' 319' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.494 1.733 0 N-CA-C 109.185 -0.672 . . . . 6.82 109.185 . . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' C' C ' 320' ' ' LYS . . . . . . . . . . . . . 6.7 tttt 62.41 81.34 0.2 Allowed 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.24 -0.913 . . . . 6.49 109.105 -179.657 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' C' C ' 321' ' ' LYS . . . . . . . . . . . . . 2.6 mttt -156.71 69.16 4.63 Favored Pre-proline 0 N--CA 1.493 1.686 0 O-C-N 121.075 -1.016 . . . . 6.4 109.704 -179.762 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' C' C ' 322' ' ' PRO . . . . . . . . . . . . . 6.0 Cg_exo -58.51 97.76 0.09 OUTLIER 'Trans proline' 0 C--N 1.31 -1.467 0 C-N-CA 122.277 1.984 . . . . 3.42 109.759 179.926 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' C' C ' 323' ' ' LEU . . . . . . . . . . . . . 26.8 mt -81.09 129.03 34.37 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.326 -0.859 . . . . 3.95 109.871 -179.511 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' C' C ' 324' ' ' ASP . . . . . . . . . . . . . 94.7 m-20 -80.32 103.45 10.2 Favored 'General case' 0 N--CA 1.489 1.5 0 O-C-N 121.337 -0.852 . . . . 1.63 109.652 179.767 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' C' C ' 325' ' ' GLY . . . . . 0.578 ' O ' ' CD2' ' C' ' 327' ' ' TYR . . . -70.44 -161.17 3.53 Favored Glycine 0 N--CA 1.493 2.481 0 N-CA-C 109.52 -1.432 . . . . 0.73 109.52 179.792 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' C' C ' 326' ' ' GLU . . . . . . . . . . . . . 2.9 mp0 -60.2 163.51 4.89 Favored 'General case' 0 C--N 1.303 -1.422 0 O-C-N 121.239 -1.154 . . . . 2.17 109.433 179.838 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' C' C ' 327' ' ' TYR . . . . . 0.578 ' CD2' ' O ' ' C' ' 325' ' ' GLY . 49.5 m-85 -150.75 114.19 4.89 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.062 -1.024 . . . . 0.48 109.835 179.752 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' C' C ' 328' ' ' PHE . . . . . 0.458 ' O ' HG23 ' C' ' 329' ' ' THR . 79.5 m-85 -113.38 -167.81 1.25 Allowed 'General case' 0 N--CA 1.488 1.466 0 O-C-N 121.217 -0.927 . . . . 0.33 109.491 179.542 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' C' C ' 329' ' ' THR . . . . . 0.458 HG23 ' O ' ' C' ' 328' ' ' PHE . 4.4 p -153.91 161.84 41.69 Favored 'General case' 0 C--N 1.301 -1.508 0 O-C-N 121.068 -1.02 . . . . 0.23 109.536 -179.881 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' C' C ' 330' ' ' LEU . . . . . . . . . . . . . 15.0 tp -149.24 129.43 13.65 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.291 -0.881 . . . . 0.28 109.671 -179.703 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' C' C ' 331' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -87.15 119.88 27.85 Favored 'General case' 0 N--CA 1.487 1.4 0 O-C-N 121.334 -0.854 . . . . 1.48 109.229 179.632 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' C' C ' 332' ' ' ILE . . . . . 0.719 HG21 ' HA ' ' C' ' 338' ' ' PHE . 14.1 mt -103.23 105.89 19.12 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.574 0 O-C-N 121.18 -0.95 . . . . 0.24 109.299 179.915 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' C' C ' 333' ' ' ARG . . . . . 0.573 ' HG2' ' CE1' ' A' ' 327' ' ' TYR . 8.3 mtt180 -72.65 134.9 45.32 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.228 -0.92 . . . . 2.74 109.155 179.624 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' C' C ' 334' ' ' GLY . . . . . . . . . . . . . . . 92.78 134.79 6.94 Favored Glycine 0 N--CA 1.489 2.176 0 N-CA-C 109.714 -1.354 . . . . 0.35 109.714 179.959 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' C' C ' 335' ' ' ARG . . . . . 0.408 ' O ' ' HB3' ' C' ' 338' ' ' PHE . 6.7 tpt180 -80.33 -34.25 36.83 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.502 -0.999 . . . . 2.53 109.319 179.922 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' C' C ' 336' ' ' GLU . . . . . . . . . . . . . 1.3 tt0 -57.96 -61.45 2.53 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.189 -0.945 . . . . 2.62 109.69 -179.974 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' C' C ' 337' ' ' ARG . . . . . . . . . . . . . 3.0 mtt180 -59.19 -28.57 66.76 Favored 'General case' 0 N--CA 1.487 1.384 0 O-C-N 121.065 -1.022 . . . . 2.81 109.553 -179.91 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' C' C ' 338' ' ' PHE . . . . . 0.719 ' HA ' HG21 ' C' ' 332' ' ' ILE . 48.4 t80 -55.21 -62.4 1.69 Allowed 'General case' 0 N--CA 1.487 1.389 0 O-C-N 121.275 -0.891 . . . . 0.4 109.61 179.887 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' C' C ' 339' ' ' GLU . . . . . . . . . . . . . 1.3 mm-40 -49.79 -31.44 11.63 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 120.994 -1.066 . . . . 2.05 109.662 -179.819 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' C' C ' 340' ' ' MET . . . . . . . . . . . . . 24.2 ttp -63.27 -57.38 10.62 Favored 'General case' 0 N--CA 1.488 1.462 0 O-C-N 121.271 -0.893 . . . . 0.32 110.35 -179.429 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' C' C ' 341' ' ' PHE . . . . . 0.444 ' HB2' ' CD1' ' C' ' 332' ' ' ILE . 51.7 m-85 -61.57 -47.87 83.54 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.004 -1.06 . . . . 0.18 109.715 -179.575 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' C' C ' 342' ' ' ARG . . . . . 0.439 HH11 ' CG ' ' C' ' 342' ' ' ARG . 0.0 OUTLIER -47.15 -40.93 16.76 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.556 -0.715 . . . . 2.91 109.947 -179.983 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild full ' C' C ' 343' ' ' GLU . . . . . 0.442 ' HA ' ' OE1' ' C' ' 343' ' ' GLU . 4.6 tp10 -60.1 -48.73 80.51 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.236 -0.915 . . . . 2.14 109.611 -179.951 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' C' C ' 344' ' ' LEU . . . . . . . . . . . . . 28.7 mt -62.18 -31.1 71.57 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.324 -0.86 . . . . 0.22 109.47 -179.899 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' C' C ' 345' ' ' ASN . . . . . . . . . . . . . 8.8 t-20 -57.57 -50.53 72.79 Favored 'General case' 0 C--N 1.301 -1.529 0 O-C-N 121.16 -0.962 . . . . 1.08 109.258 -179.928 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' C' C ' 346' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -63.9 -33.43 75.69 Favored 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.247 -0.908 . . . . 2.21 109.85 -179.849 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' C' C ' 347' ' ' ALA . . . . . 0.422 ' HB1' ' HB1' ' D' ' 347' ' ' ALA . . . -61.26 -60.1 4.27 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.225 -0.922 . . . . 0.18 110.285 -179.459 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' C' C ' 348' ' ' LEU . . . . . 0.543 HD22 ' N ' ' C' ' 348' ' ' LEU . 3.8 mm? -59.0 -44.45 91.67 Favored 'General case' 0 N--CA 1.488 1.472 0 O-C-N 121.154 -0.966 . . . . 0.32 109.814 -179.025 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' C' C ' 349' ' ' GLU . . . . . . . . . . . . . 20.2 mt-10 -58.61 -34.4 71.1 Favored 'General case' 0 N--CA 1.489 1.525 0 O-C-N 121.094 -1.004 . . . . 2.19 109.735 -179.751 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' C' C ' 350' ' ' LEU . . . . . 0.74 ' CD2' HD13 ' D' ' 350' ' ' LEU . 4.9 tt -64.07 -46.78 82.79 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.304 -0.872 . . . . 0.46 109.459 -179.713 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' C' C ' 351' ' ' LYS . . . . . 0.539 ' N ' HD23 ' C' ' 350' ' ' LEU . 3.5 tttt -61.16 -44.02 97.97 Favored 'General case' 0 C--N 1.301 -1.531 0 O-C-N 121.408 -0.807 . . . . 1.35 109.587 -179.79 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' C' C ' 352' ' ' ASP . . . . . . . . . . . . . 56.2 m-20 -55.76 -47.0 77.75 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.353 -0.842 . . . . 1.19 109.951 -179.696 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' C' C ' 353' ' ' ALA . . . . . . . . . . . . . . . -68.31 -19.26 64.66 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.309 -0.869 . . . . 0.57 109.709 -179.578 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' C' C ' 354' ' ' GLN . . . . . 0.44 ' NE2' HD11 ' D' ' 350' ' ' LEU . 3.2 mt-30 -80.45 -3.42 49.79 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.07 -1.019 . . . . 1.47 109.449 179.659 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' C' C ' 355' ' ' ALA . . . . . . . . . . . . . . . -68.02 -87.98 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.353 -0.842 . . . . 0.93 109.878 -179.664 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' C' C ' 356' ' ' GLY . . . . . . . . . . . . . . . -77.83 89.98 1.07 Allowed Glycine 0 N--CA 1.492 2.425 0 N-CA-C 109.669 -1.372 . . . . 1.33 109.669 -179.926 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' C' C ' 357' ' ' LYS . . . . . . . . . . . . . 8.8 tptp -88.09 133.57 33.96 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.41 -1.053 . . . . 4.01 109.26 179.816 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' C' C ' 358' ' ' GLU . . . . . 0.447 ' HG2' ' HD2' ' C' ' 359' ' ' PRO . 0.1 OUTLIER -50.11 134.12 22.91 Favored Pre-proline 0 C--N 1.304 -1.385 0 O-C-N 121.402 -0.811 . . . . 5.75 109.303 179.864 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild full ' C' C ' 359' ' ' PRO . . . . . 0.447 ' HD2' ' HG2' ' C' ' 358' ' ' GLU . 2.8 Cg_endo -63.07 112.38 1.67 Allowed 'Trans proline' 0 C--N 1.312 -1.383 0 C-N-CA 122.029 1.819 . . . . 4.94 110.015 179.96 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' C' C ' 360' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.364 0 N-CA-C 109.213 -1.555 . . . . 6.5 109.213 179.837 . . . . . . . . 0 0 . 1 . 030 nuclear nobuild full ' D' D ' 319' ' ' LYS . . . . . . . . . . . . . 20.9 mttp . . . . . 0 N--CA 1.491 1.596 0 CA-C-O 121.227 0.537 . . . . 7.53 109.681 . . . . . . . . . 0 0 . 1 . 030 nuclear nobuild full ' D' D ' 320' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER 64.32 120.83 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.424 -0.797 . . . . 6.41 109.218 179.828 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' D' D ' 321' ' ' LYS . . . . . 0.488 ' O ' ' CG ' ' D' ' 321' ' ' LYS . 0.0 OUTLIER -157.21 87.69 2.65 Favored Pre-proline 0 N--CA 1.492 1.64 0 O-C-N 121.168 -0.957 . . . . 6.11 109.268 179.989 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild full ' D' D ' 322' ' ' PRO . . . . . . . . . . . . . 4.2 Cg_exo -58.45 135.77 69.96 Favored 'Trans proline' 0 C--N 1.307 -1.644 0 C-N-CA 122.16 1.906 . . . . 2.82 110.426 -179.407 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' D' D ' 323' ' ' LEU . . . . . . . . . . . . . 19.1 mt -82.32 125.37 30.91 Favored 'General case' 0 C--N 1.303 -1.454 0 O-C-N 121.336 -0.852 . . . . 2.83 109.499 -179.805 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' D' D ' 324' ' ' ASP . . . . . . . . . . . . . 2.5 m-20 -80.35 103.82 10.48 Favored 'General case' 0 C--N 1.304 -1.409 0 C-N-CA 119.726 -0.79 . . . . 1.54 109.026 -179.999 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' D' D ' 325' ' ' GLY . . . . . 0.561 ' O ' ' CD2' ' D' ' 327' ' ' TYR . . . -68.51 -163.86 2.97 Favored Glycine 0 N--CA 1.493 2.49 0 N-CA-C 109.582 -1.407 . . . . 0.59 109.582 -179.955 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' D' D ' 326' ' ' GLU . . . . . . . . . . . . . 5.7 mt-10 -59.28 164.78 3.01 Favored 'General case' 0 N--CA 1.489 1.501 0 O-C-N 121.283 -1.128 . . . . 2.13 109.496 -179.864 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' D' D ' 327' ' ' TYR . . . . . 0.561 ' CD2' ' O ' ' D' ' 325' ' ' GLY . 41.3 m-85 -148.35 109.13 4.22 Favored 'General case' 0 C--N 1.302 -1.484 0 O-C-N 121.072 -1.018 . . . . 0.47 109.407 179.949 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' D' D ' 328' ' ' PHE . . . . . . . . . . . . . 18.6 m-85 -113.9 -167.88 1.27 Allowed 'General case' 0 N--CA 1.489 1.49 0 O-C-N 121.158 -0.964 . . . . 0.3 109.125 -179.802 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' D' D ' 329' ' ' THR . . . . . 0.4 ' HA ' ' O ' ' B' ' 330' ' ' LEU . 15.2 p -153.58 169.35 23.44 Favored 'General case' 0 C--N 1.302 -1.49 0 O-C-N 121.373 -0.829 . . . . 0.22 108.855 -179.902 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' D' D ' 330' ' ' LEU . . . . . . . . . . . . . 20.7 tp -151.78 134.48 15.54 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.44 -0.788 . . . . 0.28 109.686 -179.909 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' D' D ' 331' ' ' GLN . . . . . . . . . . . . . 3.3 tp60 -87.19 114.54 23.89 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.526 -0.733 . . . . 0.93 109.583 179.714 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' D' D ' 332' ' ' ILE . . . . . 0.844 HG21 ' HA ' ' D' ' 338' ' ' PHE . 57.8 mt -103.25 101.68 12.54 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.475 0 O-C-N 121.348 -0.845 . . . . 0.25 109.079 179.85 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' D' D ' 333' ' ' ARG . . . . . . . . . . . . . 47.0 mtt180 -72.17 153.42 41.64 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.322 -0.861 . . . . 2.93 109.733 -179.72 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' D' D ' 334' ' ' GLY . . . . . . . . . . . . . . . 76.38 131.33 0.4 Allowed Glycine 0 N--CA 1.492 2.378 0 N-CA-C 109.588 -1.405 . . . . 0.41 109.588 179.672 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' D' D ' 335' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -75.31 -35.15 61.29 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.222 -1.164 . . . . 3.03 109.762 179.994 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' D' D ' 336' ' ' GLU . . . . . . . . . . . . . 9.7 mt-10 -58.46 -58.01 10.42 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.131 -0.981 . . . . 2.26 109.716 -179.937 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' D' D ' 337' ' ' ARG . . . . . . . . . . . . . 5.9 mmt180 -60.81 -35.46 76.57 Favored 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.099 -1.001 . . . . 2.92 109.865 179.927 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' D' D ' 338' ' ' PHE . . . . . 0.844 ' HA ' HG21 ' D' ' 332' ' ' ILE . 65.6 t80 -54.99 -59.47 4.7 Favored 'General case' 0 N--CA 1.487 1.376 0 O-C-N 121.082 -1.011 . . . . 0.37 109.364 179.998 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' D' D ' 339' ' ' GLU . . . . . . . . . . . . . 78.1 mt-10 -50.09 -36.5 29.7 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.592 -0.693 . . . . 1.99 110.485 -179.43 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' D' D ' 340' ' ' MET . . . . . . . . . . . . . 43.5 ttp -64.39 -50.49 67.45 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.078 -1.014 . . . . 0.31 110.278 -179.266 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' D' D ' 341' ' ' PHE . . . . . . . . . . . . . 53.9 m-85 -61.81 -45.53 93.43 Favored 'General case' 0 C--N 1.298 -1.631 0 O-C-N 120.925 -1.109 . . . . 0.18 110.249 -179.408 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' D' D ' 342' ' ' ARG . . . . . . . . . . . . . 11.6 ttp180 -48.12 -43.91 31.48 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.157 -0.964 . . . . 2.41 109.896 -179.656 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' D' D ' 343' ' ' GLU . . . . . . . . . . . . . 27.7 tt0 -58.24 -48.26 80.95 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.246 -0.909 . . . . 2.35 109.7 -179.539 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' D' D ' 344' ' ' LEU . . . . . . . . . . . . . 46.4 mt -61.47 -30.31 70.52 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.074 -1.016 . . . . 0.19 109.551 -179.872 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' D' D ' 345' ' ' ASN . . . . . . . . . . . . . 12.6 t-20 -57.82 -59.11 5.73 Favored 'General case' 0 C--N 1.305 -1.367 0 O-C-N 121.148 -0.97 . . . . 1.09 109.587 -179.931 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' D' D ' 346' ' ' GLU . . . . . . . . . . . . . 83.4 tt0 -60.52 -25.22 65.95 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.327 -0.858 . . . . 1.69 109.692 -179.755 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' D' D ' 347' ' ' ALA . . . . . 0.422 ' HB1' ' HB1' ' C' ' 347' ' ' ALA . . . -61.71 -60.89 2.99 Favored 'General case' 0 C--N 1.301 -1.515 0 O-C-N 121.171 -0.956 . . . . 0.18 109.773 -179.77 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' D' D ' 348' ' ' LEU . . . . . 0.627 HD22 ' N ' ' D' ' 348' ' ' LEU . 3.8 mm? -61.84 -46.33 89.92 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.35 -0.843 . . . . 0.31 109.716 -179.239 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' D' D ' 349' ' ' GLU . . . . . . . . . . . . . 21.1 mm-40 -56.85 -31.67 65.03 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.374 -0.829 . . . . 1.95 109.904 -179.516 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' D' D ' 350' ' ' LEU . . . . . 0.74 HD13 ' CD2' ' C' ' 350' ' ' LEU . 5.8 tt -64.75 -47.12 79.37 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.466 -0.771 . . . . 0.43 108.957 179.787 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' D' D ' 351' ' ' LYS . . . . . . . . . . . . . 6.1 tttt -57.71 -43.67 85.36 Favored 'General case' 0 N--CA 1.489 1.513 0 N-CA-C 109.047 -0.723 . . . . 1.4 109.047 179.755 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' D' D ' 352' ' ' ASP . . . . . . . . . . . . . 15.7 m-20 -55.05 -39.87 69.66 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.362 -0.836 . . . . 1.17 109.603 179.904 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' D' D ' 353' ' ' ALA . . . . . . . . . . . . . . . -69.0 -27.12 65.41 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.465 -0.772 . . . . 0.59 109.848 -179.927 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' D' D ' 354' ' ' GLN . . . . . . . . . . . . . 4.4 tt0 -80.66 -4.46 54.34 Favored 'General case' 0 N--CA 1.488 1.468 0 O-C-N 120.946 -1.096 . . . . 1.44 109.997 -179.636 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' D' D ' 355' ' ' ALA . . . . . . . . . . . . . . . -69.49 -88.06 0.02 OUTLIER 'General case' 0 N--CA 1.496 1.856 0 O-C-N 121.252 -0.905 . . . . 0.98 109.603 -179.998 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' D' D ' 356' ' ' GLY . . . . . . . . . . . . . . . -68.35 104.76 1.26 Allowed Glycine 0 N--CA 1.489 2.214 0 N-CA-C 109.208 -1.557 . . . . 1.28 109.208 179.84 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' D' D ' 357' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -86.68 124.36 32.86 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.108 -1.231 . . . . 4.09 109.606 -179.612 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' D' D ' 358' ' ' GLU . . . . . . . . . . . . . 5.3 mm-40 -50.09 118.5 9.08 Favored Pre-proline 0 N--CA 1.489 1.501 0 O-C-N 121.266 -0.897 . . . . 5.71 109.639 179.995 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' D' D ' 359' ' ' PRO . . . . . . . . . . . . . 2.5 Cg_endo -62.43 150.11 88.52 Favored 'Trans proline' 0 C--N 1.313 -1.338 0 C-N-CA 121.95 1.767 . . . . 4.97 109.919 179.559 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' D' D ' 360' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.488 2.149 0 CA-C-O 117.958 -1.468 . . . . 6.97 109.536 179.978 . . . . . . . . 0 0 . 1 . 031 nuclear nobuild full ' A' A ' 319' ' ' LYS . . . . . . . . . . . . . 5.8 mtpt . . . . . 0 N--CA 1.492 1.661 0 N-CA-C 109.474 -0.565 . . . . 7.55 109.474 . . . . . . . . . 0 0 . 1 . 031 nuclear nobuild full ' A' A ' 320' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER 64.28 137.14 0.02 OUTLIER 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.162 -0.961 . . . . 6.43 109.67 -179.978 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 321' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -159.24 71.61 3.45 Favored Pre-proline 0 N--CA 1.489 1.517 0 O-C-N 121.317 -0.864 . . . . 6.13 109.212 179.822 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 322' ' ' PRO . . . . . . . . . . . . . 3.5 Cg_exo -60.88 128.42 25.45 Favored 'Trans proline' 0 C--N 1.308 -1.572 0 C-N-CA 122.278 1.985 . . . . 2.83 109.795 -179.754 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 323' ' ' LEU . . . . . . . . . . . . . 15.2 mt -79.32 124.88 28.82 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.291 -0.88 . . . . 2.83 109.411 -179.676 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 324' ' ' ASP . . . . . 0.509 ' CB ' ' OH ' ' A' ' 327' ' ' TYR . 11.9 m-20 -80.21 155.29 27.45 Favored 'General case' 0 C--N 1.304 -1.405 0 O-C-N 121.281 -0.887 . . . . 1.53 108.995 179.894 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 325' ' ' GLY . . . . . . . . . . . . . . . -70.42 -161.2 3.53 Favored Glycine 0 N--CA 1.488 2.162 0 N-CA-C 109.137 -1.585 . . . . 0.61 109.137 179.887 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 326' ' ' GLU . . . . . . . . . . . . . 2.6 mt-10 -59.19 -166.56 0.01 OUTLIER 'General case' 0 N--CA 1.488 1.47 0 O-C-N 121.153 -1.204 . . . . 2.13 109.042 179.677 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 327' ' ' TYR . . . . . 0.509 ' OH ' ' CB ' ' A' ' 324' ' ' ASP . 33.6 m-85 -148.5 112.42 5.14 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.212 -0.93 . . . . 0.48 109.722 179.901 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 328' ' ' PHE . . . . . 0.405 ' O ' HG23 ' A' ' 329' ' ' THR . 85.1 m-85 -114.78 -168.12 1.33 Allowed 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.452 -0.78 . . . . 0.31 109.45 179.972 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 329' ' ' THR . . . . . 0.405 HG23 ' O ' ' A' ' 328' ' ' PHE . 37.0 p -154.18 157.93 39.56 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.206 -0.934 . . . . 0.22 109.315 -179.971 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 330' ' ' LEU . . . . . 0.583 HD11 HD22 ' C' ' 345' ' ' ASN . 21.9 tp -150.73 128.81 11.85 Favored 'General case' 0 N--CA 1.488 1.465 0 O-C-N 121.213 -0.929 . . . . 0.28 109.888 -179.546 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 331' ' ' GLN . . . . . . . . . . . . . 1.3 tt0 -86.92 117.06 25.4 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.242 -0.911 . . . . 0.91 109.095 179.673 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 332' ' ' ILE . . . . . 0.585 HG21 ' HA ' ' A' ' 338' ' ' PHE . 96.2 mt -103.43 106.49 20.24 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.565 0 O-C-N 121.114 -0.991 . . . . 0.26 109.96 -179.576 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 333' ' ' ARG . . . . . 0.598 ' HG2' ' CE1' ' C' ' 327' ' ' TYR . 1.6 mtp180 -73.15 154.21 40.42 Favored 'General case' 0 C--N 1.303 -1.439 0 O-C-N 121.466 -0.771 . . . . 2.92 109.429 179.781 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 334' ' ' GLY . . . . . . . . . . . . . . . 79.62 129.67 0.73 Allowed Glycine 0 N--CA 1.492 2.397 0 N-CA-C 109.882 -1.287 . . . . 0.4 109.882 179.621 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 335' ' ' ARG . . . . . 0.529 ' NH1' ' HG2' ' A' ' 335' ' ' ARG . 21.6 ttt-85 -79.8 -38.24 33.46 Favored 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.355 -1.085 . . . . 3.01 109.229 179.627 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 336' ' ' GLU . . . . . . . . . . . . . 21.4 mt-10 -58.69 -59.14 5.88 Favored 'General case' 0 N--CA 1.488 1.436 0 O-C-N 121.399 -0.813 . . . . 2.29 109.59 -179.996 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 337' ' ' ARG . . . . . . . . . . . . . 2.5 mmt180 -60.17 -30.62 69.46 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.292 -0.88 . . . . 2.93 109.3 -179.981 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 338' ' ' PHE . . . . . 0.585 ' HA ' HG21 ' A' ' 332' ' ' ILE . 64.3 t80 -55.48 -58.1 9.14 Favored 'General case' 0 N--CA 1.488 1.474 0 O-C-N 121.171 -0.955 . . . . 0.38 109.278 179.826 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 339' ' ' GLU . . . . . . . . . . . . . 7.2 mt-10 -51.92 -30.95 26.58 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.139 -0.975 . . . . 1.97 109.99 -179.847 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 340' ' ' MET . . . . . . . . . . . . . 16.0 ttp -64.67 -54.4 32.34 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.166 -0.959 . . . . 0.31 109.885 -179.6 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 341' ' ' PHE . . . . . . . . . . . . . 35.7 m-85 -62.61 -52.77 62.08 Favored 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.3 -0.875 . . . . 0.18 110.024 -179.6 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 342' ' ' ARG . . . . . . . . . . . . . 12.9 ttp180 -47.93 -41.17 24.07 Favored 'General case' 0 N--CA 1.489 1.481 0 O-C-N 121.234 -0.916 . . . . 2.42 109.946 -179.576 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 343' ' ' GLU . . . . . . . . . . . . . 42.9 tt0 -59.17 -45.11 91.86 Favored 'General case' 0 N--CA 1.494 1.74 0 O-C-N 121.156 -0.965 . . . . 2.35 109.741 -179.859 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 344' ' ' LEU . . . . . 0.611 HD22 HD22 ' B' ' 344' ' ' LEU . 39.8 mt -62.81 -41.63 99.37 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.118 -0.989 . . . . 0.18 109.781 -179.864 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 345' ' ' ASN . . . . . 0.541 HD22 HD11 ' C' ' 330' ' ' LEU . 33.2 t-20 -56.16 -45.46 79.67 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.113 -0.992 . . . . 1.09 109.464 -179.826 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 346' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -60.88 -36.08 78.28 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.255 -0.903 . . . . 1.65 109.746 -179.949 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 347' ' ' ALA . . . . . 0.992 ' HB1' ' HB1' ' B' ' 347' ' ' ALA . . . -60.54 -52.32 65.7 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.164 -0.96 . . . . 0.18 110.27 -179.646 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 348' ' ' LEU . . . . . 0.59 HD22 ' N ' ' A' ' 348' ' ' LEU . 3.9 mm? -60.78 -49.74 76.28 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.196 -0.94 . . . . 0.3 109.888 -179.403 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 349' ' ' GLU . . . . . . . . . . . . . 53.3 mt-10 -57.49 -31.08 65.65 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.233 -0.917 . . . . 1.94 110.038 -179.332 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 350' ' ' LEU . . . . . 0.76 ' O ' HD23 ' A' ' 350' ' ' LEU . 4.7 tt -63.81 -41.28 97.92 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.075 -1.016 . . . . 0.46 109.054 179.92 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 351' ' ' LYS . . . . . . . . . . . . . 6.3 tttt -59.65 -44.94 93.34 Favored 'General case' 0 C--N 1.302 -1.497 0 O-C-N 121.342 -0.849 . . . . 1.4 109.647 179.94 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 352' ' ' ASP . . . . . . . . . . . . . 63.8 m-20 -54.48 -43.33 71.65 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.162 -0.962 . . . . 1.16 109.623 -179.917 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 353' ' ' ALA . . . . . . . . . . . . . . . -67.61 -28.91 68.15 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.194 -0.941 . . . . 0.63 109.599 -179.687 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 354' ' ' GLN . . . . . 0.683 ' NE2' HD11 ' B' ' 350' ' ' LEU . 0.4 OUTLIER -81.39 5.7 16.71 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.211 -0.93 . . . . 1.47 109.378 179.853 . . . . . . . . 3 3 . 1 . 031 nuclear nobuild full ' A' A ' 355' ' ' ALA . . . . . . . . . . . . . . . -69.32 -83.77 0.03 OUTLIER 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.054 -1.029 . . . . 1.01 109.622 -179.845 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 356' ' ' GLY . . . . . . . . . . . . . . . -71.73 88.1 0.45 Allowed Glycine 0 N--CA 1.491 2.351 0 N-CA-C 109.928 -1.269 . . . . 1.3 109.928 -179.744 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 357' ' ' LYS . . . . . . . . . . . . . 24.3 ttmt -88.16 141.73 28.33 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.205 -1.174 . . . . 4.1 109.491 179.63 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 358' ' ' GLU . . . . . 0.421 ' CG ' ' HD2' ' A' ' 359' ' ' PRO . 0.9 OUTLIER -51.0 167.15 0.28 Allowed Pre-proline 0 N--CA 1.49 1.555 0 O-C-N 121.299 -0.876 . . . . 5.75 109.445 -179.981 . . . . . . . . 3 3 . 1 . 031 nuclear nobuild full ' A' A ' 359' ' ' PRO . . . . . 0.421 ' HD2' ' CG ' ' A' ' 358' ' ' GLU . 2.4 Cg_endo -61.87 -75.38 0.02 OUTLIER 'Trans proline' 0 C--N 1.309 -1.54 0 C-N-CA 122.306 2.004 . . . . 5.0 110.138 179.744 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 360' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.345 0 N-CA-C 109.297 -1.521 . . . . 6.97 109.297 179.832 . . . . . . . . 0 0 . 1 . 031 nuclear nobuild full ' B' B ' 319' ' ' LYS . . . . . . . . . . . . . 5.9 mtpt . . . . . 0 N--CA 1.492 1.668 0 N-CA-C 109.449 -0.575 . . . . 7.55 109.449 . . . . . . . . . 0 0 . 1 . 031 nuclear nobuild full ' B' B ' 320' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER 63.71 138.11 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.228 -0.92 . . . . 6.44 109.56 -179.949 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' B' B ' 321' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -159.75 71.58 3.23 Favored Pre-proline 0 C--N 1.301 -1.514 0 O-C-N 121.3 -0.875 . . . . 6.13 109.141 179.701 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' B' B ' 322' ' ' PRO . . . . . . . . . . . . . 3.4 Cg_exo -61.2 128.2 24.41 Favored 'Trans proline' 0 C--N 1.308 -1.6 0 C-N-CA 122.014 1.809 . . . . 2.82 109.797 -179.59 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' B' B ' 323' ' ' LEU . . . . . . . . . . . . . 14.8 mt -78.92 123.84 27.65 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.144 -0.973 . . . . 2.84 109.676 -179.749 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' B' B ' 324' ' ' ASP . . . . . 0.528 ' CB ' ' OH ' ' B' ' 327' ' ' TYR . 13.2 m-20 -79.19 155.35 28.68 Favored 'General case' 0 C--N 1.305 -1.368 0 O-C-N 121.186 -0.946 . . . . 1.53 109.003 179.804 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' B' B ' 325' ' ' GLY . . . . . . . . . . . . . . . -70.91 -162.22 4.46 Favored Glycine 0 N--CA 1.488 2.123 0 N-CA-C 109.147 -1.581 . . . . 0.59 109.147 179.778 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' B' B ' 326' ' ' GLU . . . . . . . . . . . . . 2.6 mt-10 -58.08 -166.42 0.0 OUTLIER 'General case' 0 N--CA 1.488 1.471 0 O-C-N 121.188 -1.183 . . . . 2.13 109.314 179.949 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' B' B ' 327' ' ' TYR . . . . . 0.627 ' CE1' ' HG2' ' D' ' 333' ' ' ARG . 35.9 m-85 -148.57 112.44 5.13 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.42 -0.8 . . . . 0.48 109.671 179.74 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' B' B ' 328' ' ' PHE . . . . . 0.487 ' CE2' ' HA ' ' D' ' 335' ' ' ARG . 85.4 m-85 -114.94 -168.88 1.45 Allowed 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.429 -0.794 . . . . 0.32 109.287 179.756 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' B' B ' 329' ' ' THR . . . . . . . . . . . . . 37.9 p -153.53 158.53 41.41 Favored 'General case' 0 N--CA 1.489 1.495 0 O-C-N 121.243 -0.911 . . . . 0.23 109.262 179.989 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' B' B ' 330' ' ' LEU . . . . . . . . . . . . . 20.5 tp -151.11 129.61 12.16 Favored 'General case' 0 C--N 1.303 -1.429 0 O-C-N 121.275 -0.891 . . . . 0.28 109.628 -179.758 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' B' B ' 331' ' ' GLN . . . . . . . . . . . . . 1.4 tt0 -87.42 117.73 26.39 Favored 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.289 -0.882 . . . . 0.91 108.863 179.475 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' B' B ' 332' ' ' ILE . . . . . 0.561 HG21 ' HA ' ' B' ' 338' ' ' PHE . 95.4 mt -103.97 106.71 20.77 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.597 0 O-C-N 121.178 -0.951 . . . . 0.24 110.048 -179.724 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' B' B ' 333' ' ' ARG . . . . . 0.541 ' HG2' ' CE1' ' D' ' 327' ' ' TYR . 1.7 mtp180 -73.38 154.84 39.88 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.268 -0.895 . . . . 2.93 109.536 179.751 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' B' B ' 334' ' ' GLY . . . . . . . . . . . . . . . 77.99 128.63 0.46 Allowed Glycine 0 N--CA 1.491 2.303 0 N-CA-C 109.987 -1.245 . . . . 0.4 109.987 179.82 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' B' B ' 335' ' ' ARG . . . . . 0.538 ' HG2' ' NH1' ' B' ' 335' ' ' ARG . 23.1 ttt-85 -78.77 -38.72 37.88 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.285 -1.127 . . . . 3.01 109.293 179.787 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' B' B ' 336' ' ' GLU . . . . . . . . . . . . . 22.1 mt-10 -57.73 -59.1 5.72 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.317 -0.864 . . . . 2.28 109.563 179.935 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' B' B ' 337' ' ' ARG . . . . . . . . . . . . . 2.5 mmt180 -60.54 -30.43 69.76 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.207 -0.933 . . . . 2.93 109.34 -179.886 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' B' B ' 338' ' ' PHE . . . . . 0.561 ' HA ' HG21 ' B' ' 332' ' ' ILE . 65.8 t80 -55.52 -57.73 10.71 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.332 -0.855 . . . . 0.37 109.379 179.723 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' B' B ' 339' ' ' GLU . . . . . . . . . . . . . 7.9 mt-10 -52.38 -31.06 32.05 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.218 -0.926 . . . . 1.98 109.755 -179.848 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' B' B ' 340' ' ' MET . . . . . . . . . . . . . 17.5 ttp -64.3 -54.54 31.63 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.246 -0.909 . . . . 0.32 109.88 -179.5 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' B' B ' 341' ' ' PHE . . . . . . . . . . . . . 36.4 m-85 -62.73 -53.34 55.92 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.389 -0.819 . . . . 0.18 109.857 -179.579 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' B' B ' 342' ' ' ARG . . . . . . . . . . . . . 13.6 ttp180 -47.2 -41.37 18.04 Favored 'General case' 0 C--N 1.301 -1.511 0 O-C-N 121.274 -0.891 . . . . 2.42 109.99 -179.6 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' B' B ' 343' ' ' GLU . . . . . . . . . . . . . 41.0 tt0 -58.77 -45.61 89.37 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.013 -1.054 . . . . 2.35 109.704 -179.719 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' B' B ' 344' ' ' LEU . . . . . 0.611 HD22 HD22 ' A' ' 344' ' ' LEU . 41.1 mt -62.8 -40.93 98.86 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.237 -0.914 . . . . 0.18 110.078 -179.586 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' B' B ' 345' ' ' ASN . . . . . . . . . . . . . 33.9 t-20 -56.84 -44.99 82.64 Favored 'General case' 0 C--N 1.301 -1.522 0 O-C-N 121.242 -0.911 . . . . 1.09 109.449 -179.877 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' B' B ' 346' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -61.36 -35.43 77.43 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.191 -0.943 . . . . 1.66 109.73 -179.924 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' B' B ' 347' ' ' ALA . . . . . 0.992 ' HB1' ' HB1' ' A' ' 347' ' ' ALA . . . -61.3 -51.98 66.6 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.24 -0.913 . . . . 0.17 110.078 -179.48 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' B' B ' 348' ' ' LEU . . . . . 0.604 HD22 ' N ' ' B' ' 348' ' ' LEU . 3.9 mm? -61.0 -49.62 76.69 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.085 -1.009 . . . . 0.29 109.933 -179.494 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' B' B ' 349' ' ' GLU . . . . . . . . . . . . . 53.7 mt-10 -57.7 -31.61 66.56 Favored 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.243 -0.91 . . . . 1.95 109.897 -179.335 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' B' B ' 350' ' ' LEU . . . . . 0.765 ' O ' HD23 ' B' ' 350' ' ' LEU . 4.7 tt -62.98 -41.88 99.68 Favored 'General case' 0 N--CA 1.488 1.474 0 O-C-N 120.981 -1.074 . . . . 0.45 109.108 179.857 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' B' B ' 351' ' ' LYS . . . . . . . . . . . . . 6.3 tttt -59.0 -44.67 91.7 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.311 -0.868 . . . . 1.38 109.715 179.908 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' B' B ' 352' ' ' ASP . . . . . . . . . . . . . 65.4 m-20 -54.74 -43.59 72.82 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.195 -0.941 . . . . 1.16 109.776 -179.695 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' B' B ' 353' ' ' ALA . . . . . . . . . . . . . . . -67.49 -28.86 68.19 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.216 -0.927 . . . . 0.61 109.366 -179.955 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' B' B ' 354' ' ' GLN . . . . . 0.759 ' NE2' HD11 ' A' ' 350' ' ' LEU . 0.4 OUTLIER -80.8 4.46 19.03 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.287 -0.883 . . . . 1.45 109.661 179.862 . . . . . . . . 3 3 . 1 . 031 nuclear nobuild full ' B' B ' 355' ' ' ALA . . . . . . . . . . . . . . . -68.59 -85.31 0.02 OUTLIER 'General case' 0 N--CA 1.487 1.416 0 O-C-N 121.177 -0.952 . . . . 0.98 109.44 -179.924 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' B' B ' 356' ' ' GLY . . . . . . . . . . . . . . . -70.06 87.9 0.31 Allowed Glycine 0 N--CA 1.492 2.427 0 N-CA-C 110.177 -1.169 . . . . 1.29 110.177 -179.668 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' B' B ' 357' ' ' LYS . . . . . . . . . . . . . 24.3 ttmt -88.3 140.72 29.19 Favored 'General case' 0 N--CA 1.493 1.692 0 O-C-N 121.169 -1.195 . . . . 4.09 109.625 179.627 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' B' B ' 358' ' ' GLU . . . . . 0.413 ' CB ' ' HD2' ' B' ' 359' ' ' PRO . 1.1 mt-10 -49.98 167.15 0.25 Allowed Pre-proline 0 N--CA 1.492 1.674 0 O-C-N 121.188 -0.945 . . . . 5.72 109.341 179.753 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' B' B ' 359' ' ' PRO . . . . . 0.413 ' HD2' ' CB ' ' B' ' 358' ' ' GLU . 2.5 Cg_endo -61.94 -73.33 0.02 OUTLIER 'Trans proline' 0 C--N 1.308 -1.572 0 C-N-CA 122.572 2.182 . . . . 4.98 110.25 179.919 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' B' B ' 360' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.233 0 CA-C-O 117.978 -1.456 . . . . 6.98 109.509 179.99 . . . . . . . . 0 0 . 1 . 031 nuclear nobuild full ' C' C ' 319' ' ' LYS . . . . . 0.416 ' O ' ' HB2' ' C' ' 320' ' ' LYS . 0.1 OUTLIER . . . . . 0 N--CA 1.491 1.581 0 CA-C-O 121.284 0.564 . . . . 6.82 109.552 . . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' C' C ' 320' ' ' LYS . . . . . 0.434 ' HD3' ' HA ' ' C' ' 320' ' ' LYS . 38.2 mmtt 59.91 54.01 4.46 Favored 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.376 -0.828 . . . . 6.49 109.404 179.816 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' C' C ' 321' ' ' LYS . . . . . 0.425 ' O ' ' OD1' ' C' ' 324' ' ' ASP . 17.0 mttt -82.15 116.63 64.65 Favored Pre-proline 0 N--CA 1.492 1.653 0 O-C-N 121.283 -0.886 . . . . 6.4 109.453 -179.944 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' C' C ' 322' ' ' PRO . . . . . . . . . . . . . 2.5 Cg_endo -68.38 -3.74 11.53 Favored 'Trans proline' 0 C--N 1.313 -1.323 0 C-N-CA 121.932 1.754 . . . . 3.42 110.586 -179.88 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' C' C ' 323' ' ' LEU . . . . . . . . . . . . . 33.3 mt -85.06 55.34 3.45 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.146 -0.971 . . . . 3.95 109.659 -179.991 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' C' C ' 324' ' ' ASP . . . . . 0.477 ' CB ' ' OH ' ' C' ' 327' ' ' TYR . 8.2 m-20 -82.05 139.09 34.67 Favored 'General case' 0 N--CA 1.489 1.479 0 O-C-N 121.117 -0.989 . . . . 1.63 109.492 -179.931 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' C' C ' 325' ' ' GLY . . . . . . . . . . . . . . . -68.59 -161.97 2.36 Favored Glycine 0 N--CA 1.489 2.18 0 N-CA-C 109.117 -1.593 . . . . 0.73 109.117 179.699 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' C' C ' 326' ' ' GLU . . . . . . . . . . . . . 1.9 mm-40 -58.21 -168.69 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.282 -1.128 . . . . 2.17 109.432 -179.962 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' C' C ' 327' ' ' TYR . . . . . 0.598 ' CE1' ' HG2' ' A' ' 333' ' ' ARG . 32.7 m-85 -148.2 101.34 3.26 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.193 -0.942 . . . . 0.48 109.629 179.864 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' C' C ' 328' ' ' PHE . . . . . 0.432 ' O ' HG23 ' C' ' 329' ' ' THR . 92.8 m-85 -108.17 -164.37 0.95 Allowed 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.258 -0.901 . . . . 0.33 109.414 179.878 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' C' C ' 329' ' ' THR . . . . . 0.432 HG23 ' O ' ' C' ' 328' ' ' PHE . 3.0 p -154.19 157.5 38.92 Favored 'General case' 0 C--N 1.303 -1.426 0 O-C-N 121.405 -0.809 . . . . 0.23 109.039 -179.968 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' C' C ' 330' ' ' LEU . . . . . 0.541 HD11 HD22 ' A' ' 345' ' ' ASN . 19.8 tp -148.38 127.27 12.68 Favored 'General case' 0 N--CA 1.489 1.48 0 O-C-N 121.234 -0.916 . . . . 0.28 109.687 -179.735 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' C' C ' 331' ' ' GLN . . . . . . . . . . . . . 1.1 tt0 -86.82 120.06 27.7 Favored 'General case' 0 N--CA 1.487 1.41 0 N-CA-C 108.587 -0.894 . . . . 1.48 108.587 179.286 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' C' C ' 332' ' ' ILE . . . . . 0.668 HG21 ' HA ' ' C' ' 338' ' ' PHE . 15.0 mt -102.84 103.11 14.58 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.588 0 O-C-N 121.178 -0.951 . . . . 0.24 109.845 -179.405 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' C' C ' 333' ' ' ARG . . . . . 0.483 ' HG2' ' CE1' ' A' ' 327' ' ' TYR . 1.6 mtt-85 -73.49 126.25 29.79 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.44 -0.787 . . . . 2.74 109.47 179.812 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' C' C ' 334' ' ' GLY . . . . . . . . . . . . . . . 104.68 125.76 5.65 Favored Glycine 0 N--CA 1.49 2.243 0 N-CA-C 109.473 -1.451 . . . . 0.35 109.473 -179.889 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' C' C ' 335' ' ' ARG . . . . . 0.469 ' O ' ' HB3' ' C' ' 338' ' ' PHE . 2.6 ttm180 -78.65 -36.21 44.21 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.305 -1.115 . . . . 2.53 109.612 -179.69 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' C' C ' 336' ' ' GLU . . . . . . . . . . . . . 3.0 mm-40 -58.57 -63.31 1.33 Allowed 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.182 -0.949 . . . . 2.62 109.598 -179.802 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' C' C ' 337' ' ' ARG . . . . . . . . . . . . . 14.9 mmt180 -59.12 -27.79 65.93 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.265 -0.897 . . . . 2.81 109.615 -179.995 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' C' C ' 338' ' ' PHE . . . . . 0.668 ' HA ' HG21 ' C' ' 332' ' ' ILE . 59.8 t80 -55.34 -58.28 8.39 Favored 'General case' 0 N--CA 1.489 1.489 0 O-C-N 121.25 -0.906 . . . . 0.4 109.731 179.969 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' C' C ' 339' ' ' GLU . . . . . . . . . . . . . 17.9 mt-10 -50.52 -32.95 19.76 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.097 -1.002 . . . . 2.05 110.087 -179.544 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' C' C ' 340' ' ' MET . . . . . . . . . . . . . 35.0 ttp -64.19 -55.27 22.89 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.13 -0.981 . . . . 0.32 110.116 -179.496 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' C' C ' 341' ' ' PHE . . . . . . . . . . . . . 49.6 m-85 -60.93 -53.64 54.79 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.126 -0.984 . . . . 0.18 109.999 -179.486 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' C' C ' 342' ' ' ARG . . . . . . . . . . . . . 16.6 ttt180 -46.98 -38.47 10.76 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.088 -1.008 . . . . 2.91 109.805 -179.581 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' C' C ' 343' ' ' GLU . . . . . . . . . . . . . 31.4 tt0 -60.18 -47.35 86.3 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.165 -0.96 . . . . 2.14 109.848 -179.858 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' C' C ' 344' ' ' LEU . . . . . 0.478 HD22 HD22 ' D' ' 344' ' ' LEU . 36.0 mt -62.55 -35.48 79.6 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.146 -0.971 . . . . 0.22 109.925 -179.507 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' C' C ' 345' ' ' ASN . . . . . 0.583 HD22 HD11 ' A' ' 330' ' ' LEU . 54.8 t-20 -56.37 -48.83 76.03 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.062 -1.024 . . . . 1.08 109.371 -179.991 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' C' C ' 346' ' ' GLU . . . . . . . . . . . . . 2.1 tp10 -62.47 -32.76 73.7 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.253 -0.904 . . . . 2.21 109.734 179.945 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' C' C ' 347' ' ' ALA . . . . . 0.977 ' HB1' ' HB1' ' D' ' 347' ' ' ALA . . . -62.11 -55.96 23.62 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.205 -0.935 . . . . 0.18 110.083 -179.718 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' C' C ' 348' ' ' LEU . . . . . 0.59 HD22 ' N ' ' C' ' 348' ' ' LEU . 3.9 mm? -60.97 -49.56 76.94 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.218 -0.926 . . . . 0.32 109.832 -179.403 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' C' C ' 349' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -56.43 -33.47 65.87 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.127 -0.983 . . . . 2.19 109.373 -179.704 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' C' C ' 350' ' ' LEU . . . . . 1.009 HD22 HD13 ' D' ' 350' ' ' LEU . 6.4 tt -62.53 -43.35 99.03 Favored 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.337 -0.852 . . . . 0.46 109.092 179.759 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' C' C ' 351' ' ' LYS . . . . . . . . . . . . . 36.3 tttt -58.15 -41.84 84.64 Favored 'General case' 0 C--N 1.301 -1.514 0 O-C-N 121.377 -0.827 . . . . 1.35 109.045 179.742 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' C' C ' 352' ' ' ASP . . . . . . . . . . . . . 50.5 m-20 -56.39 -49.2 75.16 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.241 -0.912 . . . . 1.19 109.455 179.668 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' C' C ' 353' ' ' ALA . . . . . . . . . . . . . . . -68.6 -19.1 64.43 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.434 -0.791 . . . . 0.57 109.303 179.943 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' C' C ' 354' ' ' GLN . . . . . 0.493 ' HG3' ' CE ' ' C' ' 357' ' ' LYS . 12.3 tt0 -82.58 -1.96 52.32 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.304 -0.873 . . . . 1.47 109.71 179.972 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' C' C ' 355' ' ' ALA . . . . . . . . . . . . . . . -71.16 -80.67 0.06 Allowed 'General case' 0 N--CA 1.489 1.491 0 O-C-N 121.104 -0.997 . . . . 0.93 109.702 -179.962 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' C' C ' 356' ' ' GLY . . . . . . . . . . . . . . . -80.9 33.96 2.37 Favored Glycine 0 N--CA 1.493 2.458 0 C-N-CA 120.23 -0.986 . . . . 1.33 110.883 -179.516 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' C' C ' 357' ' ' LYS . . . . . 0.493 ' CE ' ' HG3' ' C' ' 354' ' ' GLN . 15.4 pttp -86.47 167.72 14.4 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 120.779 -1.424 . . . . 4.01 109.385 179.513 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' C' C ' 358' ' ' GLU . . . . . . . . . . . . . 7.8 pt-20 -51.14 146.1 11.71 Favored Pre-proline 0 N--CA 1.488 1.439 0 O-C-N 121.175 -0.953 . . . . 5.75 109.556 179.955 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' C' C ' 359' ' ' PRO . . . . . . . . . . . . . 1.6 Cg_endo -63.25 124.98 14.79 Favored 'Trans proline' 0 C--N 1.311 -1.414 0 C-N-CA 122.174 1.916 . . . . 4.94 110.179 179.965 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' C' C ' 360' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.349 0 CA-C-O 117.97 -1.461 . . . . 6.5 109.635 179.894 . . . . . . . . 0 0 . 1 . 031 nuclear nobuild full ' D' D ' 319' ' ' LYS . . . . . 0.406 ' O ' ' O ' ' D' ' 320' ' ' LYS . 5.8 mtpt . . . . . 0 N--CA 1.491 1.599 0 CA-C-O 121.303 0.573 . . . . 7.53 109.921 . . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' D' D ' 320' ' ' LYS . . . . . 0.406 ' O ' ' O ' ' D' ' 319' ' ' LYS . 0.2 OUTLIER 63.08 139.51 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.279 -0.888 . . . . 6.41 109.453 -179.828 . . . . . . . . 3 3 . 1 . 031 nuclear nobuild full ' D' D ' 321' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -160.32 71.32 2.99 Favored Pre-proline 0 C--N 1.302 -1.479 0 O-C-N 121.192 -0.942 . . . . 6.11 108.883 179.646 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' D' D ' 322' ' ' PRO . . . . . . . . . . . . . 3.5 Cg_exo -60.88 128.16 24.64 Favored 'Trans proline' 0 C--N 1.309 -1.515 0 C-N-CA 121.997 1.798 . . . . 2.82 110.036 -179.697 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' D' D ' 323' ' ' LEU . . . . . . . . . . . . . 14.1 mt -78.72 124.24 27.99 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.229 -0.919 . . . . 2.83 109.556 -179.519 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' D' D ' 324' ' ' ASP . . . . . 0.519 ' CB ' ' OH ' ' D' ' 327' ' ' TYR . 14.3 m-20 -79.43 155.22 28.43 Favored 'General case' 0 N--CA 1.488 1.473 0 O-C-N 121.195 -0.941 . . . . 1.54 109.028 179.667 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' D' D ' 325' ' ' GLY . . . . . . . . . . . . . . . -70.26 -162.07 3.8 Favored Glycine 0 N--CA 1.489 2.172 0 N-CA-C 109.095 -1.602 . . . . 0.59 109.095 179.705 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' D' D ' 326' ' ' GLU . . . . . . . . . . . . . 2.6 mt-10 -58.64 -166.57 0.01 OUTLIER 'General case' 0 N--CA 1.488 1.468 0 O-C-N 121.225 -1.162 . . . . 2.13 109.074 179.719 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' D' D ' 327' ' ' TYR . . . . . 0.541 ' CE1' ' HG2' ' B' ' 333' ' ' ARG . 34.8 m-85 -148.65 111.58 4.85 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.199 -0.938 . . . . 0.47 109.814 179.866 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' D' D ' 328' ' ' PHE . . . . . . . . . . . . . 85.6 m-85 -113.88 -168.4 1.34 Allowed 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.394 -0.816 . . . . 0.3 109.372 179.796 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' D' D ' 329' ' ' THR . . . . . . . . . . . . . 35.5 p -153.9 157.79 39.76 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.169 -0.957 . . . . 0.22 109.132 -179.771 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' D' D ' 330' ' ' LEU . . . . . . . . . . . . . 18.3 tp -150.81 129.44 12.27 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.216 -0.928 . . . . 0.28 109.864 -179.767 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' D' D ' 331' ' ' GLN . . . . . . . . . . . . . 1.7 tt0 -87.43 116.63 25.67 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.218 -0.926 . . . . 0.93 109.27 179.702 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' D' D ' 332' ' ' ILE . . . . . 0.584 HG21 ' HA ' ' D' ' 338' ' ' PHE . 95.0 mt -102.85 106.2 19.59 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.528 0 O-C-N 121.25 -0.906 . . . . 0.25 110.132 -179.572 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' D' D ' 333' ' ' ARG . . . . . 0.627 ' HG2' ' CE1' ' B' ' 327' ' ' TYR . 1.8 mtp180 -72.95 155.25 40.05 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.375 -0.828 . . . . 2.93 109.553 179.614 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' D' D ' 334' ' ' GLY . . . . . . . . . . . . . . . 78.09 128.91 0.48 Allowed Glycine 0 N--CA 1.491 2.337 0 N-CA-C 109.847 -1.301 . . . . 0.41 109.847 179.643 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' D' D ' 335' ' ' ARG . . . . . 0.521 ' HG2' ' NH1' ' D' ' 335' ' ' ARG . 22.0 ttt-85 -79.68 -37.72 35.17 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.246 -1.149 . . . . 3.03 109.235 179.734 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' D' D ' 336' ' ' GLU . . . . . . . . . . . . . 23.6 mt-10 -58.49 -59.54 5.21 Favored 'General case' 0 C--N 1.304 -1.383 0 O-C-N 121.261 -0.899 . . . . 2.26 109.483 179.922 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' D' D ' 337' ' ' ARG . . . . . . . . . . . . . 2.0 mmt180 -60.02 -30.18 68.99 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.313 -0.867 . . . . 2.92 109.438 -179.947 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' D' D ' 338' ' ' PHE . . . . . 0.584 ' HA ' HG21 ' D' ' 332' ' ' ILE . 65.6 t80 -55.37 -58.37 8.01 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.278 -0.889 . . . . 0.37 109.376 179.855 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' D' D ' 339' ' ' GLU . . . . . . . . . . . . . 8.0 mt-10 -51.9 -31.2 27.32 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.27 -0.894 . . . . 1.99 109.7 -179.939 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' D' D ' 340' ' ' MET . . . . . . . . . . . . . 17.6 ttp -64.21 -54.27 36.12 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.019 -1.051 . . . . 0.31 109.915 -179.627 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' D' D ' 341' ' ' PHE . . . . . . . . . . . . . 36.3 m-85 -62.72 -53.19 58.16 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.222 -0.924 . . . . 0.18 109.984 -179.539 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' D' D ' 342' ' ' ARG . . . . . . . . . . . . . 13.6 ttp180 -47.86 -40.29 21.07 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.357 -0.84 . . . . 2.41 109.943 -179.593 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' D' D ' 343' ' ' GLU . . . . . . . . . . . . . 40.2 tt0 -59.67 -45.4 92.17 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.042 -1.037 . . . . 2.35 109.723 -179.699 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' D' D ' 344' ' ' LEU . . . . . 0.478 HD22 HD22 ' C' ' 344' ' ' LEU . 41.9 mt -63.0 -40.76 98.74 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.27 -0.894 . . . . 0.19 109.998 -179.678 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' D' D ' 345' ' ' ASN . . . . . . . . . . . . . 33.5 t-20 -56.7 -44.93 82.03 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.34 -0.85 . . . . 1.09 109.454 -179.699 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' D' D ' 346' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -61.72 -35.86 79.26 Favored 'General case' 0 C--N 1.303 -1.447 0 O-C-N 121.476 -0.765 . . . . 1.69 109.746 -179.809 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' D' D ' 347' ' ' ALA . . . . . 0.977 ' HB1' ' HB1' ' C' ' 347' ' ' ALA . . . -60.58 -51.82 67.79 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.289 -0.882 . . . . 0.18 110.203 -179.614 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' D' D ' 348' ' ' LEU . . . . . 0.592 HD22 ' N ' ' D' ' 348' ' ' LEU . 3.9 mm? -61.16 -49.87 75.49 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.077 -1.014 . . . . 0.31 109.818 -179.315 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' D' D ' 349' ' ' GLU . . . . . . . . . . . . . 55.6 mt-10 -57.45 -31.29 65.77 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.168 -0.957 . . . . 1.95 110.062 -179.368 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' D' D ' 350' ' ' LEU . . . . . 1.009 HD13 HD22 ' C' ' 350' ' ' LEU . 4.7 tt -63.47 -41.47 98.6 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 120.972 -1.08 . . . . 0.43 109.11 179.83 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' D' D ' 351' ' ' LYS . . . . . . . . . . . . . 6.7 tttt -59.6 -44.29 93.43 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.377 -0.827 . . . . 1.4 109.517 -179.992 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' D' D ' 352' ' ' ASP . . . . . . . . . . . . . 66.6 m-20 -54.93 -43.5 73.4 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.201 -0.937 . . . . 1.17 109.747 -179.859 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' D' D ' 353' ' ' ALA . . . . . . . . . . . . . . . -67.87 -28.2 67.33 Favored 'General case' 0 N--CA 1.489 1.488 0 O-C-N 121.215 -0.928 . . . . 0.59 109.703 -179.739 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' D' D ' 354' ' ' GLN . . . . . 0.525 ' NE2' HD11 ' C' ' 350' ' ' LEU . 0.3 OUTLIER -81.32 4.69 19.73 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.41 -0.806 . . . . 1.44 109.515 179.883 . . . . . . . . 3 3 . 1 . 031 nuclear nobuild full ' D' D ' 355' ' ' ALA . . . . . . . . . . . . . . . -68.58 -84.1 0.03 OUTLIER 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.204 -0.935 . . . . 0.98 109.89 -179.813 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' D' D ' 356' ' ' GLY . . . . . . . . . . . . . . . -71.69 87.84 0.45 Allowed Glycine 0 N--CA 1.491 2.362 0 N-CA-C 109.637 -1.385 . . . . 1.28 109.637 -179.601 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' D' D ' 357' ' ' LYS . . . . . . . . . . . . . 24.7 ttmt -88.1 141.67 28.38 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.225 -1.162 . . . . 4.09 109.472 179.778 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' D' D ' 358' ' ' GLU . . . . . 0.42 ' CB ' ' HD2' ' D' ' 359' ' ' PRO . 1.1 mt-10 -50.74 167.57 0.26 Allowed Pre-proline 0 N--CA 1.493 1.677 0 O-C-N 121.099 -1.001 . . . . 5.71 109.199 179.87 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' D' D ' 359' ' ' PRO . . . . . 0.42 ' HD2' ' CB ' ' D' ' 358' ' ' GLU . 3.0 Cg_endo -62.24 -72.33 0.02 OUTLIER 'Trans proline' 0 C--N 1.311 -1.409 0 C-N-CA 122.62 2.213 . . . . 4.97 110.174 -179.944 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' D' D ' 360' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.488 2.144 0 N-CA-C 109.458 -1.457 . . . . 6.97 109.458 -179.837 . . . . . . . . 0 0 . 1 . 032 nuclear nobuild full ' A' A ' 319' ' ' LYS . . . . . 0.46 ' O ' ' O ' ' A' ' 320' ' ' LYS . 3.8 mtpt . . . . . 0 N--CA 1.49 1.536 0 N-CA-C 109.535 -0.543 . . . . 7.55 109.535 . . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 320' ' ' LYS . . . . . 0.46 ' O ' ' O ' ' A' ' 319' ' ' LYS . 2.2 mtmt 61.13 138.52 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.335 -0.853 . . . . 6.43 109.567 179.985 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 321' ' ' LYS . . . . . . . . . . . . . 19.4 mttt -159.08 110.96 1.56 Allowed Pre-proline 0 N--CA 1.49 1.55 0 O-C-N 121.262 -0.899 . . . . 6.13 109.459 -179.861 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 322' ' ' PRO . . . . . . . . . . . . . 3.7 Cg_exo -59.89 -158.92 0.02 OUTLIER 'Trans proline' 0 C--N 1.313 -1.335 0 C-N-CA 121.853 1.702 . . . . 2.83 110.072 179.799 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 323' ' ' LEU . . . . . . . . . . . . . 48.1 mt -80.38 127.28 32.21 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.251 -0.906 . . . . 2.83 109.331 179.958 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 324' ' ' ASP . . . . . . . . . . . . . 13.4 m-20 -78.61 164.45 24.63 Favored 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.228 -0.92 . . . . 1.53 109.395 -179.903 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 325' ' ' GLY . . . . . . . . . . . . . . . -67.53 178.8 17.76 Favored Glycine 0 N--CA 1.488 2.135 0 N-CA-C 109.278 -1.529 . . . . 0.61 109.278 179.97 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 326' ' ' GLU . . . . . 0.431 ' HB2' ' CE1' ' A' ' 328' ' ' PHE . 44.9 mt-10 -57.21 -168.08 0.0 OUTLIER 'General case' 0 N--CA 1.489 1.49 0 O-C-N 121.157 -1.202 . . . . 2.13 109.369 -179.838 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 327' ' ' TYR . . . . . . . . . . . . . 44.6 m-85 -149.49 109.27 4.05 Favored 'General case' 0 N--CA 1.488 1.452 0 O-C-N 121.337 -0.852 . . . . 0.48 109.267 179.993 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 328' ' ' PHE . . . . . 0.431 ' CE1' ' HB2' ' A' ' 326' ' ' GLU . 41.7 m-85 -113.58 -169.16 1.45 Allowed 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.288 -0.882 . . . . 0.31 109.473 -179.809 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 329' ' ' THR . . . . . 0.427 HG23 ' O ' ' A' ' 328' ' ' PHE . 6.4 p -153.6 168.39 26.34 Favored 'General case' 0 N--CA 1.488 1.456 0 O-C-N 121.294 -0.879 . . . . 0.22 109.216 -179.948 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 330' ' ' LEU . . . . . . . . . . . . . 20.6 tp -150.19 129.03 12.47 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.171 -0.956 . . . . 0.28 109.704 -179.783 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 331' ' ' GLN . . . . . . . . . . . . . 1.2 tp60 -87.7 113.35 23.29 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.441 -0.787 . . . . 0.91 109.393 179.739 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 332' ' ' ILE . . . . . 0.936 HG21 ' HA ' ' A' ' 338' ' ' PHE . 76.2 mt -103.57 105.06 17.66 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.573 0 O-C-N 121.193 -0.942 . . . . 0.26 109.431 -179.975 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 333' ' ' ARG . . . . . 0.457 ' NH1' ' HG2' ' A' ' 333' ' ' ARG . 0.0 OUTLIER -71.75 150.71 44.2 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.264 -0.898 . . . . 2.92 109.284 179.822 . . . . . . . . 3 3 . 1 . 032 nuclear nobuild full ' A' A ' 334' ' ' GLY . . . . . . . . . . . . . . . 76.43 126.73 0.25 Allowed Glycine 0 N--CA 1.49 2.267 0 N-CA-C 109.473 -1.451 . . . . 0.4 109.473 -179.982 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 335' ' ' ARG . . . . . 0.463 ' HB2' ' OE1' ' C' ' 326' ' ' GLU . 0.4 OUTLIER -74.02 -32.84 63.54 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.264 -1.139 . . . . 3.01 109.681 -179.879 . . . . . . . . 3 3 . 1 . 032 nuclear nobuild full ' A' A ' 336' ' ' GLU . . . . . . . . . . . . . 3.1 mt-10 -58.05 -61.5 2.5 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.282 -0.886 . . . . 2.29 109.796 -179.763 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 337' ' ' ARG . . . . . . . . . . . . . 22.4 mmm180 -59.78 -33.69 72.02 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.194 -0.941 . . . . 2.93 109.633 -179.704 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 338' ' ' PHE . . . . . 0.936 ' HA ' HG21 ' A' ' 332' ' ' ILE . 59.5 t80 -55.89 -55.12 36.37 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.159 -0.963 . . . . 0.38 109.964 -179.75 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 339' ' ' GLU . . . . . . . . . . . . . 45.4 mt-10 -50.86 -33.92 25.88 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.237 -0.914 . . . . 1.97 110.369 -179.354 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 340' ' ' MET . . . . . . . . . . . . . 24.2 ttp -64.08 -51.7 62.8 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 120.976 -1.077 . . . . 0.31 110.081 -179.457 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 341' ' ' PHE . . . . . . . . . . . . . 45.2 m-85 -61.98 -45.18 94.76 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.137 -0.977 . . . . 0.18 110.017 -179.437 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 342' ' ' ARG . . . . . 0.418 ' O ' ' HB3' ' A' ' 345' ' ' ASN . 40.5 ttt180 -50.77 -40.39 54.84 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.144 -0.973 . . . . 2.42 109.817 -179.75 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 343' ' ' GLU . . . . . . . . . . . . . 35.5 tp10 -58.43 -51.53 69.46 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.095 -1.003 . . . . 2.35 109.766 -179.624 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 344' ' ' LEU . . . . . 0.618 HD22 HD22 ' B' ' 344' ' ' LEU . 84.6 mt -61.08 -32.0 71.65 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.239 -0.913 . . . . 0.18 109.338 -179.895 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 345' ' ' ASN . . . . . 0.418 ' HB3' ' O ' ' A' ' 342' ' ' ARG . 8.7 t-20 -58.67 -55.0 40.7 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.254 -0.904 . . . . 1.09 109.325 179.861 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 346' ' ' GLU . . . . . . . . . . . . . 32.4 tp10 -61.62 -32.1 72.22 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.382 -0.824 . . . . 1.65 109.843 -179.736 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 347' ' ' ALA . . . . . 0.701 ' HB1' ' HB1' ' B' ' 347' ' ' ALA . . . -59.5 -57.04 14.69 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.187 -0.945 . . . . 0.18 109.787 -179.738 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 348' ' ' LEU . . . . . 0.555 HD22 ' N ' ' A' ' 348' ' ' LEU . 3.5 mm? -61.82 -38.73 89.25 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.171 -0.956 . . . . 0.3 109.645 -179.675 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 349' ' ' GLU . . . . . . . . . . . . . 1.8 mt-10 -58.86 -38.39 78.66 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.306 -0.871 . . . . 1.94 110.168 -179.443 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 350' ' ' LEU . . . . . 0.515 HD13 HD22 ' B' ' 350' ' ' LEU . 7.8 tt -63.76 -43.67 95.73 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.179 -0.951 . . . . 0.46 109.87 -179.576 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 351' ' ' LYS . . . . . . . . . . . . . 18.8 tttm -58.34 -42.02 85.94 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.311 -0.868 . . . . 1.4 109.549 -179.774 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 352' ' ' ASP . . . . . . . . . . . . . 48.0 m-20 -56.2 -41.52 75.72 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.252 -0.905 . . . . 1.16 109.522 -179.983 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 353' ' ' ALA . . . . . 0.402 ' O ' ' HB2' ' A' ' 357' ' ' LYS . . . -67.97 -25.54 65.48 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.229 -0.92 . . . . 0.63 109.434 -179.936 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 354' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -81.48 -1.19 45.06 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.261 -0.9 . . . . 1.47 109.508 179.968 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 355' ' ' ALA . . . . . . . . . . . . . . . -69.31 -87.77 0.02 OUTLIER 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.233 -0.917 . . . . 1.01 109.47 179.979 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 356' ' ' GLY . . . . . . . . . . . . . . . -81.67 41.17 2.67 Favored Glycine 0 N--CA 1.493 2.442 0 N-CA-C 110.358 -1.097 . . . . 1.3 110.358 -179.882 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 357' ' ' LYS . . . . . 0.402 ' HB2' ' O ' ' A' ' 353' ' ' ALA . 24.8 tttp -87.69 97.31 10.81 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 120.894 -1.356 . . . . 4.1 109.491 179.902 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 358' ' ' GLU . . . . . 0.581 ' N ' ' HD2' ' A' ' 359' ' ' PRO . 2.7 mt-10 -50.69 -53.52 45.7 Favored Pre-proline 0 N--CA 1.489 1.514 0 O-C-N 121.391 -0.818 . . . . 5.75 109.995 179.993 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 359' ' ' PRO . . . . . 0.581 ' HD2' ' N ' ' A' ' 358' ' ' GLU . 3.6 Cg_exo -61.6 131.69 36.92 Favored 'Trans proline' 0 C--N 1.311 -1.414 0 C-N-CA 121.974 1.783 . . . . 5.0 110.269 -179.656 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 360' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.312 0 CA-C-O 117.993 -1.448 . . . . 6.97 109.561 -179.992 . . . . . . . . 0 0 . 1 . 032 nuclear nobuild full ' B' B ' 319' ' ' LYS . . . . . 0.463 ' O ' ' O ' ' B' ' 320' ' ' LYS . 4.2 mtpt . . . . . 0 N--CA 1.491 1.593 0 CA-C-O 121.288 0.566 . . . . 7.55 109.489 . . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' B' B ' 320' ' ' LYS . . . . . 0.463 ' O ' ' O ' ' B' ' 319' ' ' LYS . 2.2 mtmt 61.14 138.52 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.238 -0.914 . . . . 6.44 109.51 179.96 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' B' B ' 321' ' ' LYS . . . . . . . . . . . . . 19.4 mttt -159.03 111.1 1.57 Allowed Pre-proline 0 N--CA 1.49 1.534 0 O-C-N 121.253 -0.905 . . . . 6.13 109.485 -179.918 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' B' B ' 322' ' ' PRO . . . . . . . . . . . . . 3.4 Cg_exo -59.94 -158.76 0.02 OUTLIER 'Trans proline' 0 C--N 1.312 -1.375 0 C-N-CA 121.881 1.72 . . . . 2.82 110.164 179.776 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' B' B ' 323' ' ' LEU . . . . . . . . . . . . . 48.4 mt -80.59 127.25 32.24 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.212 -0.93 . . . . 2.84 109.409 179.918 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' B' B ' 324' ' ' ASP . . . . . . . . . . . . . 13.4 m-20 -78.91 163.25 25.42 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.205 -0.934 . . . . 1.53 109.557 -179.882 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' B' B ' 325' ' ' GLY . . . . . . . . . . . . . . . -65.67 178.77 11.02 Favored Glycine 0 N--CA 1.489 2.216 0 N-CA-C 109.334 -1.507 . . . . 0.59 109.334 179.925 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' B' B ' 326' ' ' GLU . . . . . 0.44 ' HB2' ' CE1' ' B' ' 328' ' ' PHE . 45.0 mt-10 -57.52 -167.78 0.0 OUTLIER 'General case' 0 N--CA 1.488 1.462 0 O-C-N 121.204 -1.174 . . . . 2.13 109.348 179.933 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' B' B ' 327' ' ' TYR . . . . . . . . . . . . . 44.6 m-85 -149.6 109.22 4.02 Favored 'General case' 0 N--CA 1.488 1.447 0 O-C-N 121.259 -0.901 . . . . 0.48 109.291 179.914 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' B' B ' 328' ' ' PHE . . . . . 0.44 ' CE1' ' HB2' ' B' ' 326' ' ' GLU . 40.8 m-85 -113.63 -169.23 1.47 Allowed 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.255 -0.903 . . . . 0.32 109.496 -179.772 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' B' B ' 329' ' ' THR . . . . . 0.433 HG23 ' O ' ' B' ' 328' ' ' PHE . 6.4 p -153.52 168.64 25.46 Favored 'General case' 0 N--CA 1.488 1.458 0 O-C-N 121.247 -0.908 . . . . 0.23 109.267 -179.989 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' B' B ' 330' ' ' LEU . . . . . 0.477 HD21 HD22 ' D' ' 345' ' ' ASN . 20.0 tp -150.26 129.15 12.51 Favored 'General case' 0 N--CA 1.489 1.487 0 O-C-N 121.18 -0.95 . . . . 0.28 109.759 -179.88 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' B' B ' 331' ' ' GLN . . . . . . . . . . . . . 1.2 tp60 -87.83 113.27 23.33 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.355 -0.841 . . . . 0.91 109.383 179.739 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' B' B ' 332' ' ' ILE . . . . . 0.918 HG21 ' HA ' ' B' ' 338' ' ' PHE . 76.0 mt -103.59 105.01 17.57 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.554 0 O-C-N 121.29 -0.881 . . . . 0.24 109.444 -179.948 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' B' B ' 333' ' ' ARG . . . . . 0.459 ' HG2' ' NH1' ' B' ' 333' ' ' ARG . 0.0 OUTLIER -71.51 150.71 44.56 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.178 -0.952 . . . . 2.93 109.359 179.802 . . . . . . . . 3 3 . 1 . 032 nuclear nobuild full ' B' B ' 334' ' ' GLY . . . . . . . . . . . . . . . 76.24 126.78 0.24 Allowed Glycine 0 N--CA 1.49 2.276 0 N-CA-C 109.553 -1.419 . . . . 0.4 109.553 -179.933 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' B' B ' 335' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -74.04 -32.9 63.53 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.25 -1.147 . . . . 3.01 109.654 -179.855 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' B' B ' 336' ' ' GLU . . . . . . . . . . . . . 3.1 mt-10 -57.96 -61.42 2.55 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.132 -0.98 . . . . 2.28 109.781 -179.723 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' B' B ' 337' ' ' ARG . . . . . . . . . . . . . 22.2 mmm180 -59.94 -33.78 72.36 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.225 -0.922 . . . . 2.93 109.674 -179.716 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' B' B ' 338' ' ' PHE . . . . . 0.918 ' HA ' HG21 ' B' ' 332' ' ' ILE . 59.0 t80 -55.89 -55.11 36.48 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.16 -0.963 . . . . 0.37 109.873 -179.715 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' B' B ' 339' ' ' GLU . . . . . . . . . . . . . 45.0 mt-10 -50.65 -34.22 25.47 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.21 -0.931 . . . . 1.98 110.399 -179.435 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' B' B ' 340' ' ' MET . . . . . . . . . . . . . 23.9 ttp -64.01 -51.57 63.63 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.049 -1.032 . . . . 0.32 110.115 -179.375 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' B' B ' 341' ' ' PHE . . . . . . . . . . . . . 44.8 m-85 -61.9 -45.46 93.65 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.167 -0.958 . . . . 0.18 109.96 -179.451 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' B' B ' 342' ' ' ARG . . . . . 0.424 ' O ' ' HB3' ' B' ' 345' ' ' ASN . 41.1 ttt180 -50.62 -40.36 52.67 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.187 -0.946 . . . . 2.42 109.933 -179.796 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' B' B ' 343' ' ' GLU . . . . . . . . . . . . . 35.4 tp10 -58.46 -51.51 69.53 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.192 -0.943 . . . . 2.35 109.825 -179.604 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' B' B ' 344' ' ' LEU . . . . . 0.618 HD22 HD22 ' A' ' 344' ' ' LEU . 84.0 mt -61.01 -31.99 71.6 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.137 -0.977 . . . . 0.18 109.345 -179.949 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' B' B ' 345' ' ' ASN . . . . . 0.44 HD22 HD21 ' D' ' 330' ' ' LEU . 9.0 t-20 -58.65 -55.06 39.98 Favored 'General case' 0 N--CA 1.488 1.451 0 O-C-N 121.325 -0.859 . . . . 1.09 109.372 179.83 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' B' B ' 346' ' ' GLU . . . . . . . . . . . . . 32.4 tp10 -61.52 -32.21 72.25 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.478 -0.764 . . . . 1.66 109.815 -179.867 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' B' B ' 347' ' ' ALA . . . . . 0.701 ' HB1' ' HB1' ' A' ' 347' ' ' ALA . . . -59.59 -56.95 15.51 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.166 -0.959 . . . . 0.17 109.912 -179.756 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' B' B ' 348' ' ' LEU . . . . . 0.557 HD22 ' N ' ' B' ' 348' ' ' LEU . 3.5 mm? -61.92 -38.83 89.89 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.168 -0.957 . . . . 0.29 109.71 -179.734 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' B' B ' 349' ' ' GLU . . . . . . . . . . . . . 1.8 mt-10 -58.67 -38.36 78.02 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.298 -0.876 . . . . 1.95 110.184 -179.583 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' B' B ' 350' ' ' LEU . . . . . 0.515 HD22 HD13 ' A' ' 350' ' ' LEU . 7.8 tt -63.81 -43.58 95.84 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.089 -1.007 . . . . 0.45 109.827 -179.512 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' B' B ' 351' ' ' LYS . . . . . . . . . . . . . 18.7 tttm -58.39 -42.14 86.42 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.189 -0.944 . . . . 1.38 109.53 -179.744 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' B' B ' 352' ' ' ASP . . . . . . . . . . . . . 48.5 m-20 -55.91 -41.6 74.79 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.284 -0.885 . . . . 1.16 109.524 -179.996 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' B' B ' 353' ' ' ALA . . . . . 0.401 ' O ' ' HB2' ' B' ' 357' ' ' LYS . . . -68.03 -25.6 65.46 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.19 -0.944 . . . . 0.61 109.494 -179.871 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' B' B ' 354' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -81.22 -1.2 43.92 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.213 -0.929 . . . . 1.45 109.54 179.884 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' B' B ' 355' ' ' ALA . . . . . . . . . . . . . . . -69.25 -87.97 0.02 OUTLIER 'General case' 0 N--CA 1.489 1.495 0 O-C-N 121.217 -0.927 . . . . 0.98 109.454 -179.939 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' B' B ' 356' ' ' GLY . . . . . . . . . . . . . . . -81.76 41.27 2.7 Favored Glycine 0 N--CA 1.492 2.367 0 N-CA-C 110.358 -1.097 . . . . 1.29 110.358 -179.923 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' B' B ' 357' ' ' LYS . . . . . 0.401 ' HB2' ' O ' ' B' ' 353' ' ' ALA . 24.9 tttp -87.65 97.28 10.79 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 120.897 -1.355 . . . . 4.09 109.387 179.876 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' B' B ' 358' ' ' GLU . . . . . 0.591 ' N ' ' HD2' ' B' ' 359' ' ' PRO . 2.7 mt-10 -50.65 -53.31 47.78 Favored Pre-proline 0 N--CA 1.489 1.515 0 O-C-N 121.356 -0.84 . . . . 5.72 110.008 -179.999 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' B' B ' 359' ' ' PRO . . . . . 0.591 ' HD2' ' N ' ' B' ' 358' ' ' GLU . 3.4 Cg_exo -61.93 131.89 37.1 Favored 'Trans proline' 0 C--N 1.312 -1.37 0 C-N-CA 121.902 1.734 . . . . 4.98 110.358 -179.669 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' B' B ' 360' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.236 0 CA-C-O 118.053 -1.415 . . . . 6.98 109.601 -179.987 . . . . . . . . 0 0 . 1 . 032 nuclear nobuild full ' C' C ' 319' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.49 1.574 0 N-CA-C 109.442 -0.577 . . . . 6.82 109.442 . . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' C' C ' 320' ' ' LYS . . . . . . . . . . . . . 8.9 mttt 60.02 160.31 0.04 OUTLIER 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.233 -0.917 . . . . 6.49 109.567 -179.962 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' C' C ' 321' ' ' LYS . . . . . . . . . . . . . 1.2 ptmt -82.11 147.29 57.11 Favored Pre-proline 0 N--CA 1.49 1.548 0 O-C-N 121.244 -0.91 . . . . 6.4 109.625 -179.771 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' C' C ' 322' ' ' PRO . . . . . . . . . . . . . 1.8 Cg_endo -64.3 -58.82 0.21 Allowed 'Trans proline' 0 C--N 1.31 -1.452 0 C-N-CA 122.35 2.033 . . . . 3.42 110.608 -179.89 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' C' C ' 323' ' ' LEU . . . . . . . . . . . . . 12.8 mt -79.22 119.61 22.55 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.252 -0.905 . . . . 3.95 110.0 -179.535 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' C' C ' 324' ' ' ASP . . . . . 0.466 ' CB ' ' OH ' ' C' ' 327' ' ' TYR . 2.5 m-20 -79.97 172.85 13.23 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.366 -0.834 . . . . 1.63 109.378 179.637 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' C' C ' 325' ' ' GLY . . . . . 0.449 ' O ' ' CE2' ' C' ' 327' ' ' TYR . . . -68.44 178.92 22.09 Favored Glycine 0 N--CA 1.49 2.285 0 N-CA-C 109.501 -1.44 . . . . 0.73 109.501 179.946 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' C' C ' 326' ' ' GLU . . . . . 0.463 ' OE1' ' HB2' ' A' ' 335' ' ' ARG . 95.0 mt-10 -58.14 -177.57 0.03 OUTLIER 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.227 -1.161 . . . . 2.17 109.286 179.967 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' C' C ' 327' ' ' TYR . . . . . 0.466 ' OH ' ' CB ' ' C' ' 324' ' ' ASP . 59.0 m-85 -149.02 104.53 3.44 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.102 -0.999 . . . . 0.48 109.808 -179.744 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' C' C ' 328' ' ' PHE . . . . . 0.505 ' O ' HG23 ' C' ' 329' ' ' THR . 96.3 m-85 -106.03 -164.53 1.02 Allowed 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.297 -0.877 . . . . 0.33 109.303 179.654 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' C' C ' 329' ' ' THR . . . . . 0.505 HG23 ' O ' ' C' ' 328' ' ' PHE . 4.2 p -155.75 167.01 31.77 Favored 'General case' 0 N--CA 1.489 1.491 0 O-C-N 121.214 -0.929 . . . . 0.23 109.751 -179.982 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' C' C ' 330' ' ' LEU . . . . . . . . . . . . . 40.3 tp -150.94 125.57 9.62 Favored 'General case' 0 N--CA 1.488 1.471 0 O-C-N 121.321 -0.862 . . . . 0.28 109.174 179.802 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' C' C ' 331' ' ' GLN . . . . . . . . . . . . . 3.5 tp60 -87.45 113.06 22.81 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.164 -0.96 . . . . 1.48 109.732 -179.857 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' C' C ' 332' ' ' ILE . . . . . . . . . . . . . 31.7 mt -103.77 109.5 27.32 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.643 0 O-C-N 121.25 -0.906 . . . . 0.24 109.537 179.871 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' C' C ' 333' ' ' ARG . . . . . 0.475 ' HG3' ' NH1' ' C' ' 333' ' ' ARG . 16.0 mtm-85 -73.86 149.7 41.39 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.227 -0.921 . . . . 2.74 109.428 179.786 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' C' C ' 334' ' ' GLY . . . . . . . . . . . . . . . 76.72 132.16 0.47 Allowed Glycine 0 N--CA 1.49 2.289 0 N-CA-C 109.6 -1.4 . . . . 0.35 109.6 179.903 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' C' C ' 335' ' ' ARG . . . . . 0.425 ' O ' ' HB3' ' C' ' 338' ' ' PHE . 2.6 tmt_? -76.45 -30.74 57.47 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.309 -1.112 . . . . 2.53 109.647 179.943 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' C' C ' 336' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -55.81 -57.11 13.39 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.322 -0.861 . . . . 2.62 109.959 -179.603 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' C' C ' 337' ' ' ARG . . . . . 0.548 ' HG3' ' NH1' ' C' ' 337' ' ' ARG . 1.4 mtm-85 -60.82 -30.56 70.16 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.098 -1.002 . . . . 2.81 109.718 -179.839 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' C' C ' 338' ' ' PHE . . . . . 0.425 ' HB3' ' O ' ' C' ' 335' ' ' ARG . 75.9 t80 -54.0 -59.84 4.11 Favored 'General case' 0 N--CA 1.489 1.49 0 O-C-N 121.306 -0.871 . . . . 0.4 110.265 -179.257 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' C' C ' 339' ' ' GLU . . . . . . . . . . . . . 1.1 mt-10 -50.0 -37.75 34.07 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.024 -1.048 . . . . 2.05 110.58 -179.283 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' C' C ' 340' ' ' MET . . . . . . . . . . . . . 25.9 ttp -63.62 -54.8 30.16 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.034 -1.041 . . . . 0.32 110.426 -179.097 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' C' C ' 341' ' ' PHE . . . . . . . . . . . . . 59.5 m-85 -61.8 -58.49 7.77 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.117 -0.989 . . . . 0.18 110.006 -179.298 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' C' C ' 342' ' ' ARG . . . . . 0.455 ' CG ' ' NH1' ' C' ' 342' ' ' ARG . 0.0 OUTLIER -48.21 -32.5 7.2 Favored 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.186 -0.946 . . . . 2.91 109.813 -179.723 . . . . . . . . 3 3 . 1 . 032 nuclear nobuild full ' C' C ' 343' ' ' GLU . . . . . . . . . . . . . 10.0 tp10 -58.72 -55.52 33.97 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.149 -0.97 . . . . 2.14 109.458 -179.895 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' C' C ' 344' ' ' LEU . . . . . 1.118 HD22 HD22 ' D' ' 344' ' ' LEU . 43.3 mt -62.16 -28.7 69.84 Favored 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.241 -0.912 . . . . 0.22 109.361 179.833 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' C' C ' 345' ' ' ASN . . . . . . . . . . . . . 15.8 t-20 -56.33 -56.56 19.5 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.247 -0.908 . . . . 1.08 109.53 -179.996 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' C' C ' 346' ' ' GLU . . . . . . . . . . . . . 61.6 tt0 -61.17 -30.66 70.53 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.227 -0.92 . . . . 2.21 109.592 -179.831 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' C' C ' 347' ' ' ALA . . . . . 0.84 ' HB1' ' HB1' ' D' ' 347' ' ' ALA . . . -59.82 -54.73 42.79 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.284 -0.885 . . . . 0.18 109.94 -179.726 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' C' C ' 348' ' ' LEU . . . . . 0.565 HD22 ' N ' ' C' ' 348' ' ' LEU . 3.3 mm? -62.31 -43.58 98.5 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.257 -0.902 . . . . 0.32 109.768 -179.664 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' C' C ' 349' ' ' GLU . . . . . . . . . . . . . 67.6 mm-40 -59.26 -32.71 70.26 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.192 -0.943 . . . . 2.19 110.386 -179.242 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' C' C ' 350' ' ' LEU . . . . . 0.696 HD13 HD22 ' D' ' 350' ' ' LEU . 6.1 tt -62.67 -49.57 74.62 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 120.953 -1.092 . . . . 0.46 109.562 -179.702 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' C' C ' 351' ' ' LYS . . . . . . . . . . . . . 73.2 tttt -57.83 -44.03 86.17 Favored 'General case' 0 C--N 1.303 -1.437 0 O-C-N 121.176 -0.953 . . . . 1.35 109.393 -179.777 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' C' C ' 352' ' ' ASP . . . . . . . . . . . . . 42.4 m-20 -58.36 -39.79 80.5 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.333 -0.855 . . . . 1.19 110.015 179.918 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' C' C ' 353' ' ' ALA . . . . . . . . . . . . . . . -66.62 -21.42 66.12 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.177 -0.952 . . . . 0.57 110.27 -179.246 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' C' C ' 354' ' ' GLN . . . . . . . . . . . . . 29.8 mt-30 -82.94 -22.67 33.74 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 120.974 -1.079 . . . . 1.47 109.163 179.884 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' C' C ' 355' ' ' ALA . . . . . . . . . . . . . . . -74.09 -6.97 50.78 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.339 -0.851 . . . . 0.93 109.365 179.428 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' C' C ' 356' ' ' GLY . . . . . . . . . . . . . . . -80.25 -78.35 0.92 Allowed Glycine 0 N--CA 1.491 2.325 0 N-CA-C 109.801 -1.32 . . . . 1.33 109.801 -179.588 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' C' C ' 357' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -83.01 143.88 30.33 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.255 -1.144 . . . . 4.01 109.744 -179.469 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' C' C ' 358' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -49.64 130.88 19.94 Favored Pre-proline 0 N--CA 1.488 1.463 0 O-C-N 121.319 -0.863 . . . . 5.75 109.248 179.999 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' C' C ' 359' ' ' PRO . . . . . . . . . . . . . 5.1 Cg_exo -59.3 -153.65 0.01 OUTLIER 'Trans proline' 0 C--N 1.311 -1.436 0 C-N-CA 121.943 1.762 . . . . 4.94 110.267 -179.99 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' C' C ' 360' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.318 0 CA-C-O 118.078 -1.401 . . . . 6.5 109.601 -179.957 . . . . . . . . 0 0 . 1 . 032 nuclear nobuild full ' D' D ' 319' ' ' LYS . . . . . 0.446 ' O ' ' O ' ' D' ' 320' ' ' LYS . 4.5 mtpt . . . . . 0 N--CA 1.49 1.569 0 N-CA-C 109.504 -0.554 . . . . 7.53 109.504 . . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' D' D ' 320' ' ' LYS . . . . . 0.446 ' O ' ' O ' ' D' ' 319' ' ' LYS . 2.1 mtmt 61.76 138.43 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.364 -0.835 . . . . 6.41 109.513 179.972 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' D' D ' 321' ' ' LYS . . . . . . . . . . . . . 19.7 mttt -159.16 111.01 1.55 Allowed Pre-proline 0 N--CA 1.49 1.541 0 O-C-N 121.269 -0.895 . . . . 6.11 109.527 -179.914 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' D' D ' 322' ' ' PRO . . . . . . . . . . . . . 3.6 Cg_exo -59.94 -158.78 0.02 OUTLIER 'Trans proline' 0 C--N 1.312 -1.394 0 C-N-CA 121.755 1.636 . . . . 2.82 110.077 179.917 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' D' D ' 323' ' ' LEU . . . . . . . . . . . . . 46.2 mt -80.45 127.42 32.39 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.205 -0.935 . . . . 2.83 109.315 179.96 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' D' D ' 324' ' ' ASP . . . . . . . . . . . . . 13.2 m-20 -78.93 164.12 24.69 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.16 -0.962 . . . . 1.54 109.447 -179.897 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' D' D ' 325' ' ' GLY . . . . . . . . . . . . . . . -66.95 178.52 15.78 Favored Glycine 0 N--CA 1.489 2.169 0 N-CA-C 109.313 -1.515 . . . . 0.59 109.313 -179.995 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' D' D ' 326' ' ' GLU . . . . . 0.439 ' HB2' ' CE1' ' D' ' 328' ' ' PHE . 45.0 mt-10 -56.95 -168.42 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.169 -1.194 . . . . 2.13 109.356 -179.979 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' D' D ' 327' ' ' TYR . . . . . . . . . . . . . 44.7 m-85 -149.24 109.1 4.05 Favored 'General case' 0 N--CA 1.488 1.43 0 O-C-N 121.358 -0.839 . . . . 0.47 109.276 179.925 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' D' D ' 328' ' ' PHE . . . . . 0.439 ' CE1' ' HB2' ' D' ' 326' ' ' GLU . 40.4 m-85 -113.58 -169.36 1.49 Allowed 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.236 -0.915 . . . . 0.3 109.533 -179.775 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' D' D ' 329' ' ' THR . . . . . 0.425 ' HA ' ' O ' ' B' ' 330' ' ' LEU . 6.7 p -153.38 168.52 25.81 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.314 -0.866 . . . . 0.22 109.181 -179.979 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' D' D ' 330' ' ' LEU . . . . . 0.44 HD21 HD22 ' B' ' 345' ' ' ASN . 19.9 tp -150.02 129.13 12.71 Favored 'General case' 0 N--CA 1.489 1.491 0 O-C-N 121.14 -0.975 . . . . 0.28 109.686 -179.868 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' D' D ' 331' ' ' GLN . . . . . . . . . . . . . 1.2 tp60 -87.96 113.21 23.39 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.299 -0.875 . . . . 0.93 109.382 179.747 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' D' D ' 332' ' ' ILE . . . . . 0.927 HG21 ' HA ' ' D' ' 338' ' ' PHE . 74.7 mt -103.41 104.96 17.46 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.538 0 O-C-N 121.235 -0.915 . . . . 0.25 109.51 -179.985 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' D' D ' 333' ' ' ARG . . . . . 0.457 ' HG2' ' NH1' ' D' ' 333' ' ' ARG . 0.0 OUTLIER -71.47 150.78 44.55 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.246 -0.909 . . . . 2.93 109.246 179.84 . . . . . . . . 3 3 . 1 . 032 nuclear nobuild full ' D' D ' 334' ' ' GLY . . . . . . . . . . . . . . . 76.18 126.81 0.24 Allowed Glycine 0 N--CA 1.491 2.304 0 N-CA-C 109.475 -1.45 . . . . 0.41 109.475 -179.996 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' D' D ' 335' ' ' ARG . . . . . 0.401 ' HA ' ' CE1' ' B' ' 328' ' ' PHE . 0.4 OUTLIER -74.05 -32.78 63.46 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.31 -1.112 . . . . 3.03 109.63 -179.859 . . . . . . . . 3 3 . 1 . 032 nuclear nobuild full ' D' D ' 336' ' ' GLU . . . . . . . . . . . . . 3.2 mt-10 -58.06 -61.53 2.48 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.221 -0.925 . . . . 2.26 109.795 -179.762 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' D' D ' 337' ' ' ARG . . . . . . . . . . . . . 22.3 mmm180 -59.84 -33.61 71.99 Favored 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.319 -0.863 . . . . 2.92 109.651 -179.678 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' D' D ' 338' ' ' PHE . . . . . 0.927 ' HA ' HG21 ' D' ' 332' ' ' ILE . 58.6 t80 -55.99 -55.03 37.69 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.217 -0.927 . . . . 0.37 109.916 -179.697 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' D' D ' 339' ' ' GLU . . . . . . . . . . . . . 44.7 mt-10 -50.8 -34.12 26.25 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.262 -0.899 . . . . 1.99 110.41 -179.411 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' D' D ' 340' ' ' MET . . . . . . . . . . . . . 23.9 ttp -64.14 -51.41 64.03 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.045 -1.035 . . . . 0.31 110.132 -179.413 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' D' D ' 341' ' ' PHE . . . . . . . . . . . . . 44.7 m-85 -61.93 -45.5 93.42 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.179 -0.951 . . . . 0.18 109.972 -179.462 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' D' D ' 342' ' ' ARG . . . . . 0.423 ' O ' ' HB3' ' D' ' 345' ' ' ASN . 41.5 ttt180 -50.64 -40.31 52.79 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.141 -0.974 . . . . 2.41 109.876 -179.751 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' D' D ' 343' ' ' GLU . . . . . . . . . . . . . 36.0 tp10 -58.36 -51.67 68.82 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.183 -0.948 . . . . 2.35 109.77 -179.673 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' D' D ' 344' ' ' LEU . . . . . 1.118 HD22 HD22 ' C' ' 344' ' ' LEU . 84.7 mt -60.91 -32.0 71.5 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.221 -0.925 . . . . 0.19 109.425 -179.952 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' D' D ' 345' ' ' ASN . . . . . 0.477 HD22 HD21 ' B' ' 330' ' ' LEU . 9.1 t-20 -58.69 -55.2 38.09 Favored 'General case' 0 N--CA 1.489 1.487 0 O-C-N 121.351 -0.843 . . . . 1.09 109.303 179.867 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' D' D ' 346' ' ' GLU . . . . . . . . . . . . . 31.5 tp10 -61.4 -32.2 72.13 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.35 -0.844 . . . . 1.69 109.839 -179.85 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' D' D ' 347' ' ' ALA . . . . . 0.84 ' HB1' ' HB1' ' C' ' 347' ' ' ALA . . . -59.61 -56.94 15.63 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.128 -0.983 . . . . 0.18 109.78 -179.669 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' D' D ' 348' ' ' LEU . . . . . 0.555 HD22 ' N ' ' D' ' 348' ' ' LEU . 3.5 mm? -61.96 -38.79 89.84 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.195 -0.941 . . . . 0.31 109.625 -179.662 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' D' D ' 349' ' ' GLU . . . . . . . . . . . . . 1.8 mt-10 -58.83 -38.17 78.07 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.293 -0.879 . . . . 1.95 110.183 -179.514 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' D' D ' 350' ' ' LEU . . . . . 0.696 HD22 HD13 ' C' ' 350' ' ' LEU . 7.8 tt -63.96 -43.61 95.3 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.091 -1.006 . . . . 0.43 109.852 -179.505 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' D' D ' 351' ' ' LYS . . . . . . . . . . . . . 18.7 tttm -58.32 -42.03 85.85 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.305 -0.872 . . . . 1.4 109.561 -179.758 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' D' D ' 352' ' ' ASP . . . . . . . . . . . . . 49.0 m-20 -56.04 -41.57 75.22 Favored 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.203 -0.936 . . . . 1.17 109.579 179.972 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' D' D ' 353' ' ' ALA . . . . . 0.403 ' O ' ' HB2' ' D' ' 357' ' ' LYS . . . -67.84 -25.72 65.69 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.204 -0.935 . . . . 0.59 109.513 -179.97 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' D' D ' 354' ' ' GLN . . . . . 0.536 ' NE2' HD11 ' C' ' 350' ' ' LEU . 0.1 OUTLIER -81.38 -1.24 44.76 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.26 -0.9 . . . . 1.44 109.474 -179.971 . . . . . . . . 3 3 . 1 . 032 nuclear nobuild full ' D' D ' 355' ' ' ALA . . . . . . . . . . . . . . . -69.06 -87.91 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.172 -0.955 . . . . 0.98 109.446 179.95 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' D' D ' 356' ' ' GLY . . . . . . . . . . . . . . . -81.77 41.15 2.69 Favored Glycine 0 N--CA 1.492 2.368 0 N-CA-C 110.356 -1.097 . . . . 1.28 110.356 -179.888 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' D' D ' 357' ' ' LYS . . . . . 0.403 ' HB2' ' O ' ' D' ' 353' ' ' ALA . 24.6 tttp -87.47 97.59 10.92 Favored 'General case' 0 N--CA 1.489 1.488 0 O-C-N 120.775 -1.426 . . . . 4.09 109.441 179.888 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' D' D ' 358' ' ' GLU . . . . . 0.574 ' N ' ' HD2' ' D' ' 359' ' ' PRO . 2.7 mt-10 -51.02 -53.45 48.13 Favored Pre-proline 0 N--CA 1.489 1.507 0 O-C-N 121.377 -0.827 . . . . 5.71 109.988 -179.97 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' D' D ' 359' ' ' PRO . . . . . 0.574 ' HD2' ' N ' ' D' ' 358' ' ' GLU . 3.4 Cg_exo -61.64 132.07 38.64 Favored 'Trans proline' 0 C--N 1.311 -1.425 0 C-N-CA 121.977 1.785 . . . . 4.97 110.285 -179.739 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' D' D ' 360' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.334 0 CA-C-O 117.996 -1.447 . . . . 6.97 109.522 -179.999 . . . . . . . . 0 0 . 1 . 033 nuclear nobuild full ' A' A ' 319' ' ' LYS . . . . . . . . . . . . . 60.7 mmtt . . . . . 0 N--CA 1.492 1.649 0 N-CA-C 109.628 -0.508 . . . . 7.55 109.628 . . . . . . . . . 0 0 . 1 . 033 nuclear nobuild full ' A' A ' 320' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER 59.34 -171.96 0.12 Allowed 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.194 -0.941 . . . . 6.43 109.291 -179.959 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' A' A ' 321' ' ' LYS . . . . . . . . . . . . . 2.5 ttmm -158.7 69.48 3.59 Favored Pre-proline 0 N--CA 1.493 1.683 0 O-C-N 121.161 -0.962 . . . . 6.13 109.961 -179.913 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 322' ' ' PRO . . . . . . . . . . . . . 1.9 Cg_endo -60.6 -155.97 0.02 OUTLIER 'Trans proline' 0 C--N 1.311 -1.411 0 C-N-CA 122.155 1.903 . . . . 2.83 110.164 179.526 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 323' ' ' LEU . . . . . 0.507 HD23 ' HA ' ' A' ' 323' ' ' LEU . 34.4 mt -81.12 126.49 31.53 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.221 -0.924 . . . . 2.83 109.317 179.789 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' A' A ' 324' ' ' ASP . . . . . 0.436 ' HB3' ' CE2' ' A' ' 327' ' ' TYR . 14.8 m-20 -80.27 143.58 33.56 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.185 -0.947 . . . . 1.53 109.609 -179.779 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' A' A ' 325' ' ' GLY . . . . . . . . . . . . . . . -68.16 -172.6 6.95 Favored Glycine 0 N--CA 1.488 2.167 0 N-CA-C 108.943 -1.663 . . . . 0.61 108.943 179.843 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 326' ' ' GLU . . . . . . . . . . . . . 33.9 mm-40 -58.94 -175.96 0.03 OUTLIER 'General case' 0 N--CA 1.489 1.489 0 O-C-N 121.395 -1.062 . . . . 2.13 109.603 179.925 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 327' ' ' TYR . . . . . 0.436 ' CE2' ' HB3' ' A' ' 324' ' ' ASP . 39.4 m-85 -149.83 105.81 3.45 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.256 -0.903 . . . . 0.48 109.638 179.928 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' A' A ' 328' ' ' PHE . . . . . 0.566 ' CZ ' ' HB2' ' C' ' 335' ' ' ARG . 24.7 m-85 -113.29 -166.51 1.09 Allowed 'General case' 0 N--CA 1.488 1.443 0 O-C-N 121.357 -0.84 . . . . 0.31 109.192 179.799 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' A' A ' 329' ' ' THR . . . . . . . . . . . . . 71.2 p -153.94 173.99 15.23 Favored 'General case' 0 N--CA 1.495 1.814 0 O-C-N 121.395 -0.815 . . . . 0.22 109.18 179.559 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 330' ' ' LEU . . . . . . . . . . . . . 17.2 tp -150.41 131.0 13.93 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.314 -0.866 . . . . 0.28 109.394 179.845 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 331' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -87.48 112.26 22.02 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.362 -0.837 . . . . 0.91 109.124 179.793 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' A' A ' 332' ' ' ILE . . . . . 0.91 HG21 ' HA ' ' A' ' 338' ' ' PHE . 79.5 mt -103.47 105.79 18.98 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.477 0 O-C-N 121.075 -1.015 . . . . 0.26 109.736 -179.858 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' A' A ' 333' ' ' ARG . . . . . 0.638 ' HG2' ' CE2' ' C' ' 327' ' ' TYR . 25.9 mtt180 -72.38 148.26 45.42 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.44 -0.787 . . . . 2.92 109.871 179.914 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' A' A ' 334' ' ' GLY . . . . . . . . . . . . . . . 82.69 134.81 2.19 Favored Glycine 0 N--CA 1.491 2.322 0 N-CA-C 109.856 -1.297 . . . . 0.4 109.856 179.784 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 335' ' ' ARG . . . . . 0.455 ' HA ' ' CE1' ' C' ' 328' ' ' PHE . 0.0 OUTLIER -80.37 -39.75 27.89 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.338 -1.095 . . . . 3.01 109.653 179.997 . . . . . . . . 3 3 . 1 . 033 nuclear nobuild full ' A' A ' 336' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -58.82 -61.48 2.59 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.14 -0.975 . . . . 2.29 109.891 -179.657 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' A' A ' 337' ' ' ARG . . . . . 0.46 ' CG ' HH11 ' A' ' 337' ' ' ARG . 0.0 OUTLIER -58.09 -30.92 66.62 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.19 -0.943 . . . . 2.93 109.529 -179.76 . . . . . . . . 3 3 . 1 . 033 nuclear nobuild full ' A' A ' 338' ' ' PHE . . . . . 0.91 ' HA ' HG21 ' A' ' 332' ' ' ILE . 50.4 t80 -55.78 -56.37 21.33 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.306 -0.871 . . . . 0.38 109.527 -179.872 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' A' A ' 339' ' ' GLU . . . . . . . . . . . . . 48.9 mt-10 -50.88 -33.27 23.32 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.231 -0.918 . . . . 1.97 109.875 -179.965 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 340' ' ' MET . . . . . . . . . . . . . 18.7 ttp -62.22 -53.3 57.14 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.29 -0.881 . . . . 0.31 110.008 -179.416 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 341' ' ' PHE . . . . . 0.425 ' HB2' HD13 ' A' ' 332' ' ' ILE . 36.9 m-85 -61.2 -49.32 77.62 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.206 -0.934 . . . . 0.18 110.202 -179.616 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' A' A ' 342' ' ' ARG . . . . . . . . . . . . . 4.2 ttt180 -47.43 -41.06 19.45 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.368 -0.832 . . . . 2.42 109.821 -179.972 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 343' ' ' GLU . . . . . . . . . . . . . 65.2 tt0 -59.26 -47.94 83.49 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.156 -0.965 . . . . 2.35 110.285 -179.586 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 344' ' ' LEU . . . . . . . . . . . . . 47.7 mt -63.16 -32.36 73.73 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.08 -1.013 . . . . 0.18 110.063 -179.431 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 345' ' ' ASN . . . . . 0.442 ' HB2' HD21 ' C' ' 330' ' ' LEU . 10.8 t-20 -57.96 -55.38 35.65 Favored 'General case' 0 N--CA 1.488 1.47 0 O-C-N 121.19 -0.944 . . . . 1.09 109.637 -179.756 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' A' A ' 346' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -61.55 -29.74 70.2 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.211 -0.93 . . . . 1.65 109.977 -179.844 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' A' A ' 347' ' ' ALA . . . . . 0.553 ' HB1' ' HB1' ' B' ' 347' ' ' ALA . . . -59.34 -58.93 6.47 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.278 -0.889 . . . . 0.18 110.237 -179.534 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' A' A ' 348' ' ' LEU . . . . . 0.607 HD22 ' N ' ' A' ' 348' ' ' LEU . 4.1 mm? -61.2 -42.7 99.05 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.162 -0.961 . . . . 0.3 110.005 -179.365 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' A' A ' 349' ' ' GLU . . . . . . . . . . . . . 16.2 mm-40 -57.87 -34.05 69.34 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.207 -0.933 . . . . 1.94 109.997 -179.493 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 350' ' ' LEU . . . . . 0.544 HD22 HD22 ' B' ' 350' ' ' LEU . 6.2 tt -64.43 -44.3 91.64 Favored 'General case' 0 N--CA 1.495 1.783 0 O-C-N 121.194 -0.941 . . . . 0.46 109.651 -179.592 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' A' A ' 351' ' ' LYS . . . . . . . . . . . . . 43.8 tttt -60.46 -46.82 88.69 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.246 -0.909 . . . . 1.4 109.859 -179.694 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 352' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -54.86 -44.89 74.43 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.416 -0.803 . . . . 1.16 110.377 -179.288 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' A' A ' 353' ' ' ALA . . . . . . . . . . . . . . . -66.68 -26.98 67.29 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 120.95 -1.093 . . . . 0.63 109.608 -179.804 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 354' ' ' GLN . . . . . . . . . . . . . 8.8 tt0 -82.88 -3.52 57.01 Favored 'General case' 0 N--CA 1.488 1.475 0 O-C-N 121.001 -1.062 . . . . 1.47 109.825 -179.749 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 355' ' ' ALA . . . . . . . . . . . . . . . -69.97 -6.99 36.97 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.249 -0.907 . . . . 1.01 109.364 -179.938 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 356' ' ' GLY . . . . . . . . . . . . . . . -80.59 -8.08 87.89 Favored Glycine 0 N--CA 1.487 2.08 0 N-CA-C 109.886 -1.286 . . . . 1.3 109.886 -179.985 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 357' ' ' LYS . . . . . . . . . . . . . 6.1 mttm -91.56 115.0 27.68 Favored 'General case' 0 N--CA 1.488 1.433 0 O-C-N 121.315 -1.109 . . . . 4.1 109.608 179.875 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 358' ' ' GLU . . . . . . . . . . . . . 50.7 tt0 -43.93 135.43 3.86 Favored Pre-proline 0 N--CA 1.492 1.634 0 O-C-N 121.235 -0.916 . . . . 5.75 109.159 179.797 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 359' ' ' PRO . . . . . . . . . . . . . 2.8 Cg_endo -62.82 122.76 11.18 Favored 'Trans proline' 0 C--N 1.31 -1.496 0 C-N-CA 121.859 1.706 . . . . 5.0 109.945 -179.775 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 360' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.488 2.152 0 N-CA-C 109.318 -1.513 . . . . 6.97 109.318 179.83 . . . . . . . . 0 0 . 1 . 033 nuclear nobuild full ' B' B ' 319' ' ' LYS . . . . . . . . . . . . . 51.7 mmtt . . . . . 0 N--CA 1.49 1.562 0 CA-C-O 121.386 0.612 . . . . 7.55 109.588 . . . . . . . . . 0 0 . 1 . 033 nuclear nobuild full ' B' B ' 320' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER 56.75 -171.25 0.09 Allowed 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.066 -1.021 . . . . 6.44 109.271 -179.772 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' B' B ' 321' ' ' LYS . . . . . . . . . . . . . 4.2 ttmm -158.74 69.48 3.57 Favored Pre-proline 0 N--CA 1.491 1.611 0 O-C-N 121.288 -0.882 . . . . 6.13 109.755 -179.906 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' B' B ' 322' ' ' PRO . . . . . . . . . . . . . 2.1 Cg_endo -60.99 -156.83 0.02 OUTLIER 'Trans proline' 0 C--N 1.309 -1.526 0 C-N-CA 122.138 1.892 . . . . 2.82 109.959 179.884 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' B' B ' 323' ' ' LEU . . . . . 0.419 HD23 ' HA ' ' B' ' 323' ' ' LEU . 29.2 mt -80.23 126.05 30.63 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.125 -0.984 . . . . 2.84 109.493 -179.977 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' B' B ' 324' ' ' ASP . . . . . 0.44 ' HB3' ' CE2' ' B' ' 327' ' ' TYR . 17.8 m-20 -79.89 143.84 33.93 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.193 -0.942 . . . . 1.53 109.921 -179.855 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' B' B ' 325' ' ' GLY . . . . . . . . . . . . . . . -68.66 -172.64 7.64 Favored Glycine 0 N--CA 1.488 2.148 0 N-CA-C 109.528 -1.429 . . . . 0.59 109.528 179.806 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' B' B ' 326' ' ' GLU . . . . . . . . . . . . . 35.1 mm-40 -58.53 -177.04 0.03 OUTLIER 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.464 -1.021 . . . . 2.13 109.791 -179.97 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' B' B ' 327' ' ' TYR . . . . . 0.627 ' CE1' ' HG2' ' D' ' 333' ' ' ARG . 39.2 m-85 -150.02 104.38 3.28 Favored 'General case' 0 N--CA 1.489 1.487 0 O-C-N 121.325 -0.859 . . . . 0.48 109.678 -179.957 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' B' B ' 328' ' ' PHE . . . . . . . . . . . . . 18.4 m-85 -112.43 -163.86 0.88 Allowed 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.287 -0.883 . . . . 0.32 109.308 179.657 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' B' B ' 329' ' ' THR . . . . . 0.466 ' HA ' ' O ' ' D' ' 330' ' ' LEU . 67.1 p -154.76 176.3 12.63 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.28 -0.887 . . . . 0.23 109.36 179.452 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' B' B ' 330' ' ' LEU . . . . . 0.501 HD21 ' HB2' ' D' ' 345' ' ' ASN . 18.3 tp -151.9 130.32 12.13 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.183 -0.948 . . . . 0.28 109.138 179.653 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' B' B ' 331' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -87.38 111.95 21.62 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.221 -0.924 . . . . 0.91 109.144 179.72 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' B' B ' 332' ' ' ILE . . . . . 0.85 HG21 ' HA ' ' B' ' 338' ' ' PHE . 72.0 mt -103.52 107.32 21.93 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.531 0 O-C-N 120.886 -1.134 . . . . 0.24 109.659 -179.815 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' B' B ' 333' ' ' ARG . . . . . 0.63 ' HG2' ' CE1' ' D' ' 327' ' ' TYR . 27.2 mtt180 -73.9 147.96 42.69 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.356 -0.84 . . . . 2.93 109.824 -179.857 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' B' B ' 334' ' ' GLY . . . . . . . . . . . . . . . 82.47 135.97 2.35 Favored Glycine 0 N--CA 1.488 2.118 0 N-CA-C 109.643 -1.383 . . . . 0.4 109.643 179.799 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' B' B ' 335' ' ' ARG . . . . . 0.414 HH11 ' HG3' ' B' ' 335' ' ' ARG . 0.0 OUTLIER -80.68 -40.35 25.6 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.303 -1.116 . . . . 3.01 109.96 -179.964 . . . . . . . . 3 3 . 1 . 033 nuclear nobuild full ' B' B ' 336' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -58.61 -59.98 4.53 Favored 'General case' 0 N--CA 1.495 1.811 0 O-C-N 121.102 -0.999 . . . . 2.28 109.989 -179.638 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' B' B ' 337' ' ' ARG . . . . . 0.461 ' CG ' ' NH1' ' B' ' 337' ' ' ARG . 0.0 OUTLIER -59.23 -29.97 67.9 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.113 -0.992 . . . . 2.93 109.61 -179.674 . . . . . . . . 3 3 . 1 . 033 nuclear nobuild full ' B' B ' 338' ' ' PHE . . . . . 0.85 ' HA ' HG21 ' B' ' 332' ' ' ILE . 51.8 t80 -56.83 -57.06 14.14 Favored 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.509 -0.745 . . . . 0.37 109.402 179.837 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' B' B ' 339' ' ' GLU . . . . . . . . . . . . . 48.3 mt-10 -50.91 -31.72 18.46 Favored 'General case' 0 N--CA 1.493 1.722 0 O-C-N 121.293 -0.879 . . . . 1.98 109.875 -179.774 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' B' B ' 340' ' ' MET . . . . . . . . . . . . . 18.8 ttp -63.88 -53.55 48.74 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.286 -0.884 . . . . 0.32 110.04 -179.57 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' B' B ' 341' ' ' PHE . . . . . . . . . . . . . 37.5 m-85 -61.33 -49.0 78.76 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.232 -0.917 . . . . 0.18 109.866 -179.481 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' B' B ' 342' ' ' ARG . . . . . . . . . . . . . 4.6 ttt180 -47.45 -40.91 19.34 Favored 'General case' 0 N--CA 1.493 1.717 0 O-C-N 121.171 -0.955 . . . . 2.42 109.928 -179.756 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' B' B ' 343' ' ' GLU . . . . . . . . . . . . . 62.5 tt0 -59.42 -48.04 83.18 Favored 'General case' 0 N--CA 1.495 1.811 0 O-C-N 121.365 -0.835 . . . . 2.35 110.302 -179.316 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' B' B ' 344' ' ' LEU . . . . . . . . . . . . . 37.6 mt -62.44 -33.26 74.47 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.192 -0.942 . . . . 0.18 109.949 -179.485 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' B' B ' 345' ' ' ASN . . . . . 0.497 ' HB2' HD21 ' D' ' 330' ' ' LEU . 13.2 t-20 -56.92 -56.46 21.31 Favored 'General case' 0 C--N 1.299 -1.596 0 O-C-N 121.282 -0.886 . . . . 1.09 109.862 -179.773 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' B' B ' 346' ' ' GLU . . . . . . . . . . . . . 1.3 tt0 -61.0 -28.59 69.14 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.224 -0.923 . . . . 1.66 110.073 -179.627 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' B' B ' 347' ' ' ALA . . . . . 0.553 ' HB1' ' HB1' ' A' ' 347' ' ' ALA . . . -60.36 -57.69 11.68 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.118 -0.989 . . . . 0.17 110.111 -179.421 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' B' B ' 348' ' ' LEU . . . . . 0.592 HD22 ' N ' ' B' ' 348' ' ' LEU . 4.1 mm? -62.05 -42.88 99.65 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.149 -0.97 . . . . 0.29 110.159 -179.476 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' B' B ' 349' ' ' GLU . . . . . . . . . . . . . 13.7 mm-40 -57.91 -35.23 70.75 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.045 -1.034 . . . . 1.95 110.066 -179.488 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' B' B ' 350' ' ' LEU . . . . . 0.544 HD22 HD22 ' A' ' 350' ' ' LEU . 6.5 tt -62.74 -45.01 94.71 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.002 -1.061 . . . . 0.45 109.53 -179.652 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' B' B ' 351' ' ' LYS . . . . . . . . . . . . . 37.8 tttt -59.87 -47.17 86.82 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.37 -0.831 . . . . 1.38 109.764 -179.769 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' B' B ' 352' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -54.14 -44.86 71.74 Favored 'General case' 0 N--CA 1.488 1.449 0 O-C-N 121.341 -0.849 . . . . 1.16 110.252 -179.441 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' B' B ' 353' ' ' ALA . . . . . . . . . . . . . . . -66.61 -29.43 69.47 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.026 -1.046 . . . . 0.61 109.46 -179.848 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' B' B ' 354' ' ' GLN . . . . . . . . . . . . . 7.7 tt0 -81.06 -1.81 45.59 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.107 -0.996 . . . . 1.45 109.962 -179.622 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' B' B ' 355' ' ' ALA . . . . . . . . . . . . . . . -70.02 -7.27 39.6 Favored 'General case' 0 C--N 1.303 -1.434 0 O-C-N 121.025 -1.047 . . . . 0.98 109.33 -179.992 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' B' B ' 356' ' ' GLY . . . . . . . . . . . . . . . -80.82 -6.23 89.54 Favored Glycine 0 N--CA 1.49 2.274 0 N-CA-C 110.001 -1.24 . . . . 1.29 110.001 -179.86 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' B' B ' 357' ' ' LYS . . . . . 0.424 ' O ' ' C ' ' B' ' 358' ' ' GLU . 5.3 mttm -91.38 113.92 26.31 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.127 -1.22 . . . . 4.09 109.369 179.744 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' B' B ' 358' ' ' GLU . . . . . 0.424 ' C ' ' O ' ' B' ' 357' ' ' LYS . 69.9 tt0 -45.31 135.31 5.51 Favored Pre-proline 0 N--CA 1.489 1.493 0 O-C-N 121.305 -0.872 . . . . 5.72 108.742 179.973 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' B' B ' 359' ' ' PRO . . . . . . . . . . . . . 2.3 Cg_endo -61.18 122.23 10.83 Favored 'Trans proline' 0 C--N 1.309 -1.545 0 C-N-CA 121.908 1.739 . . . . 4.98 110.162 -179.551 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' B' B ' 360' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 2.405 0 N-CA-C 109.09 -1.604 . . . . 6.98 109.09 179.903 . . . . . . . . 0 0 . 1 . 033 nuclear nobuild full ' C' C ' 319' ' ' LYS . . . . . . . . . . . . . 2.9 tppt? . . . . . 0 N--CA 1.489 1.51 0 N-CA-C 109.418 -0.586 . . . . 6.82 109.418 . . . . . . . . . 0 0 . 1 . 033 nuclear nobuild full ' C' C ' 320' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 58.27 -176.77 0.08 Allowed 'General case' 0 C--N 1.304 -1.412 0 O-C-N 121.129 -0.982 . . . . 6.49 109.645 179.958 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' C' C ' 321' ' ' LYS . . . . . . . . . . . . . 13.9 mttt 56.22 77.26 0.43 Allowed Pre-proline 0 N--CA 1.49 1.535 0 O-C-N 121.293 -0.879 . . . . 6.4 109.407 179.926 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' C' C ' 322' ' ' PRO . . . . . . . . . . . . . 1.7 Cg_endo -64.04 -81.32 0.01 OUTLIER 'Trans proline' 0 C--N 1.31 -1.496 0 C-N-CA 122.284 1.989 . . . . 3.42 110.184 -179.843 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' C' C ' 323' ' ' LEU . . . . . . . . . . . . . 38.8 mt -81.53 121.31 26.14 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 120.988 -1.07 . . . . 3.95 109.884 -179.746 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' C' C ' 324' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -81.02 167.05 20.21 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.37 -0.831 . . . . 1.63 109.144 179.451 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' C' C ' 325' ' ' GLY . . . . . . . . . . . . . . . -66.96 165.28 42.29 Favored Glycine 0 N--CA 1.487 2.074 0 N-CA-C 109.086 -1.606 . . . . 0.73 109.086 179.782 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' C' C ' 326' ' ' GLU . . . . . . . . . . . . . 2.7 mp0 -57.07 -167.89 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.344 -1.091 . . . . 2.17 109.608 179.968 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' C' C ' 327' ' ' TYR . . . . . 0.638 ' CE2' ' HG2' ' A' ' 333' ' ' ARG . 46.3 m-85 -147.21 104.74 3.69 Favored 'General case' 0 N--CA 1.487 1.413 0 O-C-N 121.263 -0.898 . . . . 0.48 109.204 -179.959 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' C' C ' 328' ' ' PHE . . . . . 0.455 ' CE1' ' HA ' ' A' ' 335' ' ' ARG . 67.7 m-85 -106.87 -168.8 1.46 Allowed 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.287 -0.883 . . . . 0.33 109.147 -179.915 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' C' C ' 329' ' ' THR . . . . . . . . . . . . . 18.0 p -150.97 167.03 28.85 Favored 'General case' 0 C--N 1.302 -1.498 0 O-C-N 121.472 -0.768 . . . . 0.23 108.978 -179.847 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' C' C ' 330' ' ' LEU . . . . . 0.442 HD21 ' HB2' ' A' ' 345' ' ' ASN . 47.0 tp -150.92 127.7 10.93 Favored 'General case' 0 C--N 1.302 -1.488 0 O-C-N 121.2 -0.937 . . . . 0.28 109.688 -179.491 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' C' C ' 331' ' ' GLN . . . . . . . . . . . . . 5.4 tp60 -86.71 113.41 22.54 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.375 -0.828 . . . . 1.48 109.488 179.903 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' C' C ' 332' ' ' ILE . . . . . 0.809 HG21 ' HA ' ' C' ' 338' ' ' PHE . 30.3 mt -105.2 109.49 27.88 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.51 0 O-C-N 121.547 -0.721 . . . . 0.24 109.883 -179.853 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' C' C ' 333' ' ' ARG . . . . . . . . . . . . . 79.3 mtt180 -74.23 147.65 42.27 Favored 'General case' 0 C--N 1.302 -1.472 0 O-C-N 121.306 -0.871 . . . . 2.74 109.635 179.781 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' C' C ' 334' ' ' GLY . . . . . . . . . . . . . . . 80.23 127.0 0.67 Allowed Glycine 0 N--CA 1.486 1.987 0 N-CA-C 109.361 -1.495 . . . . 0.35 109.361 -179.857 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' C' C ' 335' ' ' ARG . . . . . 0.566 ' HB2' ' CZ ' ' A' ' 328' ' ' PHE . 0.0 OUTLIER -78.35 -33.12 49.29 Favored 'General case' 0 N--CA 1.487 1.412 0 O-C-N 121.201 -1.176 . . . . 2.53 109.463 179.972 . . . . . . . . 3 3 . 1 . 033 nuclear nobuild full ' C' C ' 336' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -57.52 -62.56 1.7 Allowed 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.127 -0.983 . . . . 2.62 108.986 179.567 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' C' C ' 337' ' ' ARG . . . . . 0.541 ' HG2' ' NH1' ' C' ' 337' ' ' ARG . 0.2 OUTLIER -59.52 -31.61 69.55 Favored 'General case' 0 N--CA 1.489 1.483 0 O-C-N 121.745 -0.597 . . . . 2.81 109.656 -179.886 . . . . . . . . 3 3 . 1 . 033 nuclear nobuild full ' C' C ' 338' ' ' PHE . . . . . 0.809 ' HA ' HG21 ' C' ' 332' ' ' ILE . 46.3 t80 -54.52 -59.42 4.72 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.171 -0.956 . . . . 0.4 109.755 -179.466 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' C' C ' 339' ' ' GLU . . . . . . . . . . . . . 9.9 mm-40 -48.32 -32.65 7.71 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.434 -0.792 . . . . 2.05 110.247 -179.333 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' C' C ' 340' ' ' MET . . . . . . . . . . . . . 34.6 ttp -63.91 -50.88 66.96 Favored 'General case' 0 N--CA 1.494 1.742 0 O-C-N 121.251 -0.905 . . . . 0.32 109.818 -179.809 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' C' C ' 341' ' ' PHE . . . . . . . . . . . . . 49.7 m-85 -62.83 -52.91 61.3 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 120.959 -1.088 . . . . 0.18 109.762 -179.804 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' C' C ' 342' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -47.81 -39.96 19.76 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.442 -0.786 . . . . 2.91 110.005 -179.428 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' C' C ' 343' ' ' GLU . . . . . . . . . . . . . 4.5 tp10 -60.8 -44.88 96.27 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 120.974 -1.079 . . . . 2.14 109.461 -179.998 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' C' C ' 344' ' ' LEU . . . . . 0.411 ' O ' ' HB3' ' C' ' 347' ' ' ALA . 27.0 mt -60.35 -41.02 92.8 Favored 'General case' 0 N--CA 1.487 1.395 0 O-C-N 121.294 -0.879 . . . . 0.22 109.593 -179.939 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' C' C ' 345' ' ' ASN . . . . . . . . . . . . . 48.9 t-20 -54.61 -53.7 51.24 Favored 'General case' 0 N--CA 1.489 1.488 0 O-C-N 121.313 -0.867 . . . . 1.08 109.818 -179.664 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' C' C ' 346' ' ' GLU . . . . . . . . . . . . . 2.9 tp10 -58.58 -29.84 66.72 Favored 'General case' 0 C--N 1.303 -1.449 0 O-C-N 121.108 -0.995 . . . . 2.21 109.362 -179.872 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' C' C ' 347' ' ' ALA . . . . . 0.655 ' HB1' ' HB1' ' D' ' 347' ' ' ALA . . . -63.12 -51.82 65.0 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.16 -0.962 . . . . 0.18 109.766 179.943 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' C' C ' 348' ' ' LEU . . . . . 0.619 HD22 ' N ' ' C' ' 348' ' ' LEU . 3.6 mm? -62.88 -43.6 98.35 Favored 'General case' 0 N--CA 1.494 1.743 0 O-C-N 121.04 -1.038 . . . . 0.32 109.773 -179.619 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' C' C ' 349' ' ' GLU . . . . . . . . . . . . . 3.1 mm-40 -59.25 -36.82 76.19 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.284 -0.885 . . . . 2.19 110.085 -179.376 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' C' C ' 350' ' ' LEU . . . . . 0.614 HD13 HD22 ' D' ' 350' ' ' LEU . 5.5 tt -62.75 -48.91 77.13 Favored 'General case' 0 C--N 1.302 -1.466 0 O-C-N 121.12 -0.987 . . . . 0.46 109.29 -179.775 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' C' C ' 351' ' ' LYS . . . . . . . . . . . . . 27.4 tttm -58.23 -39.66 79.67 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.198 -0.939 . . . . 1.35 109.06 179.662 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' C' C ' 352' ' ' ASP . . . . . . . . . . . . . 96.2 m-20 -54.44 -31.7 55.96 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.334 -0.853 . . . . 1.19 109.579 179.888 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' C' C ' 353' ' ' ALA . . . . . . . . . . . . . . . -64.24 -37.02 85.99 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.42 -0.8 . . . . 0.57 109.631 -179.626 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' C' C ' 354' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -81.97 -2.28 50.94 Favored 'General case' 0 N--CA 1.489 1.489 0 O-C-N 121.215 -0.928 . . . . 1.47 110.329 -179.423 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' C' C ' 355' ' ' ALA . . . . . . . . . . . . . . . -73.42 -4.89 36.42 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 120.962 -1.086 . . . . 0.93 110.11 -179.907 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' C' C ' 356' ' ' GLY . . . . . . . . . . . . . . . -80.97 -12.77 82.24 Favored Glycine 0 N--CA 1.494 2.558 0 C-N-CA 119.569 -1.3 . . . . 1.33 110.021 -179.699 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' C' C ' 357' ' ' LYS . . . . . 0.423 ' O ' ' HD3' ' C' ' 359' ' ' PRO . 0.4 OUTLIER -91.89 99.77 12.56 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.199 -1.177 . . . . 4.01 110.181 -179.812 . . . . . . . . 3 3 . 1 . 033 nuclear nobuild full ' C' C ' 358' ' ' GLU . . . . . 0.509 ' CG ' ' O ' ' C' ' 358' ' ' GLU . 4.2 pt-20 -50.96 108.93 1.15 Allowed Pre-proline 0 N--CA 1.492 1.627 0 O-C-N 121.275 -0.89 . . . . 5.75 109.446 179.669 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' C' C ' 359' ' ' PRO . . . . . 0.423 ' HD3' ' O ' ' C' ' 357' ' ' LYS . 4.9 Cg_exo -58.9 113.45 1.58 Allowed 'Trans proline' 0 C--N 1.313 -1.34 0 C-N-CA 122.056 1.837 . . . . 4.94 110.143 179.984 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' C' C ' 360' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.493 2.457 0 CA-C-O 117.884 -1.509 . . . . 6.5 109.673 -179.949 . . . . . . . . 0 0 . 1 . 033 nuclear nobuild full ' D' D ' 319' ' ' LYS . . . . . . . . . . . . . 51.2 mmtt . . . . . 0 N--CA 1.49 1.569 0 CA-C-O 121.39 0.614 . . . . 7.53 109.53 . . . . . . . . . 0 0 . 1 . 033 nuclear nobuild full ' D' D ' 320' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER 56.42 -170.7 0.08 Allowed 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.181 -0.95 . . . . 6.41 109.557 -179.696 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' D' D ' 321' ' ' LYS . . . . . . . . . . . . . 3.2 ttmm -158.8 68.23 3.38 Favored Pre-proline 0 N--CA 1.487 1.42 0 O-C-N 121.433 -0.792 . . . . 6.11 109.622 -179.918 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' D' D ' 322' ' ' PRO . . . . . . . . . . . . . 1.6 Cg_endo -60.93 -157.87 0.02 OUTLIER 'Trans proline' 0 C--N 1.311 -1.441 0 C-N-CA 122.283 1.989 . . . . 2.82 110.232 179.783 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' D' D ' 323' ' ' LEU . . . . . 0.435 ' HA ' HD23 ' D' ' 323' ' ' LEU . 34.0 mt -79.58 125.73 29.98 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.176 -0.952 . . . . 2.83 109.211 -179.935 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' D' D ' 324' ' ' ASP . . . . . . . . . . . . . 22.9 m-20 -79.59 143.43 34.75 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.103 -0.998 . . . . 1.54 109.669 -179.731 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' D' D ' 325' ' ' GLY . . . . . . . . . . . . . . . -68.28 -173.53 7.83 Favored Glycine 0 N--CA 1.488 2.128 0 N-CA-C 109.194 -1.563 . . . . 0.59 109.194 179.562 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' D' D ' 326' ' ' GLU . . . . . . . . . . . . . 41.3 mm-40 -59.27 -177.37 0.04 OUTLIER 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.286 -1.126 . . . . 2.13 109.65 -179.948 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' D' D ' 327' ' ' TYR . . . . . 0.63 ' CE1' ' HG2' ' B' ' 333' ' ' ARG . 41.0 m-85 -148.78 105.49 3.56 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.281 -0.887 . . . . 0.47 109.7 179.989 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' D' D ' 328' ' ' PHE . . . . . 0.404 ' C ' HG23 ' D' ' 329' ' ' THR . 22.1 m-85 -112.95 -165.44 0.99 Allowed 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.371 -0.83 . . . . 0.3 109.176 179.582 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' D' D ' 329' ' ' THR . . . . . 0.47 ' HA ' ' O ' ' B' ' 330' ' ' LEU . 78.3 p -154.02 173.87 15.42 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.194 -0.941 . . . . 0.22 109.257 179.783 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' D' D ' 330' ' ' LEU . . . . . 0.497 HD21 ' HB2' ' B' ' 345' ' ' ASN . 21.5 tp -150.58 129.81 12.78 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.265 -0.897 . . . . 0.28 109.212 179.639 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' D' D ' 331' ' ' GLN . . . . . . . . . . . . . 1.1 tt0 -86.98 112.83 22.21 Favored 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.165 -0.959 . . . . 0.93 109.331 179.756 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' D' D ' 332' ' ' ILE . . . . . 0.847 HG21 ' HA ' ' D' ' 338' ' ' PHE . 73.5 mt -103.94 107.56 22.58 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.505 0 O-C-N 121.108 -0.995 . . . . 0.25 109.671 -179.784 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' D' D ' 333' ' ' ARG . . . . . 0.627 ' HG2' ' CE1' ' B' ' 327' ' ' TYR . 32.2 mtt180 -74.1 148.27 41.99 Favored 'General case' 0 C--N 1.304 -1.37 0 O-C-N 121.413 -0.804 . . . . 2.93 109.672 -179.886 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' D' D ' 334' ' ' GLY . . . . . . . . . . . . . . . 82.84 134.48 2.17 Favored Glycine 0 N--CA 1.486 1.978 0 N-CA-C 109.598 -1.401 . . . . 0.41 109.598 179.988 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' D' D ' 335' ' ' ARG . . . . . 0.403 ' HG3' HH11 ' D' ' 335' ' ' ARG . 0.0 OUTLIER -79.88 -40.8 27.54 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.4 -1.059 . . . . 3.03 109.69 -179.795 . . . . . . . . 3 3 . 1 . 033 nuclear nobuild full ' D' D ' 336' ' ' GLU . . . . . . . . . . . . . 1.7 mt-10 -58.66 -59.12 5.9 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.221 -0.924 . . . . 2.26 110.044 -179.717 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' D' D ' 337' ' ' ARG . . . . . 0.447 HH11 ' CG ' ' D' ' 337' ' ' ARG . 0.0 OUTLIER -59.53 -31.91 69.83 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.142 -0.974 . . . . 2.92 109.756 -179.657 . . . . . . . . 3 3 . 1 . 033 nuclear nobuild full ' D' D ' 338' ' ' PHE . . . . . 0.847 ' HA ' HG21 ' D' ' 332' ' ' ILE . 46.7 t80 -55.66 -56.7 17.27 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.259 -0.901 . . . . 0.37 109.783 -179.957 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' D' D ' 339' ' ' GLU . . . . . . . . . . . . . 44.1 mt-10 -50.72 -32.75 20.45 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.059 -1.026 . . . . 1.99 109.735 -179.87 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' D' D ' 340' ' ' MET . . . . . . . . . . . . . 17.3 ttp -62.49 -52.66 62.61 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.187 -0.945 . . . . 0.31 109.99 -179.535 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' D' D ' 341' ' ' PHE . . . . . 0.406 ' HB2' HD13 ' D' ' 332' ' ' ILE . 40.2 m-85 -62.32 -51.14 68.85 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.184 -0.948 . . . . 0.18 109.773 -179.814 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' D' D ' 342' ' ' ARG . . . . . . . . . . . . . 4.1 ttt180 -45.17 -39.51 6.22 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.284 -0.885 . . . . 2.41 109.92 -179.76 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' D' D ' 343' ' ' GLU . . . . . . . . . . . . . 60.1 tt0 -60.96 -48.48 81.64 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.136 -0.977 . . . . 2.35 110.213 -179.675 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' D' D ' 344' ' ' LEU . . . . . 0.411 HD22 ' CD2' ' C' ' 344' ' ' LEU . 49.7 mt -62.13 -33.06 73.77 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.052 -1.03 . . . . 0.19 109.878 -179.459 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' D' D ' 345' ' ' ASN . . . . . 0.501 ' HB2' HD21 ' B' ' 330' ' ' LEU . 14.3 t-20 -56.96 -56.51 20.74 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.299 -0.875 . . . . 1.09 109.558 -179.582 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' D' D ' 346' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -60.85 -29.1 69.32 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.192 -0.942 . . . . 1.69 110.133 -179.716 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' D' D ' 347' ' ' ALA . . . . . 0.655 ' HB1' ' HB1' ' C' ' 347' ' ' ALA . . . -59.7 -58.53 8.17 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.152 -0.968 . . . . 0.18 110.254 -179.502 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' D' D ' 348' ' ' LEU . . . . . 0.598 HD22 ' N ' ' D' ' 348' ' ' LEU . 4.1 mm? -62.02 -42.18 98.88 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.157 -0.964 . . . . 0.31 110.069 -179.256 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' D' D ' 349' ' ' GLU . . . . . . . . . . . . . 9.1 mm-40 -58.6 -34.26 70.92 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.033 -1.042 . . . . 1.95 110.132 -179.349 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' D' D ' 350' ' ' LEU . . . . . 0.614 HD22 HD13 ' C' ' 350' ' ' LEU . 6.4 tt -64.0 -45.15 90.24 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.248 -0.907 . . . . 0.43 109.499 -179.633 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' D' D ' 351' ' ' LYS . . . . . . . . . . . . . 48.2 tttt -59.5 -46.08 89.85 Favored 'General case' 0 N--CA 1.488 1.448 0 O-C-N 121.292 -0.88 . . . . 1.4 109.676 -179.825 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' D' D ' 352' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -55.27 -45.01 76.14 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.338 -0.851 . . . . 1.17 110.119 -179.419 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' D' D ' 353' ' ' ALA . . . . . . . . . . . . . . . -66.71 -29.41 69.39 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 120.794 -1.192 . . . . 0.59 109.576 -179.678 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' D' D ' 354' ' ' GLN . . . . . . . . . . . . . 8.0 tt0 -80.98 -2.25 47.1 Favored 'General case' 0 N--CA 1.489 1.481 0 O-C-N 121.208 -0.933 . . . . 1.44 109.798 -179.769 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' D' D ' 355' ' ' ALA . . . . . . . . . . . . . . . -70.58 -6.2 34.82 Favored 'General case' 0 C--N 1.301 -1.522 0 O-C-N 121.094 -1.004 . . . . 0.98 109.156 179.691 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' D' D ' 356' ' ' GLY . . . . . . . . . . . . . . . -80.54 -7.98 88.0 Favored Glycine 0 N--CA 1.49 2.284 0 N-CA-C 109.994 -1.242 . . . . 1.28 109.994 179.955 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' D' D ' 357' ' ' LYS . . . . . 0.419 ' O ' ' C ' ' D' ' 358' ' ' GLU . 6.0 mttm -90.38 115.94 27.95 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.041 -1.27 . . . . 4.09 109.693 179.953 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' D' D ' 358' ' ' GLU . . . . . 0.428 ' CG ' ' HD2' ' D' ' 359' ' ' PRO . 53.8 tt0 -45.51 137.13 5.49 Favored Pre-proline 0 N--CA 1.487 1.425 0 O-C-N 121.277 -0.889 . . . . 5.71 108.875 179.855 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' D' D ' 359' ' ' PRO . . . . . 0.428 ' HD2' ' CG ' ' D' ' 358' ' ' GLU . 3.7 Cg_exo -61.39 119.85 7.21 Favored 'Trans proline' 0 C--N 1.311 -1.444 0 C-N-CA 121.794 1.663 . . . . 4.97 110.116 -179.768 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' D' D ' 360' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.215 0 N-CA-C 109.525 -1.43 . . . . 6.97 109.525 179.831 . . . . . . . . 0 0 . 1 . 034 nuclear nobuild full ' A' A ' 319' ' ' LYS . . . . . 0.45 ' O ' ' CB ' ' A' ' 320' ' ' LYS . 9.3 mmtt . . . . . 0 N--CA 1.49 1.547 0 CA-C-O 121.331 0.586 . . . . 7.55 109.571 . . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 320' ' ' LYS . . . . . 0.45 ' CB ' ' O ' ' A' ' 319' ' ' LYS . 0.1 OUTLIER 72.05 8.28 5.92 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.421 -0.799 . . . . 6.43 109.666 -179.858 . . . . . . . . 3 3 . 1 . 034 nuclear nobuild full ' A' A ' 321' ' ' LYS . . . . . 0.52 ' N ' ' HD3' ' A' ' 322' ' ' PRO . 0.3 OUTLIER -158.41 61.61 2.08 Favored Pre-proline 0 N--CA 1.491 1.597 0 O-C-N 121.215 -0.928 . . . . 6.13 109.446 179.651 . . . . . . . . 3 3 . 1 . 034 nuclear nobuild full ' A' A ' 322' ' ' PRO . . . . . 0.52 ' HD3' ' N ' ' A' ' 321' ' ' LYS . 2.1 Cg_endo -62.35 93.0 0.13 Allowed 'Trans proline' 0 C--N 1.31 -1.486 0 C-N-CA 122.333 2.022 . . . . 2.83 110.536 -179.964 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' A' A ' 323' ' ' LEU . . . . . . . . . . . . . 87.7 mt -82.42 72.59 9.48 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.107 -0.996 . . . . 2.83 109.611 179.859 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 324' ' ' ASP . . . . . 0.47 ' HB2' ' OH ' ' A' ' 327' ' ' TYR . 4.5 m-20 -80.57 177.94 8.67 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.119 -0.988 . . . . 1.53 109.421 179.809 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' A' A ' 325' ' ' GLY . . . . . . . . . . . . . . . -70.1 -154.02 1.04 Allowed Glycine 0 N--CA 1.49 2.279 0 N-CA-C 109.434 -1.466 . . . . 0.61 109.434 179.774 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 326' ' ' GLU . . . . . . . . . . . . . 4.2 mt-10 -58.86 -167.08 0.01 OUTLIER 'General case' 0 N--CA 1.487 1.409 0 O-C-N 121.291 -1.123 . . . . 2.13 109.404 179.922 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 327' ' ' TYR . . . . . 0.55 ' CE1' ' HG3' ' C' ' 333' ' ' ARG . 39.0 m-85 -148.96 109.81 4.29 Favored 'General case' 0 N--CA 1.489 1.478 0 O-C-N 121.35 -0.844 . . . . 0.48 109.463 179.9 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' A' A ' 328' ' ' PHE . . . . . 0.41 ' CE2' ' HA ' ' C' ' 335' ' ' ARG . 88.0 m-85 -113.64 -169.41 1.5 Allowed 'General case' 0 C--N 1.302 -1.464 0 O-C-N 121.353 -0.842 . . . . 0.31 108.934 179.772 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' A' A ' 329' ' ' THR . . . . . . . . . . . . . 23.5 p -153.15 169.77 22.16 Favored 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.013 -1.055 . . . . 0.22 109.517 -179.97 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 330' ' ' LEU . . . . . 0.484 HD21 ' HB2' ' C' ' 345' ' ' ASN . 17.4 tp -150.83 127.2 10.68 Favored 'General case' 0 N--CA 1.488 1.46 0 O-C-N 121.288 -0.882 . . . . 0.28 109.529 -179.809 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' A' A ' 331' ' ' GLN . . . . . 0.449 ' OE1' ' O ' ' C' ' 328' ' ' PHE . 3.7 tp-100 -87.77 119.91 28.57 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.19 -0.944 . . . . 0.91 109.401 179.846 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' A' A ' 332' ' ' ILE . . . . . 0.619 HG21 ' HA ' ' A' ' 338' ' ' PHE . 97.9 mt -103.38 107.99 23.41 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.596 0 O-C-N 121.299 -0.875 . . . . 0.26 109.519 179.898 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' A' A ' 333' ' ' ARG . . . . . 0.488 ' HG2' ' CE2' ' C' ' 327' ' ' TYR . 1.4 mtt-85 -72.18 131.54 42.91 Favored 'General case' 0 N--CA 1.488 1.463 0 O-C-N 121.206 -0.934 . . . . 2.92 109.569 -179.988 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' A' A ' 334' ' ' GLY . . . . . . . . . . . . . . . 87.71 138.88 6.02 Favored Glycine 0 N--CA 1.49 2.298 0 N-CA-C 109.809 -1.316 . . . . 0.4 109.809 179.817 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 335' ' ' ARG . . . . . 0.429 ' O ' ' HB3' ' A' ' 338' ' ' PHE . 37.5 ttt180 -79.78 -29.04 40.27 Favored 'General case' 0 N--CA 1.489 1.488 0 O-C-N 121.316 -1.108 . . . . 3.01 109.676 -179.978 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' A' A ' 336' ' ' GLU . . . . . . . . . . . . . 38.7 mt-10 -56.45 -61.95 2.06 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.211 -0.93 . . . . 2.29 109.843 -179.732 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 337' ' ' ARG . . . . . 0.487 ' CZ ' HD12 ' C' ' 348' ' ' LEU . 0.0 OUTLIER -60.52 -26.67 67.02 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.151 -0.968 . . . . 2.93 109.686 -179.776 . . . . . . . . 3 3 . 1 . 034 nuclear nobuild full ' A' A ' 338' ' ' PHE . . . . . 0.619 ' HA ' HG21 ' A' ' 332' ' ' ILE . 91.5 t80 -56.31 -53.58 55.57 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.163 -0.961 . . . . 0.38 110.01 -179.694 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' A' A ' 339' ' ' GLU . . . . . . . . . . . . . 6.8 mt-10 -54.6 -39.52 67.95 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.019 -1.05 . . . . 1.97 110.533 -179.369 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 340' ' ' MET . . . . . . . . . . . . . 30.9 ttp -64.37 -53.4 49.15 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.044 -1.035 . . . . 0.31 110.877 -178.788 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 341' ' ' PHE . . . . . 0.551 ' CZ ' ' HA ' ' C' ' 345' ' ' ASN . 56.7 m-85 -60.57 -48.71 80.58 Favored 'General case' 0 N--CA 1.494 1.761 0 O-C-N 120.91 -1.119 . . . . 0.18 110.291 -179.018 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' A' A ' 342' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -48.9 -44.4 40.09 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.075 -1.016 . . . . 2.42 110.136 -179.6 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' A' A ' 343' ' ' GLU . . . . . . . . . . . . . 2.1 tp10 -57.81 -41.99 83.33 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.102 -0.999 . . . . 2.35 109.745 -179.585 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 344' ' ' LEU . . . . . . . . . . . . . 45.8 mt -63.63 -47.16 82.48 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.173 -0.955 . . . . 0.18 109.92 -179.828 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 345' ' ' ASN . . . . . 0.642 ' HB2' HD21 ' C' ' 330' ' ' LEU . 39.3 t-20 -54.83 -48.3 73.01 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.16 -0.962 . . . . 1.09 109.737 -179.616 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' A' A ' 346' ' ' GLU . . . . . . . . . . . . . 56.5 tt0 -61.83 -35.88 79.53 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.194 -0.941 . . . . 1.65 109.749 -179.882 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 347' ' ' ALA . . . . . 0.689 ' HB1' ' HB1' ' B' ' 347' ' ' ALA . . . -59.94 -55.83 29.26 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.249 -0.907 . . . . 0.18 110.049 -179.623 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' A' A ' 348' ' ' LEU . . . . . 0.587 HD22 ' N ' ' A' ' 348' ' ' LEU . 3.8 mm? -60.02 -41.72 92.79 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.199 -0.938 . . . . 0.3 109.655 -179.653 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' A' A ' 349' ' ' GLU . . . . . . . . . . . . . 88.3 mt-10 -58.6 -33.48 70.04 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.254 -0.903 . . . . 1.94 109.785 -179.694 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 350' ' ' LEU . . . . . 0.623 ' O ' HD23 ' A' ' 350' ' ' LEU . 5.3 tt -63.16 -49.13 75.54 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.201 -0.937 . . . . 0.46 109.162 179.944 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' A' A ' 351' ' ' LYS . . . . . . . . . . . . . 6.5 ttmm -58.49 -44.79 89.51 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.259 -0.901 . . . . 1.4 109.303 -179.989 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 352' ' ' ASP . . . . . . . . . . . . . 14.5 m-20 -57.04 -42.95 81.45 Favored 'General case' 0 N--CA 1.489 1.484 0 O-C-N 121.319 -0.863 . . . . 1.16 109.676 179.922 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 353' ' ' ALA . . . . . . . . . . . . . . . -67.35 -22.08 65.6 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.277 -0.889 . . . . 0.63 109.691 -179.787 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 354' ' ' GLN . . . . . 0.603 ' NE2' HD11 ' B' ' 350' ' ' LEU . 0.0 OUTLIER -82.43 -11.23 58.66 Favored 'General case' 0 N--CA 1.488 1.475 0 O-C-N 121.237 -0.914 . . . . 1.47 109.274 179.944 . . . . . . . . 3 3 . 1 . 034 nuclear nobuild full ' A' A ' 355' ' ' ALA . . . . . . . . . . . . . . . -72.27 -9.83 58.98 Favored 'General case' 0 N--CA 1.489 1.499 0 O-C-N 121.184 -0.948 . . . . 1.01 109.473 179.711 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 356' ' ' GLY . . . . . . . . . . . . . . . -80.51 -29.13 45.23 Favored Glycine 0 N--CA 1.492 2.38 0 N-CA-C 109.329 -1.508 . . . . 1.3 109.329 -179.999 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 357' ' ' LYS . . . . . . . . . . . . . 36.2 mmtt -87.25 140.35 29.63 Favored 'General case' 0 N--CA 1.488 1.457 0 O-C-N 121.342 -1.093 . . . . 4.1 109.054 179.667 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 358' ' ' GLU . . . . . . . . . . . . . 1.8 mt-10 -47.6 150.25 1.82 Allowed Pre-proline 0 N--CA 1.488 1.473 0 O-C-N 121.212 -0.93 . . . . 5.75 109.364 -179.831 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 359' ' ' PRO . . . . . . . . . . . . . 2.0 Cg_endo -61.8 -159.63 0.03 OUTLIER 'Trans proline' 0 C--N 1.31 -1.463 0 C-N-CA 122.241 1.96 . . . . 5.0 110.373 -179.739 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 360' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.202 0 CA-C-O 118.0 -1.444 . . . . 6.97 109.503 179.963 . . . . . . . . 0 0 . 1 . 034 nuclear nobuild full ' B' B ' 319' ' ' LYS . . . . . 0.447 ' O ' ' HG2' ' B' ' 321' ' ' LYS . 9.4 mmtt . . . . . 0 N--CA 1.489 1.475 0 CA-C-O 121.241 0.543 . . . . 7.55 109.663 . . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' B' B ' 320' ' ' LYS . . . . . 0.447 ' CB ' ' O ' ' B' ' 319' ' ' LYS . 0.1 OUTLIER 72.19 8.31 5.85 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.314 -0.866 . . . . 6.44 109.747 -179.906 . . . . . . . . 3 3 . 1 . 034 nuclear nobuild full ' B' B ' 321' ' ' LYS . . . . . 0.513 ' N ' ' HD3' ' B' ' 322' ' ' PRO . 0.3 OUTLIER -158.41 61.6 2.08 Favored Pre-proline 0 N--CA 1.49 1.528 0 O-C-N 121.234 -0.916 . . . . 6.13 109.386 179.609 . . . . . . . . 3 3 . 1 . 034 nuclear nobuild full ' B' B ' 322' ' ' PRO . . . . . 0.513 ' HD3' ' N ' ' B' ' 321' ' ' LYS . 2.1 Cg_endo -62.33 93.01 0.13 Allowed 'Trans proline' 0 C--N 1.311 -1.446 0 C-N-CA 122.213 1.942 . . . . 2.82 110.373 -179.974 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' B' B ' 323' ' ' LEU . . . . . 0.432 ' HA ' HD23 ' B' ' 323' ' ' LEU . 88.2 mt -82.47 73.16 9.52 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.258 -0.901 . . . . 2.84 109.421 179.853 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' B' B ' 324' ' ' ASP . . . . . 0.457 ' HB2' ' OH ' ' B' ' 327' ' ' TYR . 4.7 m-20 -80.89 178.49 8.37 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.191 -0.943 . . . . 1.53 109.29 179.809 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' B' B ' 325' ' ' GLY . . . . . . . . . . . . . . . -70.91 -153.92 1.28 Allowed Glycine 0 N--CA 1.49 2.246 0 N-CA-C 109.445 -1.462 . . . . 0.59 109.445 179.853 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' B' B ' 326' ' ' GLU . . . . . . . . . . . . . 4.4 mt-10 -58.6 -167.01 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.482 0 O-C-N 121.253 -1.145 . . . . 2.13 109.497 179.936 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' B' B ' 327' ' ' TYR . . . . . 0.457 ' OH ' ' HB2' ' B' ' 324' ' ' ASP . 39.3 m-85 -148.92 109.73 4.28 Favored 'General case' 0 N--CA 1.489 1.49 0 O-C-N 121.353 -0.842 . . . . 0.48 109.51 179.854 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' B' B ' 328' ' ' PHE . . . . . 0.403 ' O ' HG23 ' B' ' 329' ' ' THR . 87.8 m-85 -113.61 -169.25 1.47 Allowed 'General case' 0 C--N 1.301 -1.522 0 O-C-N 121.305 -0.872 . . . . 0.32 108.965 179.748 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' B' B ' 329' ' ' THR . . . . . 0.403 HG23 ' O ' ' B' ' 328' ' ' PHE . 23.8 p -153.37 169.1 23.94 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.072 -1.017 . . . . 0.23 109.728 -179.776 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' B' B ' 330' ' ' LEU . . . . . 0.606 HD11 HD22 ' D' ' 345' ' ' ASN . 17.2 tp -150.61 126.89 10.64 Favored 'General case' 0 N--CA 1.488 1.452 0 O-C-N 121.262 -0.899 . . . . 0.28 109.592 -179.768 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' B' B ' 331' ' ' GLN . . . . . 0.439 ' OE1' ' O ' ' D' ' 328' ' ' PHE . 3.7 tp-100 -87.2 120.07 28.1 Favored 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.253 -0.904 . . . . 0.91 109.378 179.876 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' B' B ' 332' ' ' ILE . . . . . 0.615 HG21 ' HA ' ' B' ' 338' ' ' PHE . 97.9 mt -103.56 107.92 23.31 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.564 0 O-C-N 121.136 -0.978 . . . . 0.24 109.433 179.867 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' B' B ' 333' ' ' ARG . . . . . 0.454 ' CG ' HH11 ' B' ' 333' ' ' ARG . 1.4 mtt-85 -72.2 131.67 43.07 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.267 -0.896 . . . . 2.93 109.439 -179.979 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' B' B ' 334' ' ' GLY . . . . . . . . . . . . . . . 88.18 138.58 6.17 Favored Glycine 0 N--CA 1.49 2.27 0 N-CA-C 109.749 -1.341 . . . . 0.4 109.749 179.704 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' B' B ' 335' ' ' ARG . . . . . 0.445 ' O ' ' HB3' ' B' ' 338' ' ' PHE . 39.1 ttt180 -79.88 -28.85 39.87 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.313 -1.11 . . . . 3.01 109.655 179.991 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' B' B ' 336' ' ' GLU . . . . . . . . . . . . . 39.3 mt-10 -56.74 -61.77 2.2 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.309 -0.869 . . . . 2.28 109.811 -179.67 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' B' B ' 337' ' ' ARG . . . . . 0.497 ' HG2' ' NH1' ' B' ' 337' ' ' ARG . 0.0 OUTLIER -60.54 -27.06 67.36 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.314 -0.866 . . . . 2.93 109.602 -179.8 . . . . . . . . 3 3 . 1 . 034 nuclear nobuild full ' B' B ' 338' ' ' PHE . . . . . 0.615 ' HA ' HG21 ' B' ' 332' ' ' ILE . 91.4 t80 -56.11 -53.64 54.61 Favored 'General case' 0 C--N 1.303 -1.418 0 O-C-N 121.199 -0.938 . . . . 0.37 110.045 -179.623 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' B' B ' 339' ' ' GLU . . . . . . . . . . . . . 7.0 mt-10 -54.75 -39.46 68.34 Favored 'General case' 0 N--CA 1.494 1.769 0 O-C-N 121.073 -1.017 . . . . 1.98 110.679 -179.459 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' B' B ' 340' ' ' MET . . . . . . . . . . . . . 30.5 ttp -64.12 -53.47 49.03 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 120.946 -1.096 . . . . 0.32 110.89 -178.845 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' B' B ' 341' ' ' PHE . . . . . 0.446 ' CZ ' ' HA ' ' D' ' 345' ' ' ASN . 56.2 m-85 -60.72 -48.15 83.1 Favored 'General case' 0 N--CA 1.494 1.725 0 O-C-N 120.96 -1.087 . . . . 0.18 110.412 -178.983 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' B' B ' 342' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -49.58 -43.85 46.48 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.137 -0.977 . . . . 2.42 110.124 -179.579 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' B' B ' 343' ' ' GLU . . . . . . . . . . . . . 2.1 tp10 -57.99 -42.46 85.19 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.178 -0.951 . . . . 2.35 109.607 -179.665 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' B' B ' 344' ' ' LEU . . . . . . . . . . . . . 46.5 mt -63.5 -47.06 83.27 Favored 'General case' 0 N--CA 1.488 1.473 0 O-C-N 121.306 -0.871 . . . . 0.18 109.931 -179.722 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' B' B ' 345' ' ' ASN . . . . . 0.582 ' HB2' HD21 ' D' ' 330' ' ' LEU . 40.2 t-20 -55.06 -47.95 74.14 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.123 -0.986 . . . . 1.09 109.679 -179.615 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' B' B ' 346' ' ' GLU . . . . . . . . . . . . . 56.3 tt0 -61.99 -35.86 79.77 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.118 -0.989 . . . . 1.66 109.661 -179.863 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' B' B ' 347' ' ' ALA . . . . . 0.689 ' HB1' ' HB1' ' A' ' 347' ' ' ALA . . . -59.93 -55.37 34.88 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.293 -0.879 . . . . 0.17 110.184 -179.478 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' B' B ' 348' ' ' LEU . . . . . 0.576 HD22 ' N ' ' B' ' 348' ' ' LEU . 3.8 mm? -60.72 -41.0 94.38 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.214 -0.929 . . . . 0.29 109.678 -179.595 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' B' B ' 349' ' ' GLU . . . . . . . . . . . . . 86.8 mt-10 -59.05 -33.07 70.34 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.269 -0.894 . . . . 1.95 109.75 -179.729 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' B' B ' 350' ' ' LEU . . . . . 0.616 ' O ' HD23 ' B' ' 350' ' ' LEU . 5.3 tt -63.67 -48.97 75.02 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.192 -0.942 . . . . 0.45 109.286 179.882 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' B' B ' 351' ' ' LYS . . . . . . . . . . . . . 6.2 ttmm -58.5 -44.76 89.56 Favored 'General case' 0 N--CA 1.489 1.483 0 O-C-N 121.309 -0.869 . . . . 1.38 109.254 179.894 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' B' B ' 352' ' ' ASP . . . . . . . . . . . . . 16.6 m-20 -57.18 -43.04 82.26 Favored 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.305 -0.872 . . . . 1.16 109.549 179.956 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' B' B ' 353' ' ' ALA . . . . . . . . . . . . . . . -67.32 -21.92 65.64 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.228 -0.92 . . . . 0.61 109.585 -179.776 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' B' B ' 354' ' ' GLN . . . . . 0.497 ' NE2' HD11 ' A' ' 350' ' ' LEU . 0.0 OUTLIER -82.49 -10.96 58.8 Favored 'General case' 0 N--CA 1.488 1.471 0 O-C-N 121.246 -0.909 . . . . 1.45 109.52 179.913 . . . . . . . . 3 3 . 1 . 034 nuclear nobuild full ' B' B ' 355' ' ' ALA . . . . . . . . . . . . . . . -72.66 -9.36 58.52 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.179 -0.951 . . . . 0.98 109.415 179.814 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' B' B ' 356' ' ' GLY . . . . . . . . . . . . . . . -81.05 -29.11 42.75 Favored Glycine 0 N--CA 1.492 2.37 0 N-CA-C 109.206 -1.557 . . . . 1.29 109.206 179.956 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' B' B ' 357' ' ' LYS . . . . . . . . . . . . . 34.9 mmtt -87.26 139.82 30.17 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.349 -1.089 . . . . 4.09 109.039 179.658 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' B' B ' 358' ' ' GLU . . . . . . . . . . . . . 2.0 mt-10 -47.03 150.64 1.31 Allowed Pre-proline 0 N--CA 1.491 1.617 0 O-C-N 121.227 -0.92 . . . . 5.72 109.301 -179.772 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' B' B ' 359' ' ' PRO . . . . . . . . . . . . . 2.1 Cg_endo -62.03 -159.5 0.03 OUTLIER 'Trans proline' 0 C--N 1.309 -1.515 0 C-N-CA 122.278 1.985 . . . . 4.98 110.214 -179.935 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' B' B ' 360' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.238 0 CA-C-O 118.001 -1.444 . . . . 6.98 109.568 179.96 . . . . . . . . 0 0 . 1 . 034 nuclear nobuild full ' C' C ' 319' ' ' LYS . . . . . . . . . . . . . 2.8 mmpp? . . . . . 0 N--CA 1.49 1.537 0 CA-C-O 121.32 0.581 . . . . 6.82 109.526 . . . . . . . . . 0 0 . 1 . 034 nuclear nobuild full ' C' C ' 320' ' ' LYS . . . . . . . . . . . . . 2.2 ttpt 58.13 92.94 0.03 OUTLIER 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.252 -0.905 . . . . 6.49 109.52 -179.801 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' C' C ' 321' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -158.51 125.16 2.53 Favored Pre-proline 0 N--CA 1.49 1.534 0 O-C-N 121.307 -0.87 . . . . 6.4 109.189 179.952 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' C' C ' 322' ' ' PRO . . . . . . . . . . . . . 2.9 Cg_endo -61.52 106.5 0.42 Allowed 'Trans proline' 0 C--N 1.313 -1.324 0 C-N-CA 121.89 1.727 . . . . 3.42 109.997 -179.967 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' C' C ' 323' ' ' LEU . . . . . 0.471 ' HA ' HD23 ' C' ' 323' ' ' LEU . 38.6 mt -85.44 -72.19 0.5 Allowed 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.344 -0.848 . . . . 3.95 110.159 -179.682 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' C' C ' 324' ' ' ASP . . . . . 0.468 ' OD2' ' HD2' ' A' ' 333' ' ' ARG . 87.7 m-20 -76.11 179.5 5.62 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.245 -0.909 . . . . 1.63 109.769 -179.277 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' C' C ' 325' ' ' GLY . . . . . . . . . . . . . . . -70.28 -150.46 0.57 Allowed Glycine 0 N--CA 1.49 2.235 0 N-CA-C 110.032 -1.227 . . . . 0.73 110.032 -179.649 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' C' C ' 326' ' ' GLU . . . . . . . . . . . . . 10.3 mt-10 -59.16 -165.07 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.453 -1.028 . . . . 2.17 110.134 -179.672 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' C' C ' 327' ' ' TYR . . . . . 0.488 ' CE2' ' HG2' ' A' ' 333' ' ' ARG . 40.3 m-85 -148.03 116.5 6.61 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.482 -0.761 . . . . 0.48 109.248 -179.945 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' C' C ' 328' ' ' PHE . . . . . 0.449 ' O ' ' OE1' ' A' ' 331' ' ' GLN . 72.1 m-85 -113.29 -170.15 1.63 Allowed 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.176 -0.952 . . . . 0.33 109.49 -179.889 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' C' C ' 329' ' ' THR . . . . . 0.428 ' HA ' ' O ' ' A' ' 330' ' ' LEU . 17.8 p -152.66 168.22 26.36 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.266 -0.896 . . . . 0.23 109.483 -179.913 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' C' C ' 330' ' ' LEU . . . . . 0.642 HD21 ' HB2' ' A' ' 345' ' ' ASN . 16.5 tp -150.99 125.42 9.49 Favored 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.25 -0.906 . . . . 0.28 109.567 -179.677 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' C' C ' 331' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -88.91 113.16 24.15 Favored 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.224 -0.923 . . . . 1.48 109.522 179.965 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' C' C ' 332' ' ' ILE . . . . . 0.559 HD13 ' CD2' ' C' ' 341' ' ' PHE . 42.0 mt -104.12 113.9 42.29 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.631 0 O-C-N 121.171 -0.955 . . . . 0.24 109.589 179.73 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' C' C ' 333' ' ' ARG . . . . . 0.55 ' HG3' ' CE1' ' A' ' 327' ' ' TYR . 0.1 OUTLIER -73.59 144.18 46.1 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.195 -0.941 . . . . 2.74 109.586 179.868 . . . . . . . . 3 3 . 1 . 034 nuclear nobuild full ' C' C ' 334' ' ' GLY . . . . . . . . . . . . . . . 88.11 135.74 5.07 Favored Glycine 0 N--CA 1.493 2.465 0 N-CA-C 110.033 -1.227 . . . . 0.35 110.033 179.629 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' C' C ' 335' ' ' ARG . . . . . 0.454 ' O ' ' HB3' ' C' ' 338' ' ' PHE . 13.2 ttm180 -80.44 -41.49 24.38 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.384 -1.068 . . . . 2.53 109.704 179.938 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' C' C ' 336' ' ' GLU . . . . . . . . . . . . . 4.2 mt-10 -56.46 -53.7 54.38 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.245 -0.91 . . . . 2.62 109.5 -179.778 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' C' C ' 337' ' ' ARG . . . . . 0.426 HH11 ' HG3' ' C' ' 337' ' ' ARG . 0.1 OUTLIER -60.24 -33.61 72.52 Favored 'General case' 0 N--CA 1.489 1.499 0 O-C-N 121.149 -0.969 . . . . 2.81 109.128 179.782 . . . . . . . . 3 3 . 1 . 034 nuclear nobuild full ' C' C ' 338' ' ' PHE . . . . . 0.454 ' HB3' ' O ' ' C' ' 335' ' ' ARG . 86.6 t80 -56.33 -55.39 34.04 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.418 -0.801 . . . . 0.4 109.768 179.839 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' C' C ' 339' ' ' GLU . . . . . . . . . . . . . 47.6 mt-10 -50.13 -35.99 28.07 Favored 'General case' 0 N--CA 1.494 1.748 0 O-C-N 121.255 -0.903 . . . . 2.05 110.131 -179.75 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' C' C ' 340' ' ' MET . . . . . . . . . . . . . 37.0 ttp -63.98 -52.41 59.75 Favored 'General case' 0 N--CA 1.493 1.717 0 O-C-N 121.199 -0.938 . . . . 0.32 110.608 -179.153 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' C' C ' 341' ' ' PHE . . . . . 0.559 ' CD2' HD13 ' C' ' 332' ' ' ILE . 50.3 m-85 -61.73 -44.38 97.02 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.216 -0.928 . . . . 0.18 110.509 -178.976 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' C' C ' 342' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -50.39 -43.25 54.46 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 120.99 -1.069 . . . . 2.91 110.285 -179.491 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' C' C ' 343' ' ' GLU . . . . . . . . . . . . . 80.1 tt0 -59.07 -45.55 90.54 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.121 -0.987 . . . . 2.14 110.057 -179.388 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' C' C ' 344' ' ' LEU . . . . . . . . . . . . . 65.2 mt -62.87 -43.97 97.38 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.155 -0.966 . . . . 0.22 110.125 -179.502 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' C' C ' 345' ' ' ASN . . . . . 0.551 ' HA ' ' CZ ' ' A' ' 341' ' ' PHE . 64.6 t-20 -57.03 -51.23 70.1 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.171 -0.956 . . . . 1.08 109.868 -179.518 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' C' C ' 346' ' ' GLU . . . . . . . . . . . . . 10.8 tt0 -60.53 -30.52 69.8 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.089 -1.007 . . . . 2.21 109.431 -179.875 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' C' C ' 347' ' ' ALA . . . . . 0.824 ' HB1' ' HB1' ' D' ' 347' ' ' ALA . . . -60.23 -58.07 10.1 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.282 -0.886 . . . . 0.18 109.981 -179.946 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' C' C ' 348' ' ' LEU . . . . . 0.634 HD22 ' N ' ' C' ' 348' ' ' LEU . 4.0 mm? -61.66 -40.86 96.44 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.21 -0.931 . . . . 0.32 109.659 -179.7 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' C' C ' 349' ' ' GLU . . . . . . . . . . . . . 53.3 mm-40 -56.99 -36.11 70.0 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.223 -0.923 . . . . 2.19 109.552 -179.878 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' C' C ' 350' ' ' LEU . . . . . 0.783 HD13 HD22 ' D' ' 350' ' ' LEU . 4.5 tt -63.05 -47.1 84.43 Favored 'General case' 0 N--CA 1.488 1.46 0 O-C-N 121.236 -0.915 . . . . 0.46 109.227 179.996 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' C' C ' 351' ' ' LYS . . . . . . . . . . . . . 16.8 tttm -59.66 -42.11 92.09 Favored 'General case' 0 N--CA 1.49 1.525 0 O-C-N 121.211 -0.93 . . . . 1.35 109.547 179.879 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' C' C ' 352' ' ' ASP . . . . . . . . . . . . . 86.2 m-20 -56.13 -38.34 70.68 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.272 -0.893 . . . . 1.19 109.655 -179.941 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' C' C ' 353' ' ' ALA . . . . . . . . . . . . . . . -65.96 -29.68 70.13 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.24 -0.912 . . . . 0.57 109.613 -179.645 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' C' C ' 354' ' ' GLN . . . . . 0.558 ' NE2' HD11 ' D' ' 350' ' ' LEU . 13.4 mt-30 -82.76 -9.92 59.12 Favored 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.033 -1.042 . . . . 1.47 109.348 179.75 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' C' C ' 355' ' ' ALA . . . . . . . . . . . . . . . -72.29 -2.21 18.21 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.329 -0.857 . . . . 0.93 109.671 179.979 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' C' C ' 356' ' ' GLY . . . . . . . . . . . . . . . -71.96 -2.92 54.26 Favored Glycine 0 N--CA 1.49 2.26 0 N-CA-C 109.677 -1.369 . . . . 1.33 109.677 -179.903 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' C' C ' 357' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -87.62 122.66 31.6 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.308 -1.113 . . . . 4.01 109.381 179.825 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' C' C ' 358' ' ' GLU . . . . . . . . . . . . . 8.8 pt-20 -49.6 150.05 3.82 Favored Pre-proline 0 N--CA 1.489 1.518 0 O-C-N 121.188 -0.945 . . . . 5.75 109.325 179.878 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' C' C ' 359' ' ' PRO . . . . . . . . . . . . . 2.3 Cg_endo -62.1 -174.97 0.16 Allowed 'Trans proline' 0 C--N 1.308 -1.562 0 C-N-CA 122.15 1.9 . . . . 4.94 110.126 179.931 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' C' C ' 360' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.3 0 CA-C-O 117.885 -1.508 . . . . 6.5 109.501 179.91 . . . . . . . . 0 0 . 1 . 034 nuclear nobuild full ' D' D ' 319' ' ' LYS . . . . . 0.464 ' O ' ' HG2' ' D' ' 321' ' ' LYS . 9.1 mmtt . . . . . 0 N--CA 1.49 1.549 0 CA-C-O 121.411 0.624 . . . . 7.53 109.512 . . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' D' D ' 320' ' ' LYS . . . . . 0.44 ' CB ' ' O ' ' D' ' 319' ' ' LYS . 0.1 OUTLIER 71.78 8.39 6.08 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.199 -0.938 . . . . 6.41 109.74 179.97 . . . . . . . . 3 3 . 1 . 034 nuclear nobuild full ' D' D ' 321' ' ' LYS . . . . . 0.52 ' N ' ' HD3' ' D' ' 322' ' ' PRO . 0.4 OUTLIER -158.42 61.36 2.01 Favored Pre-proline 0 N--CA 1.491 1.61 0 O-C-N 121.134 -0.979 . . . . 6.11 109.432 179.667 . . . . . . . . 3 3 . 1 . 034 nuclear nobuild full ' D' D ' 322' ' ' PRO . . . . . 0.52 ' HD3' ' N ' ' D' ' 321' ' ' LYS . 2.0 Cg_endo -62.34 92.33 0.13 Allowed 'Trans proline' 0 C--N 1.311 -1.401 0 C-N-CA 122.32 2.014 . . . . 2.82 110.592 -179.829 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' D' D ' 323' ' ' LEU . . . . . . . . . . . . . 91.2 mt -82.01 72.64 9.07 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.261 -0.899 . . . . 2.83 109.671 179.933 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' D' D ' 324' ' ' ASP . . . . . 0.464 ' HB2' ' OH ' ' D' ' 327' ' ' TYR . 4.7 m-20 -80.62 178.13 8.55 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.156 -0.965 . . . . 1.54 109.332 179.81 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' D' D ' 325' ' ' GLY . . . . . . . . . . . . . . . -70.21 -153.91 1.05 Allowed Glycine 0 N--CA 1.49 2.258 0 N-CA-C 109.397 -1.481 . . . . 0.59 109.397 179.889 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' D' D ' 326' ' ' GLU . . . . . . . . . . . . . 4.7 mt-10 -58.85 -167.01 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.5 0 O-C-N 121.239 -1.153 . . . . 2.13 109.468 179.931 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' D' D ' 327' ' ' TYR . . . . . 0.464 ' OH ' ' HB2' ' D' ' 324' ' ' ASP . 39.0 m-85 -148.75 109.66 4.29 Favored 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.406 -0.809 . . . . 0.47 109.612 179.919 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' D' D ' 328' ' ' PHE . . . . . 0.439 ' O ' ' OE1' ' B' ' 331' ' ' GLN . 88.1 m-85 -113.56 -169.77 1.57 Allowed 'General case' 0 N--CA 1.488 1.467 0 O-C-N 121.268 -0.895 . . . . 0.3 109.055 179.76 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' D' D ' 329' ' ' THR . . . . . 0.441 ' HA ' ' O ' ' B' ' 330' ' ' LEU . 23.8 p -153.0 169.2 23.48 Favored 'General case' 0 N--CA 1.489 1.486 0 O-C-N 121.122 -0.986 . . . . 0.22 109.555 -179.845 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' D' D ' 330' ' ' LEU . . . . . 0.582 HD21 ' HB2' ' B' ' 345' ' ' ASN . 17.4 tp -150.72 127.09 10.68 Favored 'General case' 0 N--CA 1.488 1.457 0 O-C-N 121.297 -0.877 . . . . 0.28 109.427 -179.737 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' D' D ' 331' ' ' GLN . . . . . . . . . . . . . 3.6 tp-100 -87.42 120.12 28.39 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.266 -0.897 . . . . 0.93 109.377 179.862 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' D' D ' 332' ' ' ILE . . . . . 0.625 HG21 ' HA ' ' D' ' 338' ' ' PHE . 97.9 mt -103.36 108.59 24.79 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.566 0 O-C-N 121.184 -0.947 . . . . 0.25 109.354 179.814 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' D' D ' 333' ' ' ARG . . . . . 0.441 HH11 ' CG ' ' D' ' 333' ' ' ARG . 1.5 mtt-85 -72.76 131.81 42.81 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.229 -0.919 . . . . 2.93 109.488 -179.953 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' D' D ' 334' ' ' GLY . . . . . . . . . . . . . . . 88.05 138.9 6.23 Favored Glycine 0 N--CA 1.491 2.314 0 N-CA-C 109.648 -1.381 . . . . 0.41 109.648 179.741 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' D' D ' 335' ' ' ARG . . . . . 0.446 ' O ' ' HB3' ' D' ' 338' ' ' PHE . 40.7 ttt180 -80.12 -29.08 38.89 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.284 -1.127 . . . . 3.03 109.594 -179.906 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' D' D ' 336' ' ' GLU . . . . . . . . . . . . . 41.1 mt-10 -56.41 -62.29 1.82 Allowed 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.306 -0.871 . . . . 2.26 109.78 -179.715 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' D' D ' 337' ' ' ARG . . . . . 0.465 ' NH1' ' HG2' ' D' ' 337' ' ' ARG . 0.0 OUTLIER -59.92 -27.23 66.59 Favored 'General case' 0 N--CA 1.489 1.501 0 O-C-N 121.238 -0.914 . . . . 2.92 109.68 -179.813 . . . . . . . . 3 3 . 1 . 034 nuclear nobuild full ' D' D ' 338' ' ' PHE . . . . . 0.625 ' HA ' HG21 ' D' ' 332' ' ' ILE . 91.5 t80 -55.81 -54.26 46.68 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.175 -0.953 . . . . 0.37 109.923 -179.749 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' D' D ' 339' ' ' GLU . . . . . . . . . . . . . 6.9 mt-10 -54.04 -39.6 66.35 Favored 'General case' 0 N--CA 1.494 1.759 0 O-C-N 121.095 -1.003 . . . . 1.99 110.68 -179.345 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' D' D ' 340' ' ' MET . . . . . . . . . . . . . 30.0 ttp -64.43 -53.16 52.8 Favored 'General case' 0 N--CA 1.495 1.785 0 O-C-N 121.061 -1.025 . . . . 0.31 110.862 -178.703 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' D' D ' 341' ' ' PHE . . . . . 0.563 ' CZ ' ' HA ' ' B' ' 345' ' ' ASN . 56.8 m-85 -60.83 -48.43 81.82 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 120.958 -1.089 . . . . 0.18 110.364 -179.084 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' D' D ' 342' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -49.28 -44.06 43.64 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.155 -0.965 . . . . 2.41 110.054 -179.58 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' D' D ' 343' ' ' GLU . . . . . . . . . . . . . 2.1 tp10 -57.88 -42.5 84.72 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.101 -0.999 . . . . 2.35 109.652 -179.657 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' D' D ' 344' ' ' LEU . . . . . . . . . . . . . 46.4 mt -63.31 -46.97 84.23 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.199 -0.938 . . . . 0.19 109.984 -179.878 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' D' D ' 345' ' ' ASN . . . . . 0.606 HD22 HD11 ' B' ' 330' ' ' LEU . 40.5 t-20 -55.14 -48.31 73.87 Favored 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.174 -0.954 . . . . 1.09 109.672 -179.48 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' D' D ' 346' ' ' GLU . . . . . . . . . . . . . 56.2 tt0 -61.69 -36.0 79.63 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.088 -1.007 . . . . 1.69 109.681 179.997 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' D' D ' 347' ' ' ALA . . . . . 0.824 ' HB1' ' HB1' ' C' ' 347' ' ' ALA . . . -59.84 -55.79 29.85 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.185 -0.947 . . . . 0.18 110.044 -179.499 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' D' D ' 348' ' ' LEU . . . . . 0.569 HD22 ' N ' ' D' ' 348' ' ' LEU . 3.8 mm? -60.1 -41.24 92.11 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.304 -0.873 . . . . 0.31 109.69 -179.645 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' D' D ' 349' ' ' GLU . . . . . . . . . . . . . 84.6 mt-10 -59.07 -32.99 70.28 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.178 -0.952 . . . . 1.95 109.877 -179.652 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' D' D ' 350' ' ' LEU . . . . . 0.783 HD22 HD13 ' C' ' 350' ' ' LEU . 5.2 tt -63.69 -48.86 75.42 Favored 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.148 -0.97 . . . . 0.43 109.184 179.875 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' D' D ' 351' ' ' LYS . . . . . . . . . . . . . 6.0 ttmm -58.67 -44.67 90.25 Favored 'General case' 0 N--CA 1.488 1.431 0 O-C-N 121.347 -0.846 . . . . 1.4 109.378 179.881 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' D' D ' 352' ' ' ASP . . . . . . . . . . . . . 20.0 m-20 -57.26 -42.81 82.26 Favored 'General case' 0 N--CA 1.488 1.438 0 O-C-N 121.293 -0.88 . . . . 1.17 109.566 179.859 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' D' D ' 353' ' ' ALA . . . . . . . . . . . . . . . -67.58 -21.49 65.43 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.28 -0.888 . . . . 0.59 109.768 -179.739 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' D' D ' 354' ' ' GLN . . . . . 0.521 ' NE2' HD11 ' C' ' 350' ' ' LEU . 0.0 OUTLIER -82.68 -11.09 58.61 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.229 -0.919 . . . . 1.44 109.31 179.961 . . . . . . . . 3 3 . 1 . 034 nuclear nobuild full ' D' D ' 355' ' ' ALA . . . . . . . . . . . . . . . -72.16 -9.97 59.16 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.256 -0.902 . . . . 0.98 109.51 179.819 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' D' D ' 356' ' ' GLY . . . . . . . . . . . . . . . -80.75 -29.27 43.59 Favored Glycine 0 N--CA 1.49 2.281 0 N-CA-C 109.321 -1.512 . . . . 1.28 109.321 179.848 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' D' D ' 357' ' ' LYS . . . . . . . . . . . . . 34.4 mmtt -87.14 140.48 29.5 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.21 -1.171 . . . . 4.09 108.982 179.62 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' D' D ' 358' ' ' GLU . . . . . . . . . . . . . 2.0 mt-10 -47.7 150.41 1.84 Allowed Pre-proline 0 N--CA 1.489 1.502 0 O-C-N 121.155 -0.966 . . . . 5.71 109.507 -179.849 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' D' D ' 359' ' ' PRO . . . . . . . . . . . . . 2.1 Cg_endo -62.02 -159.32 0.03 OUTLIER 'Trans proline' 0 C--N 1.31 -1.497 0 C-N-CA 122.185 1.923 . . . . 4.97 110.298 -179.805 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' D' D ' 360' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.248 0 N-CA-C 109.469 -1.452 . . . . 6.97 109.469 -179.988 . . . . . . . . 0 0 . 1 . 035 nuclear nobuild full ' A' A ' 319' ' ' LYS . . . . . 0.465 ' O ' ' O ' ' A' ' 320' ' ' LYS . 18.9 ttpt . . . . . 0 N--CA 1.491 1.599 0 N-CA-C 109.448 -0.575 . . . . 7.55 109.448 . . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 320' ' ' LYS . . . . . 0.465 ' O ' ' O ' ' A' ' 319' ' ' LYS . 13.7 mttp 58.46 114.02 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.331 -0.856 . . . . 6.43 109.353 179.984 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' A' A ' 321' ' ' LYS . . . . . 0.587 ' CB ' ' HD3' ' A' ' 322' ' ' PRO . 0.0 OUTLIER -160.54 -64.66 0.02 OUTLIER Pre-proline 0 N--CA 1.492 1.628 0 O-C-N 121.314 -0.866 . . . . 6.13 109.708 179.832 . . . . . . . . 3 3 . 1 . 035 nuclear nobuild full ' A' A ' 322' ' ' PRO . . . . . 0.587 ' HD3' ' CB ' ' A' ' 321' ' ' LYS . 6.1 Cg_exo -54.59 174.26 0.2 Allowed 'Trans proline' 0 C--N 1.313 -1.316 0 C-N-CA 121.512 1.474 . . . . 2.83 110.028 179.672 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' A' A ' 323' ' ' LEU . . . . . . . . . . . . . 51.2 mt -79.19 142.47 36.27 Favored 'General case' 0 N--CA 1.489 1.499 0 O-C-N 121.202 -0.936 . . . . 2.83 109.609 -179.804 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 324' ' ' ASP . . . . . . . . . . . . . 69.7 m-20 -79.06 161.38 26.6 Favored 'General case' 0 N--CA 1.488 1.471 0 O-C-N 121.271 -0.893 . . . . 1.53 109.195 -179.968 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 325' ' ' GLY . . . . . . . . . . . . . . . -67.78 174.79 28.11 Favored Glycine 0 N--CA 1.489 2.213 0 N-CA-C 109.367 -1.493 . . . . 0.61 109.367 -179.884 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 326' ' ' GLU . . . . . . . . . . . . . 2.1 mt-10 -57.36 -176.34 0.02 OUTLIER 'General case' 0 N--CA 1.489 1.5 0 O-C-N 121.225 -1.162 . . . . 2.13 109.424 -179.92 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 327' ' ' TYR . . . . . . . . . . . . . 48.1 m-85 -148.87 109.06 4.11 Favored 'General case' 0 C--N 1.303 -1.415 0 O-C-N 121.259 -0.901 . . . . 0.48 109.413 179.989 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 328' ' ' PHE . . . . . 0.519 ' CZ ' ' HG3' ' C' ' 335' ' ' ARG . 88.4 m-85 -113.83 -169.01 1.43 Allowed 'General case' 0 N--CA 1.489 1.492 0 O-C-N 121.353 -0.842 . . . . 0.31 109.04 179.873 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' A' A ' 329' ' ' THR . . . . . . . . . . . . . 32.4 p -152.57 168.16 26.5 Favored 'General case' 0 C--N 1.302 -1.49 0 O-C-N 121.142 -0.973 . . . . 0.22 109.311 -179.925 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 330' ' ' LEU . . . . . . . . . . . . . 41.9 tp -149.72 127.69 11.89 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.196 -0.94 . . . . 0.28 109.694 -179.688 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 331' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -88.3 114.65 25.13 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.23 -0.919 . . . . 0.91 109.206 179.661 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' A' A ' 332' ' ' ILE . . . . . 0.651 HD12 ' HD1' ' A' ' 338' ' ' PHE . 23.0 mt -103.32 112.74 37.9 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.57 0 O-C-N 121.194 -0.941 . . . . 0.26 109.524 179.957 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' A' A ' 333' ' ' ARG . . . . . 0.44 ' HG2' ' CE1' ' C' ' 327' ' ' TYR . 2.4 mtt180 -72.5 145.24 47.65 Favored 'General case' 0 N--CA 1.488 1.459 0 O-C-N 121.332 -0.855 . . . . 2.92 109.31 179.918 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' A' A ' 334' ' ' GLY . . . . . . . . . . . . . . . 83.11 127.72 1.23 Allowed Glycine 0 N--CA 1.492 2.387 0 N-CA-C 109.567 -1.413 . . . . 0.4 109.567 179.936 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 335' ' ' ARG . . . . . 0.443 ' CG ' HH11 ' A' ' 335' ' ' ARG . 0.4 OUTLIER -75.01 -35.12 61.99 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.233 -1.157 . . . . 3.01 109.345 -179.965 . . . . . . . . 3 3 . 1 . 035 nuclear nobuild full ' A' A ' 336' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -58.06 -59.29 5.5 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.319 -0.863 . . . . 2.29 109.451 179.98 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' A' A ' 337' ' ' ARG . . . . . 0.668 ' NH2' HD12 ' C' ' 348' ' ' LEU . 6.0 mmt180 -60.72 -31.61 70.9 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.33 -0.856 . . . . 2.93 109.466 179.981 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' A' A ' 338' ' ' PHE . . . . . 0.651 ' HD1' HD12 ' A' ' 332' ' ' ILE . 52.5 t80 -55.43 -55.78 27.72 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.195 -0.94 . . . . 0.38 109.411 179.968 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' A' A ' 339' ' ' GLU . . . . . . . . . . . . . 4.9 mt-10 -52.07 -32.96 37.0 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.318 -0.864 . . . . 1.97 109.952 -179.812 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 340' ' ' MET . . . . . . . . . . . . . 21.8 ttp -63.52 -52.69 60.1 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.242 -0.911 . . . . 0.31 110.041 -179.519 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 341' ' ' PHE . . . . . 0.453 ' HB2' HD13 ' A' ' 332' ' ' ILE . 56.7 m-85 -62.22 -43.11 99.56 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.112 -0.993 . . . . 0.18 110.012 -179.384 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' A' A ' 342' ' ' ARG . . . . . 0.449 ' CG ' HH11 ' A' ' 342' ' ' ARG . 0.0 OUTLIER -50.8 -46.45 59.7 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.299 -0.876 . . . . 2.42 110.023 -179.655 . . . . . . . . 3 3 . 1 . 035 nuclear nobuild full ' A' A ' 343' ' ' GLU . . . . . . . . . . . . . 4.9 tt0 -59.29 -43.55 92.57 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.167 -0.958 . . . . 2.35 109.928 -179.562 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 344' ' ' LEU . . . . . . . . . . . . . 53.2 mt -62.19 -36.61 82.44 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.202 -0.936 . . . . 0.18 109.715 -179.793 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 345' ' ' ASN . . . . . 0.518 ' HB2' HD21 ' C' ' 330' ' ' LEU . 56.7 t-20 -58.47 -55.59 33.1 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.284 -0.885 . . . . 1.09 109.612 -179.787 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' A' A ' 346' ' ' GLU . . . . . . . . . . . . . 3.5 tt0 -60.41 -29.42 68.97 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.281 -0.887 . . . . 1.65 109.575 -179.803 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 347' ' ' ALA . . . . . . . . . . . . . . . -60.77 -59.08 5.95 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.243 -0.911 . . . . 0.18 109.954 179.96 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 348' ' ' LEU . . . . . 0.57 HD22 ' N ' ' A' ' 348' ' ' LEU . 4.0 mm? -61.47 -45.44 94.26 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.265 -0.897 . . . . 0.3 110.026 -179.565 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' A' A ' 349' ' ' GLU . . . . . . . . . . . . . 3.8 mm-40 -55.78 -34.21 65.08 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.166 -0.959 . . . . 1.94 109.439 -179.623 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 350' ' ' LEU . . . . . 0.608 HD11 ' NE2' ' B' ' 354' ' ' GLN . 6.0 tt -63.36 -45.69 90.0 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.223 -0.923 . . . . 0.46 109.086 179.667 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' A' A ' 351' ' ' LYS . . . . . . . . . . . . . 30.4 tttt -59.72 -45.88 90.81 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.382 -0.824 . . . . 1.4 109.692 -179.943 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 352' ' ' ASP . . . . . . . . . . . . . 7.8 m-20 -54.81 -49.85 69.97 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.248 -0.908 . . . . 1.16 109.889 -179.717 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 353' ' ' ALA . . . . . . . . . . . . . . . -67.12 -23.85 65.86 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.192 -0.943 . . . . 0.63 109.681 -179.715 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 354' ' ' GLN . . . . . 0.629 ' NE2' HD11 ' B' ' 350' ' ' LEU . 1.2 tt0 -84.45 -7.78 59.17 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.278 -0.889 . . . . 1.47 109.797 -179.932 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' A' A ' 355' ' ' ALA . . . . . . . . . . . . . . . -71.59 -35.94 70.69 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.158 -0.964 . . . . 1.01 109.79 -179.825 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 356' ' ' GLY . . . . . . . . . . . . . . . -78.47 -2.48 84.62 Favored Glycine 0 N--CA 1.492 2.431 0 N-CA-C 109.662 -1.375 . . . . 1.3 109.662 -179.846 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 357' ' ' LYS . . . . . . . . . . . . . 16.8 mttt -89.16 112.76 23.84 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.188 -1.183 . . . . 4.1 109.642 179.953 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 358' ' ' GLU . . . . . . . . . . . . . 21.8 pt-20 -49.24 154.81 1.34 Allowed Pre-proline 0 N--CA 1.491 1.617 0 O-C-N 121.218 -0.926 . . . . 5.75 109.327 179.779 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 359' ' ' PRO . . . . . . . . . . . . . 2.3 Cg_endo -62.41 140.89 84.78 Favored 'Trans proline' 0 C--N 1.309 -1.523 0 C-N-CA 122.081 1.854 . . . . 5.0 110.131 179.882 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 360' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.285 0 CA-C-O 117.892 -1.505 . . . . 6.97 109.569 179.943 . . . . . . . . 0 0 . 1 . 035 nuclear nobuild full ' B' B ' 319' ' ' LYS . . . . . 0.469 ' O ' ' O ' ' B' ' 320' ' ' LYS . 18.8 ttpt . . . . . 0 N--CA 1.49 1.558 0 CA-C-O 121.259 0.552 . . . . 7.55 109.554 . . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' B' B ' 320' ' ' LYS . . . . . 0.469 ' O ' ' O ' ' B' ' 319' ' ' LYS . 13.8 mttp 58.36 113.84 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.288 -0.883 . . . . 6.44 109.388 179.975 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' B' B ' 321' ' ' LYS . . . . . 0.584 ' CB ' ' HD3' ' B' ' 322' ' ' PRO . 0.0 OUTLIER -160.53 -64.55 0.02 OUTLIER Pre-proline 0 N--CA 1.49 1.572 0 O-C-N 121.313 -0.867 . . . . 6.13 109.843 179.972 . . . . . . . . 3 3 . 1 . 035 nuclear nobuild full ' B' B ' 322' ' ' PRO . . . . . 0.584 ' HD3' ' CB ' ' B' ' 321' ' ' LYS . 6.2 Cg_exo -54.73 174.04 0.22 Allowed 'Trans proline' 0 C--N 1.316 -1.168 0 C-N-CA 121.477 1.451 . . . . 2.82 109.961 179.597 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' B' B ' 323' ' ' LEU . . . . . . . . . . . . . 47.2 mt -79.12 142.37 36.47 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.222 -0.924 . . . . 2.84 109.646 -179.701 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' B' B ' 324' ' ' ASP . . . . . . . . . . . . . 70.2 m-20 -79.06 159.71 27.44 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.294 -0.879 . . . . 1.53 109.477 179.934 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' B' B ' 325' ' ' GLY . . . . . . . . . . . . . . . -65.83 174.43 19.89 Favored Glycine 0 N--CA 1.489 2.167 0 N-CA-C 109.603 -1.399 . . . . 0.59 109.603 179.988 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' B' B ' 326' ' ' GLU . . . . . . . . . . . . . 2.1 mt-10 -57.44 -176.35 0.02 OUTLIER 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.243 -1.151 . . . . 2.13 109.366 179.901 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' B' B ' 327' ' ' TYR . . . . . . . . . . . . . 47.9 m-85 -148.62 108.97 4.13 Favored 'General case' 0 N--CA 1.489 1.481 0 O-C-N 121.199 -0.938 . . . . 0.48 109.427 -179.974 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' B' B ' 328' ' ' PHE . . . . . 0.49 ' CZ ' ' HG3' ' D' ' 335' ' ' ARG . 88.5 m-85 -113.62 -169.07 1.43 Allowed 'General case' 0 N--CA 1.487 1.419 0 O-C-N 121.254 -0.904 . . . . 0.32 109.044 179.897 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' B' B ' 329' ' ' THR . . . . . . . . . . . . . 30.3 p -152.45 168.11 26.56 Favored 'General case' 0 N--CA 1.489 1.494 0 O-C-N 121.217 -0.927 . . . . 0.23 109.325 -179.965 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' B' B ' 330' ' ' LEU . . . . . 0.695 HD11 HD22 ' D' ' 345' ' ' ASN . 39.9 tp -149.78 127.7 11.84 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.24 -0.913 . . . . 0.28 109.656 -179.742 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' B' B ' 331' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -88.43 114.58 25.2 Favored 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.35 -0.844 . . . . 0.91 109.299 179.708 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' B' B ' 332' ' ' ILE . . . . . 0.662 HD12 ' HD1' ' B' ' 338' ' ' PHE . 22.2 mt -103.18 112.57 37.13 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.542 0 O-C-N 121.107 -0.995 . . . . 0.24 109.563 -179.923 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' B' B ' 333' ' ' ARG . . . . . 0.473 ' HG2' ' CE1' ' D' ' 327' ' ' TYR . 2.3 mtt180 -72.19 145.15 48.22 Favored 'General case' 0 N--CA 1.489 1.49 0 O-C-N 121.306 -0.871 . . . . 2.93 109.312 179.86 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' B' B ' 334' ' ' GLY . . . . . . . . . . . . . . . 83.08 127.87 1.24 Allowed Glycine 0 N--CA 1.49 2.269 0 N-CA-C 109.646 -1.382 . . . . 0.4 109.646 -179.999 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' B' B ' 335' ' ' ARG . . . . . 0.437 HH11 ' CG ' ' B' ' 335' ' ' ARG . 0.3 OUTLIER -75.16 -35.38 61.63 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.338 -1.095 . . . . 3.01 109.34 179.935 . . . . . . . . 3 3 . 1 . 035 nuclear nobuild full ' B' B ' 336' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -57.93 -59.15 5.69 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.296 -0.877 . . . . 2.28 109.403 179.941 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' B' B ' 337' ' ' ARG . . . . . 0.58 ' NH2' HD12 ' D' ' 348' ' ' LEU . 6.2 mmt180 -60.86 -31.86 71.3 Favored 'General case' 0 N--CA 1.489 1.495 0 O-C-N 121.337 -0.852 . . . . 2.93 109.434 -179.944 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' B' B ' 338' ' ' PHE . . . . . 0.662 ' HD1' HD12 ' B' ' 332' ' ' ILE . 52.7 t80 -55.14 -55.88 26.17 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.297 -0.877 . . . . 0.37 109.495 179.909 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' B' B ' 339' ' ' GLU . . . . . . . . . . . . . 4.9 mt-10 -51.77 -33.18 34.04 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.316 -0.865 . . . . 1.98 110.019 -179.865 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' B' B ' 340' ' ' MET . . . . . . . . . . . . . 20.9 ttp -63.45 -52.63 60.63 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.198 -0.939 . . . . 0.32 110.113 -179.428 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' B' B ' 341' ' ' PHE . . . . . 0.46 ' CZ ' ' HA ' ' D' ' 345' ' ' ASN . 56.2 m-85 -62.42 -42.99 99.86 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.171 -0.956 . . . . 0.18 109.988 -179.466 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' B' B ' 342' ' ' ARG . . . . . 0.448 ' NH1' ' CG ' ' B' ' 342' ' ' ARG . 0.0 OUTLIER -50.97 -46.51 61.24 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.315 -0.866 . . . . 2.42 110.049 -179.647 . . . . . . . . 3 3 . 1 . 035 nuclear nobuild full ' B' B ' 343' ' ' GLU . . . . . . . . . . . . . 5.1 tt0 -59.23 -43.39 92.35 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.121 -0.987 . . . . 2.35 109.953 -179.696 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' B' B ' 344' ' ' LEU . . . . . . . . . . . . . 55.7 mt -62.31 -36.56 82.51 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.184 -0.948 . . . . 0.18 109.75 -179.774 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' B' B ' 345' ' ' ASN . . . . . 0.601 HD22 HD11 ' D' ' 330' ' ' LEU . 56.9 t-20 -58.61 -55.02 40.4 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.239 -0.913 . . . . 1.09 109.689 -179.838 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' B' B ' 346' ' ' GLU . . . . . . . . . . . . . 3.4 tt0 -60.77 -29.49 69.45 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.354 -0.841 . . . . 1.66 109.574 -179.815 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' B' B ' 347' ' ' ALA . . . . . . . . . . . . . . . -60.88 -58.91 6.43 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.292 -0.88 . . . . 0.17 109.924 -179.896 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' B' B ' 348' ' ' LEU . . . . . 0.761 HD12 ' NH2' ' D' ' 337' ' ' ARG . 4.0 mm? -61.45 -45.93 92.22 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.196 -0.94 . . . . 0.29 109.887 -179.622 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' B' B ' 349' ' ' GLU . . . . . . . . . . . . . 3.9 mm-40 -55.38 -34.23 64.14 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.17 -0.957 . . . . 1.95 109.534 -179.705 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' B' B ' 350' ' ' LEU . . . . . 0.629 HD11 ' NE2' ' A' ' 354' ' ' GLN . 6.1 tt -63.32 -45.77 89.78 Favored 'General case' 0 N--CA 1.488 1.457 0 O-C-N 121.205 -0.934 . . . . 0.45 109.173 179.69 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' B' B ' 351' ' ' LYS . . . . . . . . . . . . . 30.5 tttt -59.79 -45.87 90.98 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.442 -0.786 . . . . 1.38 109.713 -179.967 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' B' B ' 352' ' ' ASP . . . . . . . . . . . . . 7.8 m-20 -54.88 -49.58 70.84 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.22 -0.925 . . . . 1.16 109.84 -179.735 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' B' B ' 353' ' ' ALA . . . . . . . . . . . . . . . -67.32 -24.03 65.7 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.19 -0.943 . . . . 0.61 109.601 -179.749 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' B' B ' 354' ' ' GLN . . . . . 0.608 ' NE2' HD11 ' A' ' 350' ' ' LEU . 1.2 tt0 -84.17 -8.32 59.11 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.233 -0.917 . . . . 1.45 109.779 -179.883 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' B' B ' 355' ' ' ALA . . . . . . . . . . . . . . . -71.3 -35.73 71.4 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.14 -0.975 . . . . 0.98 109.937 -179.779 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' B' B ' 356' ' ' GLY . . . . . . . . . . . . . . . -78.51 -2.66 85.22 Favored Glycine 0 N--CA 1.49 2.284 0 N-CA-C 109.7 -1.36 . . . . 1.29 109.7 -179.888 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' B' B ' 357' ' ' LYS . . . . . . . . . . . . . 16.9 mttt -89.02 112.72 23.71 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.219 -1.165 . . . . 4.09 109.611 -179.922 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' B' B ' 358' ' ' GLU . . . . . . . . . . . . . 22.0 pt-20 -49.26 154.37 1.47 Allowed Pre-proline 0 N--CA 1.491 1.584 0 O-C-N 121.29 -0.881 . . . . 5.72 109.306 179.759 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' B' B ' 359' ' ' PRO . . . . . . . . . . . . . 2.1 Cg_endo -62.29 140.47 83.16 Favored 'Trans proline' 0 C--N 1.309 -1.506 0 C-N-CA 122.07 1.847 . . . . 4.98 110.26 179.989 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' B' B ' 360' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.303 0 N-CA-C 109.418 -1.473 . . . . 6.98 109.418 179.911 . . . . . . . . 0 0 . 1 . 035 nuclear nobuild full ' C' C ' 319' ' ' LYS . . . . . 0.459 ' O ' ' HB2' ' C' ' 320' ' ' LYS . 0.0 OUTLIER . . . . . 0 N--CA 1.49 1.54 0 N-CA-C 109.499 -0.556 . . . . 6.82 109.499 . . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' C' C ' 320' ' ' LYS . . . . . 0.459 ' HB2' ' O ' ' C' ' 319' ' ' LYS . 16.0 mtmm 61.49 151.15 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.235 -0.916 . . . . 6.49 109.657 179.884 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' C' C ' 321' ' ' LYS . . . . . 0.518 ' N ' ' HD3' ' C' ' 322' ' ' PRO . 0.0 OUTLIER -158.22 61.19 2.02 Favored Pre-proline 0 N--CA 1.49 1.54 0 O-C-N 121.251 -0.906 . . . . 6.4 109.273 179.977 . . . . . . . . 3 3 . 1 . 035 nuclear nobuild full ' C' C ' 322' ' ' PRO . . . . . 0.518 ' HD3' ' N ' ' C' ' 321' ' ' LYS . 4.8 Cg_exo -60.1 149.53 84.19 Favored 'Trans proline' 0 C--N 1.309 -1.514 0 C-N-CA 122.225 1.95 . . . . 3.42 110.576 -179.797 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' C' C ' 323' ' ' LEU . . . . . . . . . . . . . 16.4 mt -79.52 177.42 8.88 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.335 -0.853 . . . . 3.95 109.324 179.868 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' C' C ' 324' ' ' ASP . . . . . . . . . . . . . 17.5 m-20 -80.12 146.58 31.79 Favored 'General case' 0 N--CA 1.489 1.492 0 O-C-N 121.308 -0.87 . . . . 1.63 109.475 179.938 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' C' C ' 325' ' ' GLY . . . . . . . . . . . . . . . -68.42 176.9 26.7 Favored Glycine 0 N--CA 1.49 2.27 0 N-CA-C 109.265 -1.534 . . . . 0.73 109.265 179.701 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' C' C ' 326' ' ' GLU . . . . . 0.49 ' HB3' ' CE1' ' C' ' 328' ' ' PHE . 60.7 mm-40 -56.84 179.38 0.04 OUTLIER 'General case' 0 N--CA 1.488 1.451 0 O-C-N 121.137 -1.214 . . . . 2.17 109.204 -179.883 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' C' C ' 327' ' ' TYR . . . . . 0.44 ' CE1' ' HG2' ' A' ' 333' ' ' ARG . 37.0 m-85 -149.22 109.59 4.18 Favored 'General case' 0 C--N 1.302 -1.462 0 O-C-N 121.354 -0.841 . . . . 0.48 109.41 179.94 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' C' C ' 328' ' ' PHE . . . . . 0.49 ' CE1' ' HB3' ' C' ' 326' ' ' GLU . 65.2 m-85 -113.58 -167.72 1.24 Allowed 'General case' 0 N--CA 1.489 1.477 0 O-C-N 121.431 -0.793 . . . . 0.33 109.393 179.969 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' C' C ' 329' ' ' THR . . . . . . . . . . . . . 14.6 p -151.86 168.66 24.43 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.242 -0.911 . . . . 0.23 109.342 -179.865 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' C' C ' 330' ' ' LEU . . . . . 0.518 HD21 ' HB2' ' A' ' 345' ' ' ASN . 30.6 tp -149.48 127.02 11.58 Favored 'General case' 0 C--N 1.303 -1.453 0 O-C-N 121.201 -0.937 . . . . 0.28 109.505 -179.741 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' C' C ' 331' ' ' GLN . . . . . 0.536 ' CG ' ' NH2' ' C' ' 333' ' ' ARG . 6.9 tp-100 -87.23 114.22 23.65 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.312 -0.868 . . . . 1.48 109.46 179.941 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' C' C ' 332' ' ' ILE . . . . . 0.612 HG21 ' HA ' ' C' ' 338' ' ' PHE . 84.7 mt -103.7 110.99 31.7 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.548 0 O-C-N 121.297 -0.877 . . . . 0.24 109.687 179.925 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' C' C ' 333' ' ' ARG . . . . . 0.536 ' NH2' ' CG ' ' C' ' 331' ' ' GLN . 0.0 OUTLIER -72.92 147.3 45.42 Favored 'General case' 0 N--CA 1.488 1.439 0 O-C-N 121.156 -0.965 . . . . 2.74 109.277 179.711 . . . . . . . . 3 3 . 1 . 035 nuclear nobuild full ' C' C ' 334' ' ' GLY . . . . . . . . . . . . . . . 76.65 131.73 0.45 Allowed Glycine 0 N--CA 1.492 2.388 0 N-CA-C 109.632 -1.387 . . . . 0.35 109.632 179.815 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' C' C ' 335' ' ' ARG . . . . . 0.519 ' HG3' ' CZ ' ' A' ' 328' ' ' PHE . 1.1 tmt_? -76.84 -30.51 56.35 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.327 -1.102 . . . . 2.53 109.61 -179.994 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' C' C ' 336' ' ' GLU . . . . . . . . . . . . . 21.2 mt-10 -57.62 -60.08 4.21 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.345 -0.847 . . . . 2.62 109.729 -179.725 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' C' C ' 337' ' ' ARG . . . . . 0.495 ' HD2' ' N ' ' C' ' 337' ' ' ARG . 11.4 mmm180 -59.85 -31.52 69.83 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.305 -0.872 . . . . 2.81 109.609 -179.592 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' C' C ' 338' ' ' PHE . . . . . 0.612 ' HA ' HG21 ' C' ' 332' ' ' ILE . 61.3 t80 -56.12 -56.74 17.21 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.365 -0.834 . . . . 0.4 109.858 -179.724 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' C' C ' 339' ' ' GLU . . . . . . . . . . . . . 3.8 mt-10 -49.45 -38.38 29.45 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.254 -0.904 . . . . 2.05 110.302 -179.462 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' C' C ' 340' ' ' MET . . . . . . . . . . . . . 35.1 ttp -64.61 -47.15 79.68 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.11 -0.994 . . . . 0.32 110.279 -179.396 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' C' C ' 341' ' ' PHE . . . . . 0.458 ' CZ ' ' HA ' ' A' ' 345' ' ' ASN . 38.0 m-85 -62.47 -52.87 61.82 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.173 -0.954 . . . . 0.18 110.139 -179.352 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' C' C ' 342' ' ' ARG . . . . . . . . . . . . . 7.4 tmm_? -46.51 -40.08 11.95 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.267 -0.896 . . . . 2.91 109.718 -179.751 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' C' C ' 343' ' ' GLU . . . . . . . . . . . . . 6.4 tp10 -59.06 -50.2 74.98 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.236 -0.915 . . . . 2.14 109.721 -179.956 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' C' C ' 344' ' ' LEU . . . . . . . . . . . . . 41.0 mt -61.91 -28.36 69.47 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.263 -0.898 . . . . 0.22 109.419 179.992 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' C' C ' 345' ' ' ASN . . . . . 0.5 ' ND2' ' OE2' ' C' ' 349' ' ' GLU . 13.9 t-20 -57.8 -59.64 4.91 Favored 'General case' 0 N--CA 1.489 1.484 0 O-C-N 121.243 -0.911 . . . . 1.08 109.45 179.929 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' C' C ' 346' ' ' GLU . . . . . . . . . . . . . 1.3 tt0 -61.74 -24.23 66.67 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.431 -0.793 . . . . 2.21 109.655 -179.954 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' C' C ' 347' ' ' ALA . . . . . 0.496 ' HB1' ' HB1' ' D' ' 347' ' ' ALA . . . -61.71 -62.8 1.55 Allowed 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.204 -0.935 . . . . 0.18 110.025 -179.76 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' C' C ' 348' ' ' LEU . . . . . 0.668 HD12 ' NH2' ' A' ' 337' ' ' ARG . 3.6 mm? -61.9 -45.0 95.64 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.19 -0.944 . . . . 0.32 110.018 -179.405 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' C' C ' 349' ' ' GLU . . . . . 0.5 ' OE2' ' ND2' ' C' ' 345' ' ' ASN . 3.6 mt-10 -56.37 -34.16 66.4 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.153 -0.967 . . . . 2.19 109.525 -179.629 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' C' C ' 350' ' ' LEU . . . . . 0.637 HD22 HD13 ' D' ' 350' ' ' LEU . 7.4 tt -65.0 -41.29 95.51 Favored 'General case' 0 N--CA 1.489 1.483 0 O-C-N 121.217 -0.927 . . . . 0.46 109.188 179.674 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' C' C ' 351' ' ' LYS . . . . . . . . . . . . . 13.7 tttt -60.3 -48.9 79.78 Favored 'General case' 0 N--CA 1.489 1.501 0 O-C-N 121.353 -0.842 . . . . 1.35 109.621 -179.919 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' C' C ' 352' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -57.23 -44.24 83.58 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.244 -0.91 . . . . 1.19 109.774 -179.902 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' C' C ' 353' ' ' ALA . . . . . . . . . . . . . . . -68.01 -19.28 64.9 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.296 -0.877 . . . . 0.57 109.764 -179.825 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' C' C ' 354' ' ' GLN . . . . . 0.565 ' NE2' HD11 ' D' ' 350' ' ' LEU . 0.2 OUTLIER -82.76 -7.88 59.62 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.268 -0.895 . . . . 1.47 109.741 -179.893 . . . . . . . . 3 3 . 1 . 035 nuclear nobuild full ' C' C ' 355' ' ' ALA . . . . . . . . . . . . . . . -70.76 -36.08 72.93 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.229 -0.919 . . . . 0.93 109.564 179.992 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' C' C ' 356' ' ' GLY . . . . . . . . . . . . . . . -78.1 3.43 61.73 Favored Glycine 0 N--CA 1.491 2.328 0 N-CA-C 109.855 -1.298 . . . . 1.33 109.855 -179.785 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' C' C ' 357' ' ' LYS . . . . . . . . . . . . . 3.1 tptm -85.92 46.88 1.37 Allowed 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.172 -1.193 . . . . 4.01 109.616 -179.933 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' C' C ' 358' ' ' GLU . . . . . 0.492 ' HG2' ' HD2' ' C' ' 359' ' ' PRO . 1.0 OUTLIER -49.56 162.6 0.43 Allowed Pre-proline 0 N--CA 1.49 1.565 0 O-C-N 121.176 -0.952 . . . . 5.75 109.159 179.75 . . . . . . . . 3 3 . 1 . 035 nuclear nobuild full ' C' C ' 359' ' ' PRO . . . . . 0.492 ' HD2' ' HG2' ' C' ' 358' ' ' GLU . 4.1 Cg_exo -60.42 -158.12 0.02 OUTLIER 'Trans proline' 0 C--N 1.309 -1.549 0 C-N-CA 121.932 1.755 . . . . 4.94 109.937 179.928 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' C' C ' 360' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.293 0 CA-C-O 118.058 -1.412 . . . . 6.5 109.589 179.959 . . . . . . . . 0 0 . 1 . 035 nuclear nobuild full ' D' D ' 319' ' ' LYS . . . . . 0.462 ' O ' ' O ' ' D' ' 320' ' ' LYS . 18.9 ttpt . . . . . 0 N--CA 1.491 1.583 0 N-CA-C 109.387 -0.597 . . . . 7.53 109.387 . . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' D' D ' 320' ' ' LYS . . . . . 0.462 ' O ' ' O ' ' D' ' 319' ' ' LYS . 13.7 mttp 58.54 113.98 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.359 -0.838 . . . . 6.41 109.354 -179.827 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' D' D ' 321' ' ' LYS . . . . . 0.592 ' CB ' ' CD ' ' D' ' 322' ' ' PRO . 0.0 OUTLIER -160.41 -64.8 0.02 OUTLIER Pre-proline 0 N--CA 1.492 1.642 0 O-C-N 121.364 -0.835 . . . . 6.11 109.806 179.871 . . . . . . . . 3 3 . 1 . 035 nuclear nobuild full ' D' D ' 322' ' ' PRO . . . . . 0.592 ' CD ' ' CB ' ' D' ' 321' ' ' LYS . 6.2 Cg_exo -54.55 174.2 0.2 Allowed 'Trans proline' 0 C--N 1.315 -1.217 0 C-N-CA 121.644 1.563 . . . . 2.82 109.958 179.71 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' D' D ' 323' ' ' LEU . . . . . . . . . . . . . 47.5 mt -79.38 142.03 36.37 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.161 -0.962 . . . . 2.83 109.612 -179.735 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' D' D ' 324' ' ' ASP . . . . . . . . . . . . . 70.5 m-20 -78.64 160.75 27.38 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.274 -0.891 . . . . 1.54 109.274 -179.975 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' D' D ' 325' ' ' GLY . . . . . . . . . . . . . . . -67.21 174.78 26.0 Favored Glycine 0 N--CA 1.489 2.233 0 N-CA-C 109.448 -1.461 . . . . 0.59 109.448 -179.822 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' D' D ' 326' ' ' GLU . . . . . . . . . . . . . 2.1 mt-10 -57.3 -176.15 0.02 OUTLIER 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.339 -1.095 . . . . 2.13 109.355 -179.936 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' D' D ' 327' ' ' TYR . . . . . 0.473 ' CE1' ' HG2' ' B' ' 333' ' ' ARG . 47.0 m-85 -148.91 108.65 4.02 Favored 'General case' 0 N--CA 1.488 1.444 0 O-C-N 121.318 -0.864 . . . . 0.47 109.453 -179.934 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' D' D ' 328' ' ' PHE . . . . . 0.415 ' CZ ' ' HG3' ' B' ' 335' ' ' ARG . 88.7 m-85 -113.47 -169.02 1.42 Allowed 'General case' 0 N--CA 1.489 1.481 0 O-C-N 121.356 -0.84 . . . . 0.3 109.103 179.936 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' D' D ' 329' ' ' THR . . . . . . . . . . . . . 31.1 p -152.44 168.18 26.32 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.208 -0.932 . . . . 0.22 109.336 -179.968 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' D' D ' 330' ' ' LEU . . . . . 0.601 HD11 HD22 ' B' ' 345' ' ' ASN . 38.5 tp -149.96 127.2 11.34 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.197 -0.94 . . . . 0.28 109.642 -179.667 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' D' D ' 331' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -87.83 114.56 24.55 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.312 -0.868 . . . . 0.93 109.299 179.604 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' D' D ' 332' ' ' ILE . . . . . 0.666 HD12 ' HD1' ' D' ' 338' ' ' PHE . 21.9 mt -103.29 112.88 38.41 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.55 0 O-C-N 121.121 -0.987 . . . . 0.25 109.493 179.925 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' D' D ' 333' ' ' ARG . . . . . . . . . . . . . 2.3 mtt180 -72.43 145.23 47.77 Favored 'General case' 0 N--CA 1.488 1.445 0 O-C-N 121.141 -0.974 . . . . 2.93 109.365 179.938 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' D' D ' 334' ' ' GLY . . . . . . . . . . . . . . . 83.08 127.57 1.2 Allowed Glycine 0 N--CA 1.49 2.271 0 N-CA-C 109.608 -1.397 . . . . 0.41 109.608 179.861 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' D' D ' 335' ' ' ARG . . . . . 0.49 ' HG3' ' CZ ' ' B' ' 328' ' ' PHE . 0.4 OUTLIER -74.75 -35.23 62.62 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.225 -1.162 . . . . 3.03 109.466 179.953 . . . . . . . . 3 3 . 1 . 035 nuclear nobuild full ' D' D ' 336' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -58.02 -59.29 5.5 Favored 'General case' 0 N--CA 1.489 1.484 0 O-C-N 121.253 -0.904 . . . . 2.26 109.522 179.956 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' D' D ' 337' ' ' ARG . . . . . 0.761 ' NH2' HD12 ' B' ' 348' ' ' LEU . 6.2 mmt180 -60.73 -31.77 71.06 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.317 -0.865 . . . . 2.92 109.426 -179.97 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' D' D ' 338' ' ' PHE . . . . . 0.666 ' HD1' HD12 ' D' ' 332' ' ' ILE . 52.9 t80 -55.19 -55.9 26.05 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.234 -0.916 . . . . 0.37 109.517 179.927 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' D' D ' 339' ' ' GLU . . . . . . . . . . . . . 5.0 mt-10 -51.94 -33.06 35.78 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.261 -0.899 . . . . 1.99 109.893 -179.755 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' D' D ' 340' ' ' MET . . . . . . . . . . . . . 21.1 ttp -63.53 -52.51 60.86 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.262 -0.898 . . . . 0.31 110.12 -179.422 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' D' D ' 341' ' ' PHE . . . . . 0.569 ' CZ ' ' HA ' ' B' ' 345' ' ' ASN . 57.0 m-85 -62.38 -43.17 99.45 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.137 -0.977 . . . . 0.18 110.016 -179.515 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' D' D ' 342' ' ' ARG . . . . . 0.447 ' NH1' ' CG ' ' D' ' 342' ' ' ARG . 0.0 OUTLIER -50.77 -46.47 59.49 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.229 -0.92 . . . . 2.41 110.017 -179.657 . . . . . . . . 3 3 . 1 . 035 nuclear nobuild full ' D' D ' 343' ' ' GLU . . . . . . . . . . . . . 4.7 tt0 -59.12 -43.71 91.96 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.181 -0.949 . . . . 2.35 109.887 -179.636 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' D' D ' 344' ' ' LEU . . . . . . . . . . . . . 54.4 mt -62.18 -36.54 82.19 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.175 -0.953 . . . . 0.19 109.783 -179.79 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' D' D ' 345' ' ' ASN . . . . . 0.695 HD22 HD11 ' B' ' 330' ' ' LEU . 56.5 t-20 -58.61 -55.43 35.17 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.243 -0.911 . . . . 1.09 109.664 -179.824 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' D' D ' 346' ' ' GLU . . . . . . . . . . . . . 3.3 tt0 -60.52 -29.44 69.11 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.193 -0.942 . . . . 1.69 109.534 -179.777 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' D' D ' 347' ' ' ALA . . . . . 0.496 ' HB1' ' HB1' ' C' ' 347' ' ' ALA . . . -60.91 -58.84 6.74 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.154 -0.966 . . . . 0.18 109.885 -179.943 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' D' D ' 348' ' ' LEU . . . . . 0.58 HD12 ' NH2' ' B' ' 337' ' ' ARG . 4.0 mm? -61.53 -45.82 92.55 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.212 -0.93 . . . . 0.31 109.9 -179.557 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' D' D ' 349' ' ' GLU . . . . . . . . . . . . . 3.9 mm-40 -55.51 -34.17 64.41 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.273 -0.892 . . . . 1.95 109.607 -179.622 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' D' D ' 350' ' ' LEU . . . . . 0.637 HD13 HD22 ' C' ' 350' ' ' LEU . 6.1 tt -63.44 -45.79 89.31 Favored 'General case' 0 N--CA 1.489 1.484 0 O-C-N 121.273 -0.892 . . . . 0.43 109.069 179.701 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' D' D ' 351' ' ' LYS . . . . . . . . . . . . . 30.2 tttt -59.77 -45.74 91.34 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.402 -0.811 . . . . 1.4 109.664 -179.942 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' D' D ' 352' ' ' ASP . . . . . . . . . . . . . 7.6 m-20 -54.91 -49.85 70.25 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.293 -0.879 . . . . 1.17 109.845 -179.766 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' D' D ' 353' ' ' ALA . . . . . . . . . . . . . . . -67.22 -23.88 65.77 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.198 -0.939 . . . . 0.59 109.651 -179.731 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' D' D ' 354' ' ' GLN . . . . . 0.478 ' NE2' HD11 ' C' ' 350' ' ' LEU . 1.2 tt0 -84.46 -8.02 59.09 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.249 -0.907 . . . . 1.44 109.728 -179.889 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' D' D ' 355' ' ' ALA . . . . . . . . . . . . . . . -71.51 -35.64 70.81 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.273 -0.892 . . . . 0.98 109.749 -179.752 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' D' D ' 356' ' ' GLY . . . . . . . . . . . . . . . -78.58 -2.57 85.32 Favored Glycine 0 N--CA 1.49 2.289 0 N-CA-C 109.675 -1.37 . . . . 1.28 109.675 -179.84 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' D' D ' 357' ' ' LYS . . . . . . . . . . . . . 16.7 mttt -89.04 112.78 23.8 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.272 -1.134 . . . . 4.09 109.633 -179.914 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' D' D ' 358' ' ' GLU . . . . . . . . . . . . . 21.8 pt-20 -49.51 154.53 1.57 Allowed Pre-proline 0 N--CA 1.491 1.581 0 O-C-N 121.114 -0.991 . . . . 5.71 109.272 179.803 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' D' D ' 359' ' ' PRO . . . . . . . . . . . . . 2.3 Cg_endo -62.28 140.59 83.82 Favored 'Trans proline' 0 C--N 1.31 -1.47 0 C-N-CA 122.165 1.91 . . . . 4.97 110.152 179.947 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' D' D ' 360' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.299 0 CA-C-O 117.964 -1.464 . . . . 6.97 109.448 179.888 . . . . . . . . 0 0 . 1 stop_ save_